NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 G 3.9505 8.3544 109.7392 45.4727 0.0000 172.8088 25 Y 3.9667 8.4972 120.4143 57.3553 39.3168 174.5303 26 Q 4.1642 7.1888 124.8288 53.0106 32.6377 173.2604 27 P 4.4249 0.0000 0.0000 60.6078 32.5828 174.1777 28 P 4.3210 0.0000 0.0000 62.5877 31.6974 177.6978 29 S 4.1659 8.6949 115.8913 61.0357 62.5976 175.0771 30 D 4.9379 8.2548 117.8674 52.8307 39.4808 174.7318 31 Y 4.5620 8.0707 116.9854 56.4364 40.0727 175.0705 32 K 4.6259 8.3450 124.5395 54.1037 34.7573 175.4540 33 Q 4.0565 8.5591 126.6487 56.2473 29.6081 175.5186 34 C 4.3987 8.5515 122.6082 59.2011 27.6547 173.5577 35 K 4.3985 8.3906 123.4944 56.5552 33.1093 176.4042 36 H 5.1047 7.6117 114.8270 54.6430 29.2160 174.2356 37 L 4.1317 7.5254 119.1686 54.6315 42.3986 178.4585 38 K 4.3098 8.4519 123.1091 55.7485 32.8994 177.0793 39 S 4.3915 8.3922 115.9998 58.2461 63.7383 173.4371 40 F 4.7907 8.4644 123.9618 55.7180 41.7172 173.7300 41 P 4.3935 0.0000 0.0000 61.7293 29.6893 176.5305 42 V 3.6914 8.3818 127.1865 66.8250 31.4611 178.2126 43 S 4.1275 8.2263 114.2941 61.8130 62.2896 176.2152 44 E 4.0466 7.8189 123.3861 59.3131 29.2452 179.7262 45 L 4.1990 7.6881 122.5504 59.2639 40.8817 183.5024 46 K 4.2810 7.6148 115.9681 57.3475 32.1873 177.3338 47 G 3.9736 7.2729 108.6695 44.3949 0.0000 174.1240 48 D 4.4330 8.6619 123.2201 57.3309 41.0905 177.6882 49 N 4.7650 8.1136 113.6711 53.7471 38.6512 174.0357 50 K 4.7614 7.6502 115.1550 54.5047 35.7814 175.3804 51 E 4.9400 8.4613 119.3592 54.5381 32.9562 175.0079 52 L 4.8077 9.5099 125.7547 53.6359 43.5893 175.2825 53 W 5.7203 9.2245 125.6239 55.1787 32.4731 174.1697 54 L 4.5273 8.2787 122.9037 52.9502 46.0915 174.7304 *56 K 4.3175 8.3326 120.2256 56.2675 33.1724 174.4852 57 V 4.8541 8.1809 126.0429 60.2124 34.9425 173.1921 58 P 4.4389 0.0000 0.0000 62.5004 31.8755 177.5676 59 A 3.9894 8.7021 126.0118 55.0726 18.5387 178.5546 60 N 4.5432 8.0376 111.1591 54.2192 37.8569 175.0106 61 I 3.9543 7.2217 121.5823 60.6528 37.9269 175.3693 62 D 4.6219 8.4379 125.4365 52.6586 40.3452 176.3772 63 I 3.7555 8.2234 128.6117 64.0566 37.4575 178.9633 64 S 4.1793 8.1867 113.7882 61.1530 62.7706 175.2757 65 Q 4.1932 7.7192 118.0981 57.0495 28.9207 176.0810 66 L 4.3341 7.6053 118.6334 54.0213 42.3796 176.5131 67 K 4.4439 8.5782 122.7059 56.6763 33.9189 176.0521 68 S 4.5956 7.7118 110.8022 56.5627 65.7719 173.6613 69 L 4.5579 8.2375 122.4393 52.5537 41.9275 175.3598 70 P 4.6351 0.0000 0.0000 62.3486 31.3271 177.3016 71 L 3.8977 7.6627 118.0727 55.7937 42.1831 176.8836 72 D 4.6554 8.4263 122.4455 53.0373 40.9872 176.9208 73 T 4.2283 8.5272 122.3097 64.6736 67.8169 174.9488 74 D 4.5252 8.0140 120.5598 56.3700 41.3782 177.2160 75 A 4.2258 7.2628 121.4520 52.5102 19.1995 177.3901 76 T 4.1910 8.5741 118.1527 65.5880 70.0156 175.0120 77 V 4.9057 7.6799 119.8268 61.2694 34.1885 174.9128 78 S 4.7617 8.8692 121.5376 57.8453 66.2756 172.5220 79 T 5.3647 8.4946 108.4096 60.3856 71.8854 173.6776 80 V 4.4900 8.8182 122.3780 60.0142 35.0653 173.9583 81 E 5.1333 9.0037 125.2240 54.5990 30.4354 174.6673 82 L 4.8499 8.6204 127.4767 54.8558 44.1239 175.8918 83 G 4.0835 8.6364 112.2296 47.1020 0.0000 174.6096 84 S 4.7759 9.0512 119.4518 57.6040 64.2017 173.2941 85 K 4.5519 7.8246 120.1682 54.3721 34.8065 174.2078 86 N 5.3867 8.0804 119.1962 52.2042 40.9121 173.8387 87 F 4.9783 8.8543 122.2595 55.6810 43.4470 173.8087 88 N 5.0169 9.1372 118.5665 52.9840 40.2388 174.4264 89 V 4.8488 8.6962 121.7282 61.0183 35.0423 173.9203 90 L 5.0030 8.9265 129.2401 53.5224 45.0820 175.4048 91 Q 4.2357 8.9982 129.1671 54.1865 27.8859 175.2861 92 N 4.2215 8.3930 122.8514 56.1661 38.8714 177.3252 93 T 4.0057 7.5610 104.8993 63.0335 68.7145 174.4937 94 S 4.5619 7.7661 117.4951 58.6077 64.8024 174.2835 95 T 4.3936 7.5298 111.4578 60.1292 70.0386 175.7988 96 Q 4.0204 8.5464 124.4723 59.3717 29.2327 177.2846 97 E 4.1527 8.1751 115.0774 57.8120 29.7458 177.3015 98 G 4.1131 7.4239 105.1566 45.1489 0.0000 174.2922 99 S 4.0727 8.1207 117.6169 60.7605 63.0547 174.0548 100 D 4.5524 7.8528 120.0556 53.4952 41.1914 175.1050 101 N 5.2921 8.5725 123.5717 52.1703 39.7498 176.0901 102 T 3.7910 7.8323 107.7876 62.9166 68.4257 174.7370 103 N 4.5075 8.0271 119.8752 54.0615 38.1547 174.2968 104 L 4.8740 7.8745 120.1416 53.1874 42.4054 175.7774 105 S 4.7094 8.5508 118.5694 56.0877 65.3041 173.0810 106 L 4.3455 8.1979 126.1044 54.2777 43.1093 174.8506 107 L 5.1728 8.4428 126.5046 53.1533 43.6428 175.9176 108 I 4.6982 8.6677 116.5912 58.1912 41.0064 172.9792 109 P 5.0314 0.0000 0.0000 62.6759 32.1346 176.1249 110 S 4.5589 8.1715 117.2255 57.5976 64.2214 174.4241 111 E 4.0490 8.6632 121.6473 59.3306 29.0987 178.0927 112 K 3.8533 7.7560 118.7986 58.3644 32.9373 175.8652 113 K 4.5758 9.1327 116.6427 54.7480 34.5136 176.7197 114 K 4.4691 8.6425 123.2302 56.5353 32.2711 177.8524 115 E 4.2605 8.2298 121.6255 56.2005 31.7222 175.6824 116 T 4.7903 7.4619 107.0184 59.6682 71.9365 173.3659 117 L 5.0543 8.4209 121.8558 53.1711 44.8297 175.7504 118 K 4.7213 8.6734 119.4795 54.3205 36.9574 175.8152 119 V 4.1258 8.3120 122.1651 62.5691 32.3012 175.4879 120 A 4.1401 9.0392 130.9086 52.4270 19.0891 176.3969 121 T 4.4350 8.2950 116.5069 60.5915 70.8841 173.4038 122 S 4.7164 7.8231 121.8582 56.4152 65.5147 174.5366 123 K 3.8596 8.6677 118.8710 59.8902 31.6208 177.7479 124 D 4.4613 7.9896 115.0307 53.1853 39.7825 175.5672 125 N 4.1769 7.9998 117.2824 54.6792 38.0628 173.2451 126 K 4.5213 7.8671 115.2341 53.5829 34.2839 175.7356 127 S 4.0010 8.5666 119.5087 59.1928 63.3742 174.3919 128 V 3.6115 7.6382 124.5268 62.8358 31.7074 174.8568 129 Y 4.9740 8.1039 124.5627 55.8221 41.1969 175.5277 130 F 4.5770 8.7456 120.7122 57.8549 39.7776 175.5433 131 D 4.7253 9.4949 126.6394 56.9799 41.4319 177.1904 132 R 4.4990 8.0824 115.5237 54.1239 34.7210 174.5799 133 V 4.6184 8.2489 121.7345 61.0940 34.5867 174.1572 134 F 5.0426 9.0931 126.4928 55.8801 42.2257 174.8521 135 T 4.7011 9.3159 119.5938 62.0042 71.1300 173.1098 136 I 4.8591 8.8119 129.3266 59.9691 38.1659 175.7123 137 S 4.9334 9.0200 121.6924 56.1290 66.5510 173.5485 138 E 4.8000 8.8840 120.6215 56.4502 30.0379 177.1728 139 T 4.3135 8.5903 111.7689 60.3043 69.8101 174.2705 140 A 4.0737 8.4484 125.8427 52.8955 18.8434 177.4057 141 R 4.7178 8.3004 120.1631 54.5350 34.0333 175.6962 142 I 4.3393 7.8965 121.6984 58.4588 37.0177 174.1971 143 P 4.4207 0.0000 0.0000 62.6237 31.0973 176.5479 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 24 G 8.35 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 0.00 0.00 0.00 25 Y 8.50 3.97 0.00 3.05 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 26 Q 7.19 4.16 0.00 1.77 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.28 2.15 0.00 27 P 0.00 4.42 0.00 2.23 2.20 0.00 3.24 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 1.98 2.00 0.00 28 P 0.00 4.32 0.00 2.33 2.05 0.00 3.33 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.93 0.00 29 S 8.69 4.17 0.00 3.98 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 30 D 8.25 4.94 0.00 2.71 2.75 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 31 Y 8.07 4.56 0.00 3.11 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 32 K 8.35 4.63 0.00 1.68 1.66 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.39 7.81 33 Q 8.56 4.06 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 34 C 8.55 4.40 0.00 3.01 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 35 K 8.39 4.40 0.00 1.52 1.71 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.40 7.81 36 H 7.61 5.10 0.00 3.12 3.19 0.00 5.70 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 37 L 7.53 4.13 0.00 1.71 1.64 0.93 0.84 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 38 K 8.45 4.31 0.00 1.79 1.78 0.00 1.79 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.40 7.81 39 S 8.39 4.39 0.00 4.01 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 40 F 8.46 4.79 0.00 2.91 2.93 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 41 P 0.00 4.39 0.00 2.04 2.05 0.00 2.76 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.73 0.00 42 V 8.38 3.69 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 1.04 0.00 0.00 1.06 0.00 0.00 43 S 8.23 4.13 0.00 4.05 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 44 E 7.82 4.05 0.00 1.92 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 2.26 2.22 0.00 45 L 7.69 4.20 0.00 1.63 1.67 0.92 1.25 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 46 K 7.61 4.28 0.00 1.76 1.88 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.46 1.37 7.81 47 G 7.27 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 48 D 8.66 4.43 0.00 2.72 2.74 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 49 N 8.11 4.76 0.00 2.66 2.80 0.00 0.00 6.74 6.68 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 50 K 7.65 4.76 0.00 1.74 1.62 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.33 7.81 51 E 8.46 4.94 0.00 1.97 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 0.00 2.38 2.38 0.00 52 L 9.51 4.81 0.00 1.84 1.67 1.17 0.50 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 53 W 9.22 5.72 0.00 3.27 3.17 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 0.00 54 L 8.28 4.53 0.00 0.27 0.85 0.68 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 *56 K 8.33 4.32 0.00 1.87 1.70 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.43 7.81 57 V 8.18 4.85 2.04 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 0.75 0.00 0.00 0.89 0.00 0.00 58 P 0.00 4.44 0.00 2.18 1.97 0.00 3.37 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.08 0.00 59 A 8.70 3.99 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 60 N 8.04 4.54 0.00 2.85 2.98 0.00 0.00 6.04 7.81 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 61 I 7.22 3.95 1.73 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 1.04 0.40 0.81 0.00 0.00 62 D 8.44 4.62 0.00 2.75 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.22 3.76 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.02 0.91 0.00 0.00 64 S 8.19 4.18 0.00 3.97 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 65 Q 7.72 4.19 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.85 0.00 0.00 0.00 0.00 0.00 2.60 2.48 0.00 66 L 7.61 4.33 0.00 1.82 1.59 0.98 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.58 4.44 0.00 1.69 1.80 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.38 7.81 68 S 7.71 4.60 0.00 3.95 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 69 L 8.24 4.56 0.00 1.64 1.64 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.64 0.00 2.17 2.14 0.00 3.51 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 71 L 7.66 3.90 0.00 1.52 1.27 0.38 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.43 4.66 0.00 2.77 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 73 T 8.53 4.23 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 1.32 0.00 0.00 74 D 8.01 4.53 0.00 2.71 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 75 A 7.26 4.23 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.57 4.19 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 1.17 0.00 0.00 77 V 7.68 4.91 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 0.85 0.00 0.00 0.93 0.00 0.00 78 S 8.87 4.76 0.00 3.91 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 79 T 8.49 5.36 4.48 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 1.22 0.00 0.00 80 V 8.82 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 0.80 0.00 0.00 0.97 0.00 0.00 81 E 9.00 5.13 0.00 2.01 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 2.38 2.23 0.00 82 L 8.62 4.85 0.00 1.92 1.75 0.90 0.39 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 83 G 8.64 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 S 9.05 4.78 0.00 3.84 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 85 K 7.82 4.55 0.00 1.67 1.28 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.25 1.31 7.81 86 N 8.08 5.39 0.00 2.63 2.56 0.00 0.00 6.79 7.02 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 87 F 8.85 4.98 0.00 2.97 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 88 N 9.14 5.02 0.00 2.78 2.76 0.00 0.00 6.66 7.79 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 89 V 8.70 4.85 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 1.05 0.00 0.00 0.96 0.00 0.00 90 L 8.93 5.00 0.00 1.77 1.47 0.97 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 9.00 4.24 0.00 1.91 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.52 0.00 0.00 0.00 0.00 0.00 1.90 1.42 0.00 92 N 8.39 4.22 0.00 2.60 2.78 0.00 0.00 6.67 7.07 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 93 T 7.56 4.01 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 1.12 0.00 0.00 94 S 7.77 4.56 0.00 3.95 3.85 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 95 T 7.53 4.39 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 1.16 0.00 0.00 96 Q 8.55 4.02 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.09 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 97 E 8.18 4.15 0.00 1.98 1.96 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 2.29 2.28 0.00 98 G 7.42 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 4.07 0.00 3.83 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 0.00 100 D 7.85 4.55 0.00 2.57 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 0.00 101 N 8.57 5.29 0.00 2.78 2.83 0.00 0.00 7.37 7.05 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 0.00 102 T 7.83 3.79 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 0.54 0.00 0.00 103 N 8.03 4.51 0.00 2.91 3.11 0.00 0.00 6.16 6.67 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 0.00 104 L 7.87 4.87 0.00 2.02 1.93 1.00 0.73 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 0.00 105 S 8.55 4.71 0.00 3.92 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 0.00 106 L 8.20 4.35 0.00 1.51 1.37 0.81 0.46 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 0.00 107 L 8.44 5.17 0.00 1.49 1.52 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 108 I 8.67 4.70 1.91 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 1.25 1.02 0.75 0.00 0.00 109 P 0.00 5.03 0.00 2.12 2.10 0.00 3.80 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 110 S 8.17 4.56 0.00 3.97 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 0.00 111 E 8.66 4.05 0.00 1.99 2.06 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 2.33 2.25 0.00 112 K 7.76 3.85 0.00 1.71 1.78 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.48 7.81 113 K 9.13 4.58 0.00 1.76 1.66 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.36 7.81 114 K 8.64 4.47 0.00 1.80 1.82 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.60 1.38 7.81 115 E 8.23 4.26 0.00 1.90 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 2.18 2.25 0.00 116 T 7.46 4.79 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 0.00 117 L 8.42 5.05 0.00 1.49 1.56 0.91 0.75 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 0.00 118 K 8.67 4.72 0.00 1.64 1.61 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.34 7.81 119 V 8.31 4.13 2.04 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 0.68 0.00 0.00 0.90 0.00 0.00 120 A 9.04 4.14 1.24 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 0.00 0.00 0.00 121 T 8.29 4.44 4.16 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 1.22 0.00 0.00 122 S 7.82 4.72 0.00 4.14 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 0.00 123 K 8.67 3.86 0.00 1.75 1.93 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.44 7.81 124 D 7.99 4.46 0.00 2.78 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 0.00 125 N 8.00 4.18 0.00 2.88 2.92 0.00 0.00 6.96 6.70 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 0.00 126 K 7.87 4.52 0.00 2.16 1.65 0.00 1.97 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.41 7.81 127 S 8.57 4.00 0.00 3.08 3.55 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 0.00 128 V 7.64 3.61 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 0.61 0.00 0.00 0.82 0.00 0.00 129 Y 8.10 4.97 0.00 2.89 2.74 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 0.00 130 F 8.75 4.58 0.00 3.13 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 0.00 131 D 9.49 4.73 0.00 2.94 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 0.00 132 R 8.08 4.50 0.00 0.76 0.84 0.00 2.55 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.55 0.00 133 V 8.25 4.62 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 0.86 0.00 0.00 0.80 0.00 0.00 134 F 9.09 5.04 0.00 2.78 2.75 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 0.00 135 T 9.32 4.70 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 1.25 0.00 0.00 136 I 8.81 4.86 1.78 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.52 0.74 0.00 0.00 137 S 9.02 4.93 0.00 3.88 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 0.00 138 E 8.88 4.80 0.00 1.96 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 2.68 2.45 0.00 139 T 8.59 4.31 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 1.26 0.00 0.00 140 A 8.45 4.07 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 0.00 141 R 8.30 4.72 0.00 1.75 1.78 0.00 3.16 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.78 0.00 142 I 7.90 4.34 1.87 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 1.41 0.86 0.91 0.00 0.00 143 P 0.00 4.42 0.00 2.04 1.97 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.