NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 5.0760 0.0000 0.0000 62.3631 33.3779 174.6897 2 L 5.1722 8.0861 123.5126 51.2123 43.7034 174.4116 3 R 4.7312 9.5749 120.4466 54.2684 34.2839 173.9794 4 L 4.4863 8.6003 119.7549 54.5775 42.0599 177.7553 5 G 3.9582 8.7680 115.0475 45.2347 0.0000 173.4994 6 G 3.8247 8.7929 106.4790 46.9904 0.0000 173.4302 7 N 4.9593 8.0441 115.9574 52.1960 37.9406 175.8149 8 G 4.0948 8.5738 108.8695 46.2849 0.0000 174.3776 9 Q 4.4970 7.8005 118.3437 54.6837 30.4387 175.4347 10 L 4.6118 8.4878 124.5500 55.7807 43.1808 175.7237 11 Q 4.8404 9.1547 122.8396 55.1573 34.0871 172.5021 12 Y 5.2712 8.3311 120.7496 55.8977 41.6437 174.5783 13 W 4.7774 8.0974 124.4610 54.4754 33.4390 173.3563 14 P 4.2780 0.0000 0.0000 61.3453 31.8929 176.2617 15 F 4.3357 8.3048 118.7689 57.5104 39.5430 176.1623 16 S 4.1603 8.7316 119.2564 58.4736 63.2956 175.4671 17 S 3.8748 8.6935 124.4460 61.3867 62.9192 176.4323 18 S 4.1073 8.1047 118.3839 61.8892 62.5431 176.4173 19 D 3.7052 7.4924 120.6312 56.9983 40.0355 178.6916 20 L 3.5160 7.0196 119.3631 57.4969 41.4994 179.0073 21 Y 4.3211 7.7766 116.7871 60.5842 37.5749 177.5950 22 N 4.3293 7.9432 117.3567 56.3402 38.4808 177.3595 23 W 4.5753 7.6037 118.7839 59.6264 29.2406 178.2916 24 K 4.2328 7.8369 119.0105 59.4091 31.5566 177.8555 25 N 5.0074 8.3907 113.6984 53.4061 38.5226 174.9138 26 N 5.1901 7.7700 116.0314 52.4870 40.1899 173.8390 27 N 4.9960 7.7016 112.3463 51.1957 42.8940 172.8876 28 P 4.5390 0.0000 0.0000 61.8968 32.4127 176.4940 29 S 4.3856 8.4817 114.1803 58.3400 64.4377 174.9976 30 F 4.1963 8.7474 123.2818 61.6500 38.9771 177.1011 31 S 3.9936 8.3839 113.9247 61.7625 62.8551 176.0157 32 E 4.2369 7.8505 120.3690 58.5427 29.3629 176.1290 33 D 4.1744 7.3647 112.5814 52.9780 43.5473 173.4725 34 P 3.9138 0.0000 0.0000 64.9416 31.8029 179.0489 35 G 3.8724 8.3352 106.7898 48.8558 0.0000 174.7364 36 K 3.5491 7.7346 116.3551 59.8932 31.6772 178.2864 37 L 3.9765 8.3870 120.7348 58.9461 42.2508 179.4932 38 T 3.9049 8.5150 115.5264 66.7456 68.3514 176.5174 39 A 4.0315 8.8139 123.1536 54.6502 18.3106 179.4525 40 L 3.6628 7.9202 118.9711 58.4968 42.2738 179.1985 41 I 3.4545 8.4790 120.8303 64.1819 36.6570 178.1883 42 E 3.8709 7.9820 120.4492 59.3865 29.5424 179.0706 43 S 3.9892 8.1864 114.5343 61.2383 63.0691 176.5049 44 V 3.5045 7.8245 122.0437 65.7843 30.6895 177.6628 45 L 4.0903 7.8603 118.7266 58.2301 41.4111 179.6335 46 T 4.1170 7.4121 114.8658 66.4604 68.7255 177.3607 47 T 4.1448 8.5738 109.9641 63.9487 69.1150 174.9080 48 H 4.7392 8.9071 117.9974 54.2012 30.9812 173.3562 49 Q 3.5999 8.1647 118.2801 54.7930 26.6680 172.1780 50 P 4.4697 0.0000 0.0000 62.7787 32.3380 177.7817 51 T 4.3059 9.0558 112.6671 61.1939 71.0849 175.0432 52 W 3.8950 8.6680 128.9347 60.6611 30.5988 177.7735 53 D 4.1679 8.2068 118.3758 57.6149 40.3624 177.9721 54 D 4.5542 8.0634 119.3078 57.9497 40.7922 179.3491 55 C 4.1838 7.7964 116.5457 62.9797 28.3237 175.7954 56 Q 3.6664 7.2282 119.2394 59.2095 28.3609 179.8324 57 Q 3.9214 8.1007 120.0984 58.9077 28.8562 177.7210 58 L 3.8347 8.2010 121.6801 58.2660 42.1765 179.0959 59 L 4.0718 8.5064 119.1735 57.7871 41.3833 179.6004 60 G 3.8204 8.2813 104.7214 48.1968 0.0000 175.2786 61 T 4.2118 7.7085 115.9802 64.7226 68.7260 175.3413 62 L 4.7392 7.2768 116.6636 54.0991 43.4644 176.1592 63 L 4.9995 8.2356 118.3252 52.2056 45.4736 176.9485 64 T 4.3916 9.7264 112.6877 61.2907 71.0704 176.2424 65 G 3.9839 8.4081 109.2125 48.2161 0.0000 175.6632 66 E 3.9961 8.2930 121.2907 58.9267 29.5685 179.3250 67 E 3.9932 8.2147 118.2029 59.4997 29.6733 179.3022 68 K 3.9256 8.1416 119.5191 59.5942 32.2185 178.4459 69 Q 3.9934 8.2954 118.3842 59.1809 28.7288 179.1754 70 R 3.9222 8.3189 118.8205 59.2690 30.2156 179.1181 71 V 3.5332 8.2344 118.2230 66.3669 31.6434 178.1951 72 L 4.2355 7.9389 117.9270 57.3135 41.3249 179.6074 73 L 4.0317 7.8168 119.1013 57.7610 41.5185 179.2393 74 E 3.8687 8.1509 118.3000 59.2036 29.1745 178.9104 75 A 3.7124 7.4640 119.7752 55.3180 18.2117 179.6633 76 R 3.9445 7.3856 117.2098 59.7926 30.4225 179.4279 77 K 4.0074 8.0833 123.4842 60.1161 31.3351 180.2153 78 A 4.3659 7.8920 119.4104 52.8539 18.6167 179.5184 79 V 3.5224 7.5849 120.5897 66.7177 32.9047 176.3511 *87 T 4.2138 7.2444 116.0353 63.4792 69.1421 173.6854 88 Q 4.4722 7.6362 117.9441 54.2705 32.3422 175.0689 89 L 4.1525 7.8874 118.7644 54.4654 42.6728 175.1929 90 P 4.2910 0.0000 0.0000 65.9044 31.0537 178.1794 91 N 4.3319 8.3193 115.0483 55.6387 37.0357 175.5891 92 E 4.4419 8.0296 118.9904 56.6416 30.2267 177.6404 93 V 3.7384 7.5997 117.2985 66.1694 31.7125 177.2756 94 D 4.6193 8.2378 117.9966 57.1892 40.7406 178.3665 95 A 4.0598 7.4501 119.3489 55.5054 18.4323 179.1404 96 A 4.5317 7.9373 117.0175 53.7267 20.2268 177.8974 97 F 5.2631 7.9754 118.4520 56.2739 39.8889 170.8071 98 P 4.6250 0.0000 0.0000 61.6591 32.4408 177.7731 99 L 4.3706 8.7235 122.1601 56.7955 42.0006 176.8407 100 E 4.7302 7.6259 116.2046 53.5837 32.0666 175.3421 101 R 2.0000 8.0663 120.6274 55.7305 29.9715 174.8036 102 P 4.0510 0.0000 0.0000 61.6216 33.2487 175.5541 103 D 4.7462 7.5769 114.1893 51.6234 38.7340 175.7181 104 W 4.4552 7.4948 120.4767 57.3567 30.3391 176.7345 105 D 4.5968 8.4773 122.7392 52.5448 39.6602 176.1499 106 Y 4.4929 8.1091 123.0400 58.3803 38.4847 177.8540 107 T 4.0443 7.5645 111.4144 64.3973 69.4728 175.5678 108 T 4.4501 7.7570 112.3108 60.5343 71.3597 175.2090 109 T 4.3273 8.0650 115.8146 64.7899 68.5566 176.2557 110 E 4.0375 8.0076 121.9801 58.9040 29.5137 178.8588 111 G 3.6789 7.7008 105.7673 47.6063 0.0000 175.2712 112 R 3.9987 8.1576 121.3836 59.0195 30.1271 178.8105 113 N 4.3134 7.6597 115.6624 56.7083 38.5291 176.8273 114 H 3.6206 7.5582 116.8643 58.7923 28.6486 177.4974 115 L 4.0927 7.9263 120.7295 58.0521 41.4774 179.5288 116 V 3.6203 7.3555 116.4078 66.1476 31.3061 177.5201 117 L 3.9343 7.7427 119.4078 58.5007 41.9332 178.0197 118 Y 4.4048 8.3129 119.3761 61.2983 38.6445 178.3492 119 R 3.9793 8.8588 118.9220 59.5490 30.3779 178.7753 120 Q 4.0367 8.5408 117.7673 59.4614 28.7892 179.6660 121 L 4.0182 8.8022 120.1652 57.4369 41.6632 179.2121 122 L 3.9616 8.3528 120.9680 57.8929 42.0247 178.7247 123 L 3.9151 8.3507 120.5974 57.9168 41.9913 178.5642 124 A 4.0440 7.9140 120.5200 55.5927 18.2584 179.2094 125 G 3.7121 7.7880 103.4268 48.3884 0.0000 175.1369 126 L 4.0391 7.9242 121.4247 57.8132 42.2163 179.3616 127 Q 4.1013 8.2380 116.9893 59.9474 28.5744 179.5780 128 N 4.3885 8.8488 116.8682 56.2194 38.6816 177.2150 129 A 4.3128 8.2623 121.9850 53.4533 18.6436 179.0178 130 G 3.3035 8.4723 105.9262 47.3263 0.0000 174.7194 131 R 4.1524 8.8122 121.5171 56.1843 29.6171 178.8533 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 P 0.00 5.08 0.00 1.99 1.93 0.00 3.31 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.33 0.00 2 L 8.09 5.17 0.00 1.56 1.49 0.76 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 3 R 9.57 4.73 0.00 1.85 1.99 0.00 2.77 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 4 L 8.60 4.49 0.00 1.57 1.73 0.95 0.97 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 5 G 8.77 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 6 G 8.79 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 7 N 8.04 4.96 0.00 2.81 2.87 0.00 0.00 6.95 7.16 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 8 G 8.57 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 0.00 0.00 0.00 0.00 9 Q 7.80 4.50 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.65 0.00 10 L 8.49 4.61 0.00 1.74 1.75 0.98 0.82 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 11 Q 9.15 4.84 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.52 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 12 Y 8.33 5.27 0.00 2.66 2.73 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 13 W 8.10 4.78 0.00 2.81 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 14 P 0.00 4.28 0.00 2.08 2.06 0.00 3.79 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 2.09 2.17 0.00 15 F 8.30 4.34 0.00 3.17 2.73 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 16 S 8.73 4.16 0.00 3.84 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 17 S 8.69 3.87 0.00 4.03 4.07 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 0.00 0.00 0.00 0.00 18 S 8.10 4.11 0.00 3.81 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 19 D 7.49 3.71 0.00 2.13 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 20 L 7.02 3.52 0.00 1.09 1.29 0.73 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.78 4.32 0.00 2.95 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 22 N 7.94 4.33 0.00 2.73 2.87 0.00 0.00 6.96 7.42 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 23 W 7.60 4.58 0.00 3.46 3.03 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 24 K 7.84 4.23 0.00 2.09 2.07 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.63 7.81 25 N 8.39 5.01 0.00 2.84 2.85 0.00 0.00 6.87 7.92 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 26 N 7.77 5.19 0.00 2.77 2.80 0.00 0.00 6.69 7.88 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 27 N 7.70 5.00 0.00 2.89 2.70 0.00 0.00 6.87 7.90 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 28 P 0.00 4.54 0.00 2.21 2.07 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 29 S 8.48 4.39 0.00 4.17 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 0.00 30 F 8.75 4.20 0.00 3.09 3.31 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 31 S 8.38 3.99 0.00 3.91 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 32 E 7.85 4.24 0.00 1.97 2.15 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 2.32 2.33 0.00 33 D 7.36 4.17 0.00 2.51 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 34 P 0.00 3.91 0.00 1.98 1.41 0.00 3.80 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 1.85 1.51 0.00 35 G 8.34 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 36 K 7.73 3.55 0.00 1.77 1.89 0.00 1.89 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.51 7.81 37 L 8.39 3.98 0.00 1.88 1.83 1.08 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.52 3.90 4.44 0.00 0.00 0.00 0.00 0.00 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 39 A 8.81 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 40 L 7.92 3.66 0.00 1.60 1.71 0.69 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.48 3.45 1.86 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 1.29 0.65 0.86 0.00 0.00 42 E 7.98 3.87 0.00 2.28 2.01 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 2.30 2.45 0.00 43 S 8.19 3.99 0.00 4.04 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 44 V 7.82 3.50 1.77 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 0.94 0.00 0.00 -0.30 0.00 0.00 45 L 7.86 4.09 0.00 2.00 1.78 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 46 T 7.41 4.12 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 47 T 8.57 4.14 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 1.28 0.00 0.00 48 H 8.91 4.74 0.00 3.54 3.46 0.00 5.96 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 49 Q 8.16 3.60 0.00 2.41 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.98 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 50 P 0.00 4.47 0.00 2.31 2.21 0.00 4.09 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 2.13 2.13 0.00 51 T 9.06 4.31 4.30 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 0.00 0.00 0.00 1.10 0.00 0.00 52 W 8.67 3.90 0.00 2.91 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 53 D 8.21 4.17 0.00 2.77 2.73 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 54 D 8.06 4.55 0.00 2.98 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 55 C 7.80 4.18 0.00 3.06 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.23 3.67 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 1.46 1.38 0.00 57 Q 8.10 3.92 0.00 2.16 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 58 L 8.20 3.83 0.00 2.13 1.73 0.95 0.84 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 59 L 8.51 4.07 0.00 1.60 1.60 0.88 0.76 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 60 G 8.28 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 61 T 7.71 4.21 4.12 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 0.00 0.00 0.00 0.93 0.00 0.00 62 L 7.28 4.74 0.00 1.71 1.65 0.95 0.96 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 63 L 8.24 5.00 0.00 1.53 1.42 0.54 0.45 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 64 T 9.73 4.39 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 1.27 0.00 0.00 65 G 8.41 3.98 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 0.00 0.00 0.00 66 E 8.29 4.00 0.00 2.10 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 0.00 2.43 2.50 0.00 67 E 8.21 3.99 0.00 2.24 1.92 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 2.61 2.43 0.00 68 K 8.14 3.93 0.00 1.78 1.92 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.45 7.81 69 Q 8.30 3.99 0.00 2.39 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 70 R 8.32 3.92 0.00 2.03 2.03 0.00 3.21 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.96 0.00 71 V 8.23 3.53 2.05 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 0.98 0.00 0.00 0.64 0.00 0.00 72 L 7.94 4.24 0.00 1.89 2.00 1.05 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.82 4.03 0.00 1.89 1.71 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.15 3.87 0.00 1.95 1.95 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 2.55 2.56 0.00 75 A 7.46 3.71 0.12 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 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.39 3.94 0.00 2.01 2.02 0.00 3.40 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.79 0.00 77 K 8.08 4.01 0.00 1.74 1.84 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.36 7.81 78 A 7.89 4.37 1.21 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 0.00 0.00 79 V 7.58 3.52 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 0.94 0.00 0.00 1.06 0.00 0.00 *87 T 7.24 4.21 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 1.25 0.00 0.00 88 Q 7.64 4.47 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.46 6.94 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 89 L 7.89 4.15 0.00 1.75 1.62 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.29 0.00 2.17 2.14 0.00 3.63 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 91 N 8.32 4.33 0.00 2.96 3.12 0.00 0.00 5.70 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 92 E 8.03 4.44 0.00 2.08 2.00 0.00 0.00 0.00 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 2.39 0.00 93 V 7.60 3.74 2.36 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 0.99 0.00 0.00 0.98 0.00 0.00 94 D 8.24 4.62 0.00 2.80 2.73 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 95 A 7.45 4.06 1.48 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 96 A 7.94 4.53 1.51 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 0.00 0.00 97 F 7.98 5.26 0.00 3.09 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 98 P 0.00 4.63 0.00 1.99 1.97 0.00 3.97 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.60 0.00 99 L 8.72 4.37 0.00 1.78 1.91 1.05 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 100 E 7.63 4.73 0.00 1.80 1.69 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 2.22 2.30 0.00 101 R 8.07 2.00 0.00 1.60 1.56 0.00 3.22 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.44 0.00 102 P 0.00 4.05 0.00 0.56 0.85 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 103 D 7.58 4.75 0.00 2.66 2.54 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 0.00 104 W 7.49 4.46 0.00 3.36 2.99 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 0.00 105 D 8.48 4.60 0.00 2.63 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 0.00 106 Y 8.11 4.49 0.00 3.08 3.15 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 0.00 107 T 7.56 4.04 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 0.92 0.00 0.00 108 T 7.76 4.45 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 0.00 109 T 8.07 4.33 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 1.23 0.00 0.00 110 E 8.01 4.04 0.00 2.13 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 2.32 2.39 0.00 111 G 7.70 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.16 4.00 0.00 1.99 2.05 0.00 3.19 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.97 0.00 113 N 7.66 4.31 0.00 2.85 2.70 0.00 0.00 6.95 8.04 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 0.00 114 H 7.56 3.62 0.00 2.49 1.31 0.00 5.63 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 0.00 115 L 7.93 4.09 0.00 1.88 1.87 1.06 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.36 3.62 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 1.10 0.00 0.00 0.99 0.00 0.00 117 L 7.74 3.93 0.00 1.78 1.78 0.91 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 0.00 118 Y 8.31 4.40 0.00 3.54 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 R 8.86 3.98 0.00 2.08 2.03 0.00 3.30 0.00 0.00 3.40 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.11 0.00 120 Q 8.54 4.04 0.00 2.38 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 121 L 8.80 4.02 0.00 2.07 1.65 1.12 0.72 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 0.00 122 L 8.35 3.96 0.00 1.65 1.78 0.90 0.49 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 0.00 123 L 8.35 3.92 0.00 1.86 1.86 0.93 0.91 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 0.00 124 A 7.91 4.04 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 125 G 7.79 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 0.00 126 L 7.92 4.04 0.00 1.82 1.91 0.72 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 8.24 4.10 0.00 2.34 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 128 N 8.85 4.39 0.00 2.73 2.88 0.00 0.00 7.15 7.54 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 0.00 129 A 8.26 4.31 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 0.00 0.00 0.00 0.00 0.00 0.00 130 G 8.47 3.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 R 8.81 4.15 0.00 1.85 1.71 0.00 3.30 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 1.54 1.19 0.00 * Residues marked with a * may have inaccurate shift predictions.