NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 P 4.6471 0.0000 0.0000 62.5642 33.6694 174.6118 12 V 4.7676 8.7997 114.1898 59.3255 35.6140 173.3428 13 L 5.1556 10.0385 123.5927 53.2102 45.2687 175.7072 14 L 5.1151 8.7149 121.4063 53.1784 44.3477 174.9603 15 K 4.8667 8.9638 126.3812 54.0801 34.8239 175.1309 16 S 3.9676 8.9952 123.6212 58.5252 62.5390 174.8675 17 T 3.7900 8.2548 118.9051 64.6269 68.6755 175.9233 18 E 4.0091 8.1909 122.2351 57.9955 29.8912 176.8921 19 T 4.3156 7.5489 106.1442 60.3394 70.3381 175.2070 20 G 3.7323 8.1732 109.8629 45.6311 0.0000 173.1818 21 Q 4.4241 7.3583 119.2046 55.1888 30.4049 174.7335 22 Y 4.9898 9.0111 121.5302 56.9136 39.4170 174.8940 23 L 4.6561 9.1972 126.3570 55.3794 43.8088 175.6597 24 R 5.1211 9.2676 125.5825 54.8010 33.4911 173.5487 25 I 4.8262 7.8850 126.4037 59.8717 38.2676 175.6714 26 N 4.5523 8.9896 125.4362 51.7548 39.3880 174.8432 27 P 4.1558 0.0000 0.0000 65.4822 31.4769 177.2239 28 D 4.5028 7.9594 115.2252 53.5661 39.7831 177.0920 29 G 4.2797 8.4860 110.6549 45.1395 0.0000 173.8629 30 T 4.5153 8.2304 110.4364 61.5000 70.5208 173.8040 31 V 4.9861 8.2147 122.0208 61.4775 34.4239 174.1273 32 D 4.8080 9.1450 126.1899 52.6623 42.9801 173.8079 33 G 4.5895 8.8062 105.2747 45.2242 0.0000 172.8860 34 T 4.8490 8.9239 115.0760 60.4338 71.3263 174.2461 35 R 4.5187 8.6557 124.3624 56.0211 30.6441 175.9091 36 D 4.6930 8.1325 120.0269 52.9501 40.6730 177.3759 37 R 3.7861 8.5887 127.1026 58.6454 30.2710 177.9231 38 S 4.4169 8.2997 110.8501 57.9545 63.4862 173.9151 39 D 4.3358 7.6201 121.9419 55.1315 41.1257 176.1336 40 Q 4.1933 8.6070 123.8302 57.2785 29.2663 175.8912 41 H 4.8220 8.8483 115.1836 55.3502 30.0401 174.5088 42 I 4.6429 7.5725 110.6141 60.0759 38.4330 175.3098 43 Q 4.5188 7.5694 121.7765 55.8031 29.9503 174.8778 44 F 5.3195 9.4449 122.0385 55.6377 43.4031 173.6372 45 Q 4.9289 9.3470 122.4013 54.5060 31.4789 174.1727 46 I 4.9303 8.4559 127.3183 60.0387 38.5838 175.1531 47 S 4.8975 8.7868 121.4713 55.6493 66.3601 171.8935 48 P 4.8086 0.0000 0.0000 62.6635 32.0564 175.6370 49 E 4.2649 9.0942 124.6456 54.6001 31.5682 175.4063 50 G 3.9403 8.7834 119.5062 46.8510 0.0000 173.6737 51 G 3.8371 8.8272 108.3553 46.4585 0.0000 174.0984 52 G 4.0472 8.0204 104.8288 44.7412 0.0000 171.6454 53 E 4.9535 7.7804 117.8570 54.6211 33.3323 175.0692 54 V 5.0582 8.8626 113.1737 59.9254 36.5141 174.8316 55 L 5.1451 9.0290 122.0797 53.2341 44.7895 176.0011 56 L 4.8028 8.7223 121.6367 53.1819 44.1145 174.9398 57 K 4.9028 9.0006 126.2982 54.0718 35.0675 175.1966 58 S 4.0476 8.9763 123.4437 58.5282 62.6004 174.9431 59 T 3.8913 8.3356 118.5760 64.6607 68.6486 175.8806 60 E 4.1524 8.1747 120.4316 57.6461 29.9677 177.0461 61 T 4.2955 7.6269 106.6136 60.4182 70.4540 175.4835 62 G 3.7515 8.0863 109.4126 45.3887 0.0000 173.3884 63 Q 4.3416 7.5033 118.8019 55.5543 30.3911 174.6978 64 Y 5.0459 8.8715 120.9023 56.6294 40.1035 174.9298 65 L 4.7291 9.0963 126.0496 55.3317 43.7431 175.6303 66 R 4.9627 9.2347 125.6081 54.7358 33.5731 173.6053 67 I 4.8073 8.0991 127.1927 59.7706 38.4113 175.7185 68 N 4.5588 9.1678 125.5829 51.8287 39.3615 174.6243 69 P 4.1788 0.0000 0.0000 65.8078 31.4158 177.3755 70 D 4.4800 7.9520 114.6358 53.8131 39.7410 177.0296 71 G 4.3216 8.4941 110.5168 45.0281 0.0000 173.7800 72 T 4.4461 8.2409 110.5696 61.5611 70.3977 173.7263 73 V 5.0636 8.2744 122.4681 61.4411 34.3644 174.0921 74 D 4.7953 9.0889 126.2088 52.5334 43.2605 173.7076 75 G 4.5649 8.8707 105.5863 45.1245 0.0000 173.0678 76 T 4.8550 8.9086 115.8746 60.3779 71.3475 174.2375 76A R 4.5234 8.6068 124.1150 56.0060 30.7697 176.3098 77 D 4.5847 8.2399 120.0341 53.2139 39.9057 176.8505 78 R 3.9113 8.4575 127.4438 58.2396 30.3292 177.3689 79 S 4.3422 8.1895 110.8820 59.2533 63.6444 174.1414 80 D 4.3776 7.7814 122.0133 54.9018 41.2544 175.7065 81 Q 4.4077 8.6068 123.6334 56.5149 29.1941 175.6460 82 H 4.7009 8.8406 115.7427 55.4647 29.0239 175.3818 83 I 4.7617 7.0771 109.7198 59.9619 38.3569 175.2415 84 Q 4.6406 7.5126 121.4908 55.2802 30.2497 174.6851 85 F 5.2807 9.3580 121.8296 55.7608 43.5061 173.7956 86 Q 4.9534 9.2760 120.4686 54.3547 31.3497 174.6326 87 I 4.9044 8.4136 124.5326 59.9123 38.8590 175.0506 88 S 4.8184 8.8824 122.3658 55.5972 65.2245 172.1697 89 P 4.6743 0.0000 0.0000 62.9350 31.3396 176.0184 90 E 4.3799 9.4533 120.6443 55.3325 31.8638 176.5892 91 G 3.7282 7.9506 106.9553 48.6786 0.0000 173.0549 92 G 4.0092 9.0254 114.4937 45.5149 0.0000 173.7518 93 G 3.9024 8.3354 104.9931 45.4740 0.0000 173.5727 94 E 5.0591 7.7747 118.2937 54.5851 32.5488 175.3094 95 V 5.0297 9.0142 114.7920 59.8506 36.5734 174.4580 96 L 5.0897 9.0727 122.1987 53.3118 44.7113 176.0479 97 L 5.0028 8.6989 121.5698 53.1854 44.1291 174.8373 98 K 4.7916 8.9261 126.4458 54.2564 34.5871 175.1031 99 S 4.0739 8.8991 123.9683 58.0262 62.5561 175.1002 100 T 3.8079 8.2264 118.7792 64.5079 68.8893 175.5380 101 E 3.9456 8.0095 122.2971 58.2441 29.7203 176.9699 102 T 4.3393 7.5327 104.9773 60.2953 70.2627 174.3652 103 G 3.6077 7.9616 110.5789 46.6307 0.0000 172.8701 *107 Q 4.7390 7.5589 117.1480 55.8193 30.6529 173.8797 108 Y 4.9733 8.9470 121.1907 56.7584 39.8828 174.9016 109 L 4.6426 9.0508 126.2670 55.4223 43.6846 175.6395 110 R 4.9800 9.3122 125.7433 54.6939 33.6284 173.5844 111 I 4.9525 8.0386 126.9987 59.7021 38.8249 175.5601 112 N 4.5628 9.1492 125.3708 51.6907 39.4774 174.5959 113 P 4.1626 0.0000 0.0000 65.7367 31.4483 177.2681 114 D 4.4898 7.9668 114.7637 53.6895 39.6748 177.0910 115 G 4.2556 8.5257 110.5192 45.1096 0.0000 173.7997 116 T 4.5005 8.1973 110.4937 61.5254 70.4641 173.7704 117 V 5.0657 8.1823 122.0147 61.4903 34.5511 174.0808 118 D 4.7880 9.0890 125.9028 52.8242 43.1890 173.7473 119 G 4.7921 8.9114 105.1066 44.7387 0.0000 172.7078 *123 T 4.7749 8.1063 115.1347 62.1229 68.7432 174.4654 123A R 4.3495 8.7116 124.0659 56.5275 30.8655 176.5771 124 D 4.6002 8.2156 119.6116 53.0092 39.9126 176.5974 125 R 3.5639 8.4846 127.4369 58.1917 30.2713 177.2271 126 S 4.4016 7.9827 110.6342 58.3855 63.4597 173.8925 127 D 4.3381 7.9301 123.1887 54.9003 41.1945 176.1558 128 Q 4.3768 8.6068 124.3134 56.6688 28.6293 175.8956 129 H 4.7478 8.8565 114.8627 55.5399 29.5615 174.7808 130 I 4.7991 7.1514 110.9422 60.1539 38.5719 175.7160 131 Q 4.5115 7.6838 123.5504 55.7457 30.0439 174.8561 132 F 5.3015 9.3797 122.1783 55.6130 43.4027 173.6433 133 Q 4.9329 9.3132 122.6021 54.5096 31.3819 174.1874 134 I 4.9460 8.4381 127.3887 60.1295 38.6428 175.2392 135 S 4.8034 8.9370 121.2665 55.6810 66.3634 171.8416 136 P 4.8513 0.0000 0.0000 62.5273 32.0257 176.2668 137 E 4.2214 8.4013 120.5309 56.4255 29.6924 175.7196 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 11 P 0.00 4.65 0.00 2.08 2.04 0.00 3.49 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.11 0.00 12 V 8.80 4.77 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 0.77 0.00 0.00 1.05 0.00 0.00 13 L 10.04 5.16 0.00 1.69 1.70 0.66 0.84 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 14 L 8.71 5.12 0.00 1.36 1.34 -0.27 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.96 4.87 0.00 1.83 1.63 0.00 1.29 0.00 0.00 1.31 0.00 0.00 2.78 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.05 0.59 7.81 16 S 9.00 3.97 0.00 3.48 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 17 T 8.25 3.79 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 1.20 0.00 0.00 18 E 8.19 4.01 0.00 1.84 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 2.16 2.29 0.00 19 T 7.55 4.32 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 1.21 0.00 0.00 20 G 8.17 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 21 Q 7.36 4.42 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 6.87 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 22 Y 9.01 4.99 0.00 3.12 2.95 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 23 L 9.20 4.66 0.00 1.88 1.66 1.04 0.45 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 24 R 9.27 5.12 0.00 1.98 2.09 0.00 3.21 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 25 I 7.89 4.83 1.77 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 1.37 0.81 0.91 0.00 0.00 26 N 8.99 4.55 0.00 2.87 2.66 0.00 0.00 6.57 8.83 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 27 P 0.00 4.16 0.00 1.98 2.08 0.00 3.51 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.96 0.00 28 D 7.96 4.50 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 29 G 8.49 4.28 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 0.00 30 T 8.23 4.52 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 31 V 8.21 4.99 2.31 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 1.02 0.00 0.00 0.99 0.00 0.00 32 D 9.15 4.81 0.00 2.96 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.81 4.59 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 0.00 34 T 8.92 4.85 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 1.34 0.00 0.00 35 R 8.66 4.52 0.00 1.88 1.97 0.00 3.25 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 1.54 1.61 0.00 36 D 8.13 4.69 0.00 2.81 2.61 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 37 R 8.59 3.79 0.00 1.84 1.91 0.00 2.62 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.60 0.00 38 S 8.30 4.42 0.00 3.94 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 39 D 7.62 4.34 0.00 2.82 2.61 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 40 Q 8.61 4.19 0.00 1.80 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.11 0.00 0.00 0.00 0.00 0.00 2.31 2.26 0.00 41 H 8.85 4.82 0.00 3.30 3.35 0.00 5.79 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.57 4.64 1.95 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.08 0.99 0.00 0.00 43 Q 7.57 4.52 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 44 F 9.44 5.32 0.00 3.05 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 45 Q 9.35 4.93 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 46 I 8.46 4.93 1.89 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 1.36 0.72 0.92 0.00 0.00 47 S 8.79 4.90 0.00 3.93 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 48 P 0.00 4.81 0.00 1.97 2.03 0.00 3.64 0.00 0.00 3.61 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 49 E 9.09 4.26 0.00 2.01 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 2.14 2.23 0.00 50 G 8.78 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 51 G 8.83 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 52 G 8.02 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 0.00 0.00 0.00 53 E 7.78 4.95 0.00 2.11 1.85 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 2.20 2.23 0.00 54 V 8.86 5.06 2.19 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 0.79 0.00 0.00 0.98 0.00 0.00 55 L 9.03 5.15 0.00 1.72 1.74 0.67 0.55 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 56 L 8.72 4.80 0.00 1.40 1.34 -0.18 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 57 K 9.00 4.90 0.00 1.86 1.78 0.00 1.51 0.00 0.00 1.51 0.00 0.00 2.63 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.10 0.70 7.81 58 S 8.98 4.05 0.00 3.54 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 59 T 8.34 3.89 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 1.14 0.00 0.00 60 E 8.17 4.15 0.00 1.88 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 2.18 2.26 0.00 61 T 7.63 4.30 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 1.19 0.00 0.00 62 G 8.09 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 7.50 4.34 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.28 0.00 64 Y 8.87 5.05 0.00 3.14 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 65 L 9.10 4.73 0.00 2.01 1.65 1.04 0.59 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 66 R 9.23 4.96 0.00 1.98 2.08 0.00 3.24 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 67 I 8.10 4.81 1.82 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.91 0.94 0.00 0.00 68 N 9.17 4.56 0.00 2.92 2.67 0.00 0.00 6.56 7.60 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 69 P 0.00 4.18 0.00 2.00 2.11 0.00 3.54 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.03 0.00 70 D 7.95 4.48 0.00 2.76 2.77 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 71 G 8.49 4.32 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 0.00 72 T 8.24 4.45 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 73 V 8.27 5.06 2.32 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 0.99 0.00 0.00 0.98 0.00 0.00 74 D 9.09 4.80 0.00 2.95 2.77 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 75 G 8.87 4.56 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 0.00 0.00 0.00 76 T 8.91 4.85 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 1.34 0.00 0.00 76A R 8.61 4.52 0.00 1.86 1.97 0.00 3.25 0.00 0.00 3.11 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.57 0.00 77 D 8.24 4.58 0.00 2.80 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 R 8.46 3.91 0.00 1.85 1.95 0.00 2.93 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 79 S 8.19 4.34 0.00 4.01 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 80 D 7.78 4.38 0.00 2.77 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 81 Q 8.61 4.41 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.11 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 82 H 8.84 4.70 0.00 3.32 3.42 0.00 5.78 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.08 4.76 1.94 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.43 0.98 0.00 0.00 84 Q 7.51 4.64 0.00 1.93 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 85 F 9.36 5.28 0.00 2.96 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 86 Q 9.28 4.95 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 87 I 8.41 4.90 1.89 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 1.37 0.54 0.91 0.00 0.00 88 S 8.88 4.82 0.00 3.91 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 89 P 0.00 4.67 0.00 1.97 2.04 0.00 3.64 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 90 E 9.45 4.38 0.00 2.01 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 2.23 2.34 0.00 91 G 7.95 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 92 G 9.03 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 0.00 0.00 0.00 93 G 8.34 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 94 E 7.77 5.06 0.00 1.91 1.85 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 2.29 2.30 0.00 95 V 9.01 5.03 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 0.79 0.00 0.00 1.03 0.00 0.00 96 L 9.07 5.09 0.00 1.71 1.76 0.65 0.68 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 97 L 8.70 5.00 0.00 1.35 1.31 -0.20 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.93 4.79 0.00 1.80 1.63 0.00 1.44 0.00 0.00 1.47 0.00 0.00 2.61 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.06 0.55 7.81 99 S 8.90 4.07 0.00 3.54 3.50 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 0.00 100 T 8.23 3.81 4.15 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 0.00 0.00 0.00 1.18 0.00 0.00 101 E 8.01 3.95 0.00 1.84 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 1.76 2.21 0.00 102 T 7.53 4.34 4.21 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 1.23 0.00 0.00 103 G 7.96 3.61 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 0.00 *107 Q 7.56 4.74 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.25 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 108 Y 8.95 4.97 0.00 3.10 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 0.00 109 L 9.05 4.64 0.00 1.85 1.59 1.03 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 110 R 9.31 4.98 0.00 1.98 2.11 0.00 3.14 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 111 I 8.04 4.95 1.81 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.89 0.97 0.00 0.00 112 N 9.15 4.56 0.00 2.93 2.66 0.00 0.00 6.55 7.59 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 0.00 113 P 0.00 4.16 0.00 2.00 2.11 0.00 3.54 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.05 0.00 114 D 7.97 4.49 0.00 2.76 2.77 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 0.00 115 G 8.53 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 0.00 0.00 0.00 116 T 8.20 4.50 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 0.00 117 V 8.18 5.07 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 1.02 0.00 0.00 1.02 0.00 0.00 118 D 9.09 4.79 0.00 3.03 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.91 4.79 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 0.00 0.00 0.00 *123 T 8.11 4.77 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 1.39 0.00 0.00 123A R 8.71 4.35 0.00 1.89 2.01 0.00 3.27 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.63 0.00 124 D 8.22 4.60 0.00 2.81 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.48 3.56 0.00 1.82 1.89 0.00 3.33 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.06 0.00 126 S 7.98 4.40 0.00 4.00 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 0.00 127 D 7.93 4.34 0.00 2.88 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 0.00 128 Q 8.61 4.38 0.00 1.89 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 129 H 8.86 4.75 0.00 3.37 3.39 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 7.15 4.80 1.98 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.38 0.99 0.00 0.00 131 Q 7.68 4.51 0.00 1.95 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.83 0.00 0.00 0.00 0.00 0.00 2.51 2.41 0.00 132 F 9.38 5.30 0.00 2.86 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 0.00 133 Q 9.31 4.93 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 134 I 8.44 4.95 1.89 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 1.36 0.72 0.92 0.00 0.00 135 S 8.94 4.80 0.00 3.90 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 0.00 136 P 0.00 4.85 0.00 1.97 2.04 0.00 3.68 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 137 E 8.40 4.22 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 2.20 2.41 0.00 * Residues marked with a * may have inaccurate shift predictions.