NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.8259 8.4093 118.1236 52.3627 41.0943 173.6358 2 F 4.9576 7.1535 113.1142 55.5188 41.5880 171.2575 3 M 4.8002 10.1347 120.6099 53.6521 36.0834 176.1636 4 L 5.3622 8.4759 120.3785 53.3966 44.6886 175.3931 5 T 4.9150 9.1404 115.2882 60.0659 71.1189 173.6738 6 Q 5.4306 8.8053 122.5361 52.0496 32.7725 173.4261 7 P 4.4911 0.0000 0.0000 61.9926 32.3179 174.9336 8 P 4.7647 0.0000 0.0000 65.5219 32.4566 175.9182 9 S 5.5310 8.0226 113.0756 55.8217 66.9947 173.5055 *11 V 4.2135 8.4596 119.5474 62.1594 32.7626 174.2925 12 S 5.5296 8.1477 115.3365 57.4455 66.0785 172.3909 13 E 4.7242 8.2741 119.5818 55.6499 32.9432 174.7069 14 S 4.7349 8.8503 120.3938 57.0868 64.5126 172.3787 15 P 4.4189 0.0000 0.0000 64.4993 31.4603 177.3615 16 G 3.8790 9.3223 110.9348 45.3447 0.0000 173.5290 17 K 4.4223 7.4872 119.1515 55.7605 34.7499 175.1983 18 T 5.1053 8.2565 117.0395 61.9977 70.7522 174.7186 19 V 4.4656 8.4046 124.6539 60.1195 34.8444 174.4508 20 T 4.9164 8.4475 119.1568 61.7748 71.4077 173.4281 21 I 4.5575 8.5156 126.7266 59.5284 39.5982 175.0874 22 S 5.2308 8.7290 121.8178 57.4966 65.8976 173.9430 23 C 5.2918 9.4783 121.1679 55.6692 43.9924 172.5297 24 T 5.1040 9.0639 124.2355 61.7324 70.7640 173.5584 25 R 4.8648 8.5369 127.9234 55.4982 30.2965 176.5441 26 S 4.5481 8.9854 122.3853 61.0449 63.8081 174.8971 27 S 4.4830 7.9933 112.4462 57.7160 65.5247 174.7035 27A G 3.9599 8.6523 106.9213 45.5506 0.0000 172.7080 28A S 4.4968 7.9889 113.4094 56.9790 63.0607 174.8533 28 I 3.4659 8.8649 127.6724 64.0903 37.7830 177.3722 29 A 3.9320 7.5010 121.1658 53.6008 18.5423 178.4938 30 S 4.2236 7.6642 112.0916 60.9807 63.0644 174.4661 31 N 5.0338 7.3320 114.6226 51.1817 42.4920 173.8876 32 Y 4.5976 8.4826 118.2132 58.3906 38.8659 175.6109 33 V 4.5131 9.2170 123.7891 61.5811 33.7559 174.5748 34 Q 5.1386 8.8276 126.1935 53.8639 32.2224 174.4417 35 W 5.3490 9.0656 121.9794 55.1829 32.6769 174.2536 36 Y 5.3758 9.5599 120.9997 56.3611 41.5801 174.1521 37 Q 4.5618 9.3695 124.2941 54.5269 31.4817 174.0350 38 Q 4.8076 9.0213 127.1632 54.4707 32.0794 174.4337 39 R 4.6415 8.5017 125.3629 54.2925 32.3575 174.4739 40 P 4.3475 0.0000 0.0000 64.4230 31.6540 177.2600 41 G 3.9350 9.0584 110.8376 45.4290 0.0000 172.7355 42 S 4.7680 7.5275 114.7144 56.1686 65.8188 173.6099 43 S 4.5193 8.1754 116.3244 57.1573 64.1708 172.2260 44 P 4.6919 0.0000 0.0000 63.0709 32.0335 175.9807 45 T 4.7389 9.1067 120.9617 61.7372 71.1802 173.8904 46 T 4.2388 8.8892 123.6213 64.2697 68.3432 174.3559 47 V 4.1548 8.7925 119.9759 62.0850 33.6725 176.6095 48 I 5.0826 7.6843 119.7328 59.6416 41.6070 174.0933 49 Y 4.9790 8.4307 123.1715 54.7441 41.9689 174.4297 50 E 3.2483 9.8429 117.2190 57.5300 27.3677 175.4747 51 D 5.1718 9.4851 125.6923 55.1565 40.6268 176.9359 52 N 4.9713 7.6613 109.9079 53.0951 38.9220 173.3241 53 Q 4.2222 7.9227 119.2175 54.6522 29.8917 174.9383 54 R 4.7731 8.1814 122.0808 54.3419 31.6585 174.8497 55 P 4.6801 0.0000 0.0000 61.9376 32.1915 175.6805 56 S 4.2953 8.3821 114.9180 59.9530 62.5967 174.7418 57 G 3.9269 8.9617 115.2652 45.2644 0.0000 173.1276 58 V 3.9587 7.3150 120.1250 60.7457 32.3674 174.0765 59 P 4.5632 0.0000 0.0000 62.5568 31.8826 176.6551 60 D 4.6749 8.5754 118.0536 54.5939 39.7505 177.2654 61 R 3.9988 8.0177 119.8470 58.3382 31.2413 176.1290 62 F 4.9969 8.1749 118.1693 56.0767 40.0713 175.9207 63 S 4.7161 9.1773 118.1807 56.5054 66.6692 173.1328 64 G 4.5425 8.8907 107.9326 43.8453 0.0000 171.9993 65 S 4.9540 8.7868 116.0565 56.8649 67.4345 172.5441 66 I 4.9711 8.2369 119.4166 59.7151 40.7984 175.2011 66A D 4.8410 9.5293 126.6621 52.0506 42.1357 176.2319 67A S 4.2359 8.6646 121.3564 60.6413 63.5139 177.2677 67 S 4.1542 8.0584 115.4353 60.7194 63.0963 174.8433 68 S 4.4453 7.9527 112.8076 57.1153 63.3513 173.2056 69 N 4.1517 7.8418 118.8631 55.0908 37.8507 173.1184 70 S 5.3793 8.1233 109.1711 56.4517 67.2242 173.0932 71 A 5.3757 9.1770 122.6352 50.5759 22.2186 175.7368 72 S 5.1866 9.2558 115.0528 56.6942 67.6410 172.8565 73 L 4.3506 8.0131 125.7665 53.3887 43.7466 174.9613 74 T 4.8090 8.7618 123.3383 61.7015 71.4757 173.3445 75 I 4.3730 8.4451 127.5481 59.5039 39.5660 175.3892 76 S 4.5163 8.7020 122.7313 56.0453 65.7111 173.9402 77 G 3.8763 8.3527 106.3170 45.6406 0.0000 174.1761 78 L 3.9652 7.7081 117.2285 55.2611 42.7739 177.5988 79 K 4.9682 8.7972 121.8974 54.3097 35.2109 177.5510 80 T 4.0201 8.3718 111.0554 64.3346 68.8709 176.1690 81 E 4.1212 8.1158 119.0619 58.5610 29.9360 177.6205 82 D 4.6508 8.0024 119.0485 56.3501 41.0878 175.9657 83 E 4.4530 8.1533 120.6731 56.4741 30.1012 176.0027 84 A 4.3062 8.2616 127.2643 52.0201 22.7412 173.8905 85 D 5.0933 8.2429 119.0071 53.7801 42.7974 175.7898 86 Y 5.2554 9.0167 120.7150 56.4564 40.8608 174.2295 87 Y 5.5277 9.2839 121.8082 56.3703 41.3207 173.0168 88 C 4.3684 8.9166 118.2227 54.9320 43.4406 172.3394 89 Q 4.7056 8.0252 119.9805 55.4283 32.5921 173.3412 90 S 4.3990 8.5942 119.9762 57.5218 66.0922 171.8455 91 Y 5.2218 8.6538 114.6999 56.6957 41.2883 174.9610 92 D 4.9775 8.9882 121.6700 53.5228 40.2899 176.6729 93 S 4.7222 8.5525 119.0330 59.0357 61.3107 170.3540 94 S 3.7732 8.4971 111.4740 59.7059 62.1470 174.3064 95 N 3.8228 6.9481 114.2223 52.0886 37.9106 172.7523 95A H 4.7799 7.9457 120.1758 55.3540 34.0182 173.7770 96 V 4.2694 8.6224 115.0195 60.7726 32.9161 175.6812 97 V 4.2355 8.3167 124.2629 61.0966 34.0277 174.0916 98 F 4.8969 8.7840 126.5135 55.6840 40.6130 176.1040 99 G 4.1790 9.2209 111.0593 45.8735 0.0000 174.1160 100 G 3.8662 8.8380 108.5172 46.4454 0.0000 175.0386 101 G 3.6671 8.9454 106.7247 45.6620 0.0000 172.8508 102 T 4.8602 8.4315 117.9258 61.3432 72.2886 172.8425 103 K 4.7573 9.1445 128.6149 55.1629 33.7054 174.7877 104 L 4.9306 8.9096 130.9329 54.1783 43.8286 174.9886 105 T 4.8019 8.6892 123.5337 61.9163 70.9121 173.6775 106 V 4.4902 8.6506 126.9623 61.3651 32.6157 175.7037 107 L 4.2888 8.7753 127.7916 55.0593 41.1377 177.0107 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 N 8.41 4.83 0.00 2.65 2.88 0.00 0.00 6.71 6.56 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 2 F 7.15 4.96 0.00 3.03 3.04 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 0.00 0.00 0.00 3 M 10.13 4.80 0.00 1.99 2.04 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 2.54 2.49 0.00 4 L 8.48 5.36 0.00 1.61 1.58 0.91 0.66 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 5 T 9.14 4.91 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 1.26 0.00 0.00 6 Q 8.81 5.43 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.98 0.00 0.00 0.00 0.00 0.00 2.59 2.25 0.00 7 P 0.00 4.49 0.00 2.20 2.08 0.00 3.97 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 8 P 0.00 4.76 0.00 2.16 2.38 0.00 3.68 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 2.09 1.99 0.00 9 S 8.02 5.53 0.00 3.90 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.46 4.21 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 0.79 0.00 0.00 0.89 0.00 0.00 12 S 8.15 5.53 0.00 3.89 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 13 E 8.27 4.72 0.00 2.02 1.71 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 2.31 2.29 0.00 14 S 8.85 4.73 0.00 3.77 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 15 P 0.00 4.42 0.00 2.02 1.99 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 16 G 9.32 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 0.00 0.00 0.00 17 K 7.49 4.42 0.00 1.74 1.72 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.64 7.81 18 T 8.26 5.11 4.17 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 1.15 0.00 0.00 19 V 8.40 4.47 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 0.72 0.00 0.00 0.85 0.00 0.00 20 T 8.45 4.92 4.17 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 1.12 0.00 0.00 21 I 8.52 4.56 1.57 0.00 0.00 0.63 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 0.56 1.12 0.00 0.00 22 S 8.73 5.23 0.00 3.98 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 23 C 9.48 5.29 0.00 3.01 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 24 T 9.06 5.10 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 1.28 0.00 0.00 25 R 8.54 4.86 0.00 1.71 1.71 0.00 2.45 0.00 0.00 2.95 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.15 0.00 26 S 8.99 4.55 0.00 3.99 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 27 S 7.99 4.48 0.00 3.97 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 27A G 8.65 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 28A S 7.99 4.50 0.00 3.81 3.66 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 28 I 8.86 3.47 1.97 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 1.24 1.03 0.89 0.00 0.00 29 A 7.50 3.93 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 30 S 7.66 4.22 0.00 3.88 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 31 N 7.33 5.03 0.00 2.54 2.84 0.00 0.00 7.06 7.34 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 32 Y 8.48 4.60 0.00 3.15 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 33 V 9.22 4.51 2.14 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 0.67 0.00 0.00 0.92 0.00 0.00 34 Q 8.83 5.14 0.00 1.97 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.52 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 35 W 9.07 5.35 0.00 3.23 3.18 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 0.00 0.00 0.00 0.00 36 Y 9.56 5.38 0.00 3.13 3.04 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 0.00 0.00 0.00 37 Q 9.37 4.56 0.00 2.07 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.06 1.68 0.00 38 Q 9.02 4.81 0.00 2.21 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.65 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 39 R 8.50 4.64 0.00 1.80 1.82 0.00 3.20 0.00 0.00 3.35 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 40 P 0.00 4.35 0.00 2.04 2.01 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 41 G 9.06 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 0.00 0.00 0.00 42 S 7.53 4.77 0.00 4.01 3.77 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 0.00 0.00 0.00 43 S 8.18 4.52 0.00 3.82 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 44 P 0.00 4.69 0.00 1.74 1.97 0.00 3.52 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.88 0.00 45 T 9.11 4.74 4.45 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 1.22 0.00 0.00 46 T 8.89 4.24 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 1.27 0.00 0.00 47 V 8.79 4.15 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 0.32 0.00 0.00 1.19 0.00 0.00 48 I 7.68 5.08 2.17 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 1.46 1.10 1.03 0.00 0.00 49 Y 8.43 4.98 0.00 3.00 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 50 E 9.84 3.25 0.00 1.61 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 1.47 1.94 0.00 51 D 9.49 5.17 0.00 2.95 2.94 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 52 N 7.66 4.97 0.00 2.74 2.97 0.00 0.00 5.96 7.39 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 53 Q 7.92 4.22 0.00 0.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.94 0.00 0.00 0.00 0.00 0.00 1.91 2.03 0.00 54 R 8.18 4.77 0.00 1.80 1.88 0.00 3.53 0.00 0.00 3.55 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 55 P 0.00 4.68 0.00 2.22 2.02 0.00 3.69 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 56 S 8.38 4.30 0.00 3.85 3.79 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 57 G 8.96 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 0.00 0.00 0.00 58 V 7.32 3.96 2.21 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 0.68 0.00 0.00 0.85 0.00 0.00 59 P 0.00 4.56 0.00 2.40 2.25 0.00 3.76 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.10 0.00 60 D 8.58 4.67 0.00 2.80 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 61 R 8.02 4.00 0.00 1.65 1.92 0.00 3.51 0.00 0.00 3.27 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 62 F 8.17 5.00 0.00 2.91 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 63 S 9.18 4.72 0.00 3.77 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 64 G 8.89 4.54 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 65 S 8.79 4.95 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 66 I 8.24 4.97 1.91 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 1.31 1.01 0.98 0.00 0.00 66A D 9.53 4.84 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67A S 8.66 4.24 0.00 4.03 4.10 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 67 S 8.06 4.15 0.00 4.00 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 68 S 7.95 4.45 0.00 4.02 4.01 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 69 N 7.84 4.15 0.00 2.89 2.82 0.00 0.00 6.69 8.98 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 70 S 8.12 5.38 0.00 4.05 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 71 A 9.18 5.38 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 72 S 9.26 5.19 0.00 3.70 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 73 L 8.01 4.35 0.00 0.27 0.13 0.66 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.76 4.81 4.09 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 1.07 0.00 0.00 75 I 8.45 4.37 1.48 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 0.59 0.32 0.09 0.00 0.00 76 S 8.70 4.52 0.00 3.79 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 77 G 8.35 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 0.00 0.00 0.00 78 L 7.71 3.97 0.00 1.73 1.60 0.91 0.69 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 79 K 8.80 4.97 0.00 1.82 1.68 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.47 7.81 80 T 8.37 4.02 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 1.22 0.00 0.00 81 E 8.12 4.12 0.00 2.16 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 2.34 2.42 0.00 82 D 8.00 4.65 0.00 2.92 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 83 E 8.15 4.45 0.00 1.99 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 0.00 2.36 2.33 0.00 84 A 8.26 4.31 1.10 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 0.00 0.00 85 D 8.24 5.09 0.00 2.64 2.21 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 86 Y 9.02 5.26 0.00 3.02 3.14 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 87 Y 9.28 5.53 0.00 3.36 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 88 C 8.92 4.37 0.00 1.92 1.18 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 0.00 0.00 0.00 0.00 89 Q 8.03 4.71 0.00 1.60 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.51 0.00 0.00 0.00 0.00 0.00 1.61 1.16 0.00 90 S 8.59 4.40 0.00 3.85 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 91 Y 8.65 5.22 0.00 3.01 2.82 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 92 D 8.99 4.98 0.00 2.90 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 93 S 8.55 4.72 0.00 4.15 4.41 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 94 S 8.50 3.77 0.00 3.85 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 95 N 6.95 3.82 0.00 2.75 2.93 0.00 0.00 6.97 7.89 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 95A H 7.95 4.78 0.00 3.41 3.09 0.00 5.68 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 96 V 8.62 4.27 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 0.76 0.00 0.00 0.80 0.00 0.00 97 V 8.32 4.24 1.71 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 0.82 0.00 0.00 0.34 0.00 0.00 98 F 8.78 4.90 0.00 2.90 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 99 G 9.22 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.84 3.87 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 0.00 101 G 8.95 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 0.00 102 T 8.43 4.86 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 1.30 0.00 0.00 103 K 9.14 4.76 0.00 2.02 1.84 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.44 7.81 104 L 8.91 4.93 0.00 1.91 1.94 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 105 T 8.69 4.80 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 1.22 0.00 0.00 106 V 8.65 4.49 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 0.75 0.00 0.00 1.00 0.00 0.00 107 L 8.78 4.29 0.00 1.53 1.56 0.91 0.73 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 * Residues marked with a * may have inaccurate shift predictions.