NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.3526 8.0427 122.6696 54.8775 43.0533 174.7453 3 V 4.6533 8.3194 124.8050 58.3423 33.4514 173.1658 4 R 4.8518 8.4557 123.2713 54.8038 33.6978 173.8651 5 T 4.7479 8.4256 110.1016 61.4552 70.1893 173.8772 6 L 4.9273 8.1407 123.0546 53.1081 43.9263 176.8546 7 S 4.3605 9.1880 116.4819 57.5589 64.3706 175.1488 8 A 3.9854 8.6611 122.5776 55.6347 18.0442 180.0461 9 L 4.0068 7.8469 116.7566 57.8302 41.8306 179.3859 10 E 4.0112 8.3199 118.7503 59.3563 29.3523 179.1673 11 C 4.1169 8.0591 116.8287 63.2100 28.1684 175.9632 12 T 3.6863 7.6723 116.8775 66.8594 68.1427 176.6455 13 K 3.9035 7.8934 119.5917 59.2291 31.6763 179.6743 14 V 3.5889 7.6365 118.0334 66.0522 31.3141 178.0836 15 L 4.1116 7.6383 117.2729 58.1794 41.4950 179.4119 16 T 3.9860 7.7618 114.6774 66.5747 68.4827 176.3878 17 A 4.2028 7.8783 120.7961 53.0359 18.6600 176.8995 18 N 5.0137 7.3173 113.7262 51.7303 41.2127 174.5439 19 R 4.2646 8.2898 112.9509 55.2458 31.5575 175.1247 20 V 5.0635 8.0358 118.9614 60.1969 34.4360 174.8511 21 G 4.3742 9.3678 109.6428 45.1465 0.0000 170.7227 22 R 5.0197 8.7959 118.4308 54.1543 32.7246 175.3210 23 L 5.0872 8.8072 126.2367 53.2146 44.4557 174.6747 24 A 5.4063 9.2092 128.4083 50.3011 21.9965 174.8272 25 C 5.2463 9.0578 115.6189 56.7335 33.8490 172.3434 26 A 5.3951 8.4452 118.4984 50.9213 22.1472 175.8982 27 K 3.8968 8.5080 120.3602 55.9465 35.1322 176.2939 28 D 4.3685 9.6266 126.4345 55.3766 38.3631 174.7829 29 G 3.8515 8.2775 105.8475 45.1317 0.0000 173.2430 30 Q 4.5113 7.7647 122.3168 54.2027 30.2187 173.5675 31 P 5.3188 0.0000 0.0000 62.8187 33.0130 175.3178 32 Y 5.0079 9.1788 122.7159 56.4013 42.2281 173.9250 33 V 4.7104 8.1414 125.7107 59.9765 34.0835 175.2442 34 V 4.4979 8.1942 116.5902 58.6271 36.3065 173.0483 35 P 4.8394 0.0000 0.0000 63.0229 32.4304 175.3579 36 L 4.4474 8.6457 122.5853 53.9896 45.9441 174.1172 37 Y 5.2730 8.4759 123.7440 57.8486 38.9145 174.1709 38 Y 5.3200 8.6321 120.7577 55.3184 42.1250 174.2031 39 A 4.7310 9.2742 121.4540 50.2061 21.9631 174.8214 40 Y 4.8985 9.0273 124.4727 57.5193 40.0813 174.8042 41 S 4.1561 8.9383 119.0443 58.3183 66.0228 174.0768 42 D 4.5063 9.1796 125.3824 54.6454 37.9200 173.1614 43 A 3.8914 7.5328 116.6281 54.6854 17.0772 177.1396 44 H 5.3370 7.7011 114.4692 55.5186 33.5053 172.7974 45 L 5.0761 8.6215 121.4924 53.5954 43.4862 175.2201 46 Y 4.8126 9.1798 122.4739 56.8939 40.2862 174.7578 47 A 4.9174 8.1646 122.7907 51.2894 23.3339 174.9786 48 F 5.5249 9.0067 117.0826 55.6078 42.2773 175.3308 49 S 4.4645 9.8311 119.6855 57.2179 66.5215 172.1567 *51 P 4.4389 0.0000 0.0000 61.3073 32.3442 176.3669 52 G 3.9171 8.1623 107.1303 44.7796 0.0000 172.3899 53 K 3.5672 8.1892 119.5067 59.6223 31.5625 178.9698 54 K 3.9691 7.9312 116.8598 60.0581 32.5058 178.5847 55 I 3.4999 7.4930 119.4788 63.9947 37.5451 177.6397 56 E 4.2052 8.3666 119.6299 59.2052 29.2279 180.2139 57 W 4.2966 8.4550 116.8717 57.3064 28.7243 178.3808 *59 R 4.2367 7.9560 119.4068 56.2950 31.4379 177.0507 60 A 4.0341 7.7919 119.0716 54.0792 18.5796 176.6059 61 N 4.7285 8.1416 113.6828 51.3444 40.0639 171.6059 62 P 4.6984 0.0000 0.0000 63.1993 32.7737 175.8716 63 R 4.5915 8.1895 120.9983 56.6912 30.5356 176.3041 64 V 4.7996 8.8179 116.0849 59.7885 37.0229 174.1190 65 S 5.1079 8.8490 115.2975 56.6836 66.1375 172.7201 66 V 4.9200 8.8449 125.3079 61.0951 34.8260 173.7210 67 Q 5.1503 8.9122 128.3835 54.3151 31.9745 174.2315 68 V 4.8924 8.7437 125.3882 61.3286 35.2036 173.7238 69 D 5.4468 8.6526 125.4782 52.3966 43.0186 173.5783 70 E 4.8277 9.2079 115.7370 55.0730 33.2699 174.5188 71 H 5.0349 8.9013 117.9794 55.0379 29.6063 176.4925 72 G 4.1835 8.6277 109.7803 45.9764 0.0000 174.6134 73 Q 4.5056 8.7709 122.7814 55.6495 31.1342 176.2891 74 G 3.8075 8.2900 111.8619 48.0408 0.0000 174.8178 75 R 4.4387 8.8150 122.2514 55.7483 29.4767 176.0802 76 G 4.0306 8.5141 107.1688 47.7398 0.0000 172.7524 77 W 5.4342 7.8597 115.5789 55.6689 32.0820 173.3232 78 K 5.2745 9.2258 119.5264 54.9011 35.7321 175.5565 79 S 5.1824 9.7046 118.4486 56.5956 66.4511 172.6089 80 V 4.9447 9.1071 125.4918 61.0507 34.8347 174.1282 81 V 4.8433 8.8803 127.2066 61.0973 34.1603 174.0731 82 V 4.7406 8.9825 128.1259 61.2796 34.0523 173.7505 83 D 5.2547 9.2579 128.1861 52.7583 43.1648 175.8086 84 G 4.5446 9.1215 109.9654 44.5446 0.0000 170.6655 85 R 5.2395 8.5043 119.2673 54.1263 32.8699 173.9938 86 Y 4.5908 9.0647 128.9865 57.9864 39.6153 174.9922 87 E 4.2975 9.0249 125.8360 54.0873 32.8224 174.9583 88 E 3.8253 8.2414 125.9968 56.0986 30.7212 176.6412 89 L 4.3643 8.2699 126.5909 51.7370 41.9393 174.6886 90 P 4.4238 0.0000 0.0000 62.4604 32.5005 177.0817 91 D 4.7657 8.4351 120.7964 53.6144 39.5139 175.0148 92 L 4.9149 7.3397 121.8470 52.1729 45.9235 177.9073 93 I 3.6700 8.3323 120.2534 64.0354 38.0742 178.3439 94 G 3.6327 8.0749 107.9767 47.7978 0.0000 173.5559 95 H 5.3325 8.2333 115.2534 54.6998 29.7432 176.1202 96 K 3.9848 8.1227 122.9322 59.4161 31.8688 178.6710 97 L 3.8028 7.8140 120.1872 58.0967 41.9871 178.5751 98 Q 3.9703 8.1137 117.5685 59.0115 28.6354 178.8431 99 R 2.9494 8.4561 119.8292 59.2683 30.1433 178.1943 100 D 4.3713 8.6475 118.9769 57.7066 40.6898 178.4393 101 H 4.1729 8.4089 116.6404 59.0109 28.7082 177.6363 102 A 4.0692 8.2475 122.6168 55.0875 18.1589 179.5163 103 W 3.8887 8.6692 127.4077 60.4401 30.5124 178.4053 104 S 3.8844 7.9306 113.6370 61.2692 62.4615 176.3659 105 V 3.6318 7.3012 121.0812 64.9792 31.6886 177.1617 106 L 4.1987 7.7905 116.8038 54.7911 41.7364 178.4680 107 S 2.7900 7.0669 113.8782 60.5116 62.5569 175.3993 108 K 3.5015 7.2911 121.5257 59.8446 31.8300 178.2053 109 H 2.5800 7.0113 115.5071 58.4513 28.5125 177.7611 110 T 3.5444 7.8678 117.7080 66.3567 67.9268 175.9815 111 D 4.2928 6.9792 118.8029 55.7505 40.8704 177.4973 112 W 5.0192 7.8650 118.7559 56.6927 29.6278 176.5967 113 W 5.0649 7.5529 113.3556 56.4012 29.7040 175.2568 114 E 3.7506 7.2149 120.2252 55.3302 29.0421 174.5639 115 P 4.4233 0.0000 0.0000 62.1462 32.0083 176.8259 116 G 3.7713 8.4985 111.6947 44.7611 0.0000 172.9701 117 A 3.9712 8.4407 123.1692 53.5768 18.7583 176.5615 118 L 3.5733 8.5422 118.4800 56.5351 40.3655 175.1158 *128 S 3.4452 7.6428 111.9293 57.7510 63.8269 175.0720 129 A 4.2210 7.6691 124.4357 55.1420 19.4663 177.7936 130 P 4.7400 0.0000 0.0000 63.3014 31.7973 176.0582 131 H 4.6887 7.6152 115.5478 55.9428 29.5426 174.7601 132 V 4.3455 9.3787 123.8681 62.0612 32.7927 174.3663 133 F 5.3230 8.9800 130.6056 57.0233 41.4860 174.1937 134 F 4.9508 8.0915 119.3379 55.7587 41.7635 172.8354 135 R 4.6655 8.5447 115.2454 54.3257 33.0873 174.3396 136 I 4.7755 8.3813 122.3078 59.7035 38.9374 174.8214 137 L 4.2073 8.6559 131.0926 54.7992 43.1686 175.9025 138 I 4.0974 8.2611 128.1878 61.3959 36.7984 175.2553 139 E 4.4269 9.0019 127.3116 57.7281 30.7508 176.9854 140 Q 4.9039 7.9160 117.0029 54.0326 32.9752 174.9453 141 V 5.1170 8.2061 120.6330 60.4090 34.5095 174.0616 142 S 4.8420 9.2831 117.5871 56.8057 67.0504 172.9012 143 G 4.6136 8.4420 106.2138 44.9589 0.0000 171.5934 144 R 5.3917 9.4054 120.0894 54.1817 35.0618 173.9240 145 E 4.6804 9.1069 122.3789 54.2428 33.5527 173.9040 146 A 4.6189 6.6900 128.2434 50.3143 20.9389 177.1563 147 S 4.2806 8.7999 118.5441 58.5121 62.7651 174.3603 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 2 L 8.04 4.35 0.00 1.36 1.65 0.92 0.38 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 3 V 8.32 4.65 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 0.92 0.00 0.00 0.87 0.00 0.00 4 R 8.46 4.85 0.00 1.84 1.90 0.00 2.76 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 1.41 1.48 0.00 5 T 8.43 4.75 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 6 L 8.14 4.93 0.00 1.57 1.62 0.95 0.67 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 7 S 9.19 4.36 0.00 3.98 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 8 A 8.66 3.99 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 9 L 7.85 4.01 0.00 1.70 1.72 0.92 0.98 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 10 E 8.32 4.01 0.00 2.24 1.99 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 2.32 2.34 0.00 11 C 8.06 4.12 0.00 3.15 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 12 T 7.67 3.69 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 1.02 0.00 0.00 13 K 7.89 3.90 0.00 2.09 1.84 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.46 1.32 7.81 14 V 7.64 3.59 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 1.09 0.00 0.00 0.99 0.00 0.00 15 L 7.64 4.11 0.00 1.53 1.68 0.90 0.61 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 16 T 7.76 3.99 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 1.24 0.00 0.00 17 A 7.88 4.20 1.36 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 18 N 7.32 5.01 0.00 2.97 2.87 0.00 0.00 6.75 7.33 0.00 0.00 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 R 8.29 4.26 0.00 1.65 1.90 0.00 3.02 0.00 0.00 3.39 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.15 0.00 20 V 8.04 5.06 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 0.85 0.00 0.00 0.83 0.00 0.00 21 G 9.37 4.37 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 0.00 22 R 8.80 5.02 0.00 1.74 1.76 0.00 3.10 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.50 0.00 23 L 8.81 5.09 0.00 1.74 1.44 0.96 1.06 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 24 A 9.21 5.41 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 0.00 0.00 25 C 9.06 5.25 0.00 3.07 3.05 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 26 A 8.45 5.40 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 27 K 8.51 3.90 0.00 0.79 0.74 0.00 0.61 0.00 0.00 1.20 0.00 0.00 2.71 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.80 0.78 7.81 28 D 9.63 4.37 0.00 2.65 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 29 G 8.28 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 0.00 0.00 0.00 30 Q 7.76 4.51 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.86 0.00 0.00 0.00 0.00 0.00 2.52 2.69 0.00 31 P 0.00 5.32 0.00 2.06 2.03 0.00 3.80 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 2.07 2.12 0.00 32 Y 9.18 5.01 0.00 2.73 2.68 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 33 V 8.14 4.71 1.99 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 0.73 0.00 0.00 0.84 0.00 0.00 34 V 8.19 4.50 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 0.21 0.00 0.00 0.63 0.00 0.00 35 P 0.00 4.84 0.00 1.90 1.94 0.00 3.62 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 36 L 8.65 4.45 0.00 1.68 1.51 0.98 1.42 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 37 Y 8.48 5.27 0.00 3.10 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 38 Y 8.63 5.32 0.00 3.09 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 39 A 9.27 4.73 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 40 Y 9.03 4.90 0.00 3.32 3.09 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 41 S 8.94 4.16 0.00 3.79 3.64 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 42 D 9.18 4.51 0.00 3.00 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 43 A 7.53 3.89 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 44 H 7.70 5.34 0.00 2.98 2.54 0.00 5.78 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 45 L 8.62 5.08 0.00 1.48 1.52 0.60 1.12 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 46 Y 9.18 4.81 0.00 3.10 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 47 A 8.16 4.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 9.01 5.52 0.00 3.43 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 49 S 9.83 4.46 0.00 4.12 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 *51 P 0.00 4.44 0.00 2.16 2.06 0.00 3.98 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.16 0.00 52 G 8.16 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 53 K 8.19 3.57 0.00 1.50 1.48 0.00 1.00 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.72 7.81 54 K 7.93 3.97 0.00 1.85 1.96 0.00 1.52 0.00 0.00 1.58 0.00 0.00 3.04 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.41 7.81 55 I 7.49 3.50 1.98 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 1.59 0.85 0.92 0.00 0.00 56 E 8.37 4.21 0.00 2.21 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 0.00 2.53 2.54 0.00 57 W 8.46 4.30 0.00 3.35 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 *59 R 7.96 4.24 0.00 2.04 2.05 0.00 3.35 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 60 A 7.79 4.03 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 61 N 8.14 4.73 0.00 2.51 2.83 0.00 0.00 7.26 7.56 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 62 P 0.00 4.70 0.00 2.24 2.39 0.00 3.75 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 2.09 2.04 0.00 63 R 8.19 4.59 0.00 1.74 1.92 0.00 3.09 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 64 V 8.82 4.80 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 0.71 0.00 0.00 0.99 0.00 0.00 65 S 8.85 5.11 0.00 3.86 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 66 V 8.84 4.92 1.99 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 0.63 0.00 0.00 0.90 0.00 0.00 67 Q 8.91 5.15 0.00 2.07 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.54 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 68 V 8.74 4.89 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 1.10 0.00 0.00 0.86 0.00 0.00 69 D 8.65 5.45 0.00 2.78 2.56 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 70 E 9.21 4.83 0.00 2.06 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 0.00 2.27 2.37 0.00 71 H 8.90 5.03 0.00 3.11 3.34 0.00 5.84 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.63 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 73 Q 8.77 4.51 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.78 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 74 G 8.29 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 R 8.81 4.44 0.00 1.84 1.82 0.00 3.28 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.19 0.00 76 G 8.51 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 77 W 7.86 5.43 0.00 3.55 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 78 K 9.23 5.27 0.00 1.79 1.77 0.00 1.75 0.00 0.00 1.58 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.38 7.81 79 S 9.70 5.18 0.00 3.87 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 80 V 9.11 4.94 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 0.88 0.00 0.00 1.00 0.00 0.00 81 V 8.88 4.84 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 0.95 0.00 0.00 0.93 0.00 0.00 82 V 8.98 4.74 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 0.98 0.00 0.00 0.90 0.00 0.00 83 D 9.26 5.25 0.00 2.57 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 84 G 9.12 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 85 R 8.50 5.24 0.00 1.88 1.74 0.00 3.09 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 86 Y 9.06 4.59 0.00 2.84 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 87 E 9.02 4.30 0.00 1.58 1.60 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 0.00 2.11 2.10 0.00 88 E 8.24 3.83 0.00 1.85 1.75 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 2.30 2.51 0.00 89 L 8.27 4.36 0.00 1.16 1.29 -0.19 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.42 0.00 2.11 2.04 0.00 3.70 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 91 D 8.44 4.77 0.00 2.69 2.65 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 92 L 7.34 4.91 0.00 1.74 1.52 0.96 0.72 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 93 I 8.33 3.67 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 1.34 1.22 0.91 0.00 0.00 94 G 8.07 3.63 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 0.00 0.00 0.00 95 H 8.23 5.33 0.00 3.41 3.46 0.00 5.63 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.12 3.98 0.00 1.91 1.90 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.47 7.81 97 L 7.81 3.80 0.00 1.74 1.60 0.75 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.11 3.97 0.00 2.60 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.68 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 99 R 8.46 2.95 0.00 1.97 2.01 0.00 3.14 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.27 0.00 100 D 8.65 4.37 0.00 2.75 2.70 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 0.00 0.00 0.00 0.00 101 H 8.41 4.17 0.00 3.26 3.26 0.00 5.64 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 0.00 102 A 8.25 4.07 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 W 8.67 3.89 0.00 3.19 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 0.00 104 S 7.93 3.88 0.00 4.02 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 0.00 105 V 7.30 3.63 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 0.78 0.00 0.00 0.88 0.00 0.00 106 L 7.79 4.20 0.00 1.80 1.67 1.26 0.82 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 0.00 107 S 7.07 2.79 0.00 2.72 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 0.00 108 K 7.29 3.50 0.00 1.46 1.15 0.00 1.49 0.00 0.00 1.14 0.00 0.00 3.24 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.04 1.33 7.81 109 H 7.01 2.58 0.00 2.74 1.97 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.87 3.54 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 0.80 0.00 0.00 111 D 6.98 4.29 0.00 2.56 2.67 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 0.00 112 W 7.87 5.02 0.00 3.74 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 0.00 113 W 7.55 5.06 0.00 3.57 3.29 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 0.00 114 E 7.21 3.75 0.00 1.16 1.56 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 2.23 2.13 0.00 115 P 0.00 4.42 0.00 2.15 2.05 0.00 3.87 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 116 G 8.50 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 0.00 0.00 0.00 117 A 8.44 3.97 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 0.00 118 L 8.54 3.57 0.00 1.71 1.77 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 *128 S 7.64 3.45 0.00 3.36 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 0.00 129 A 7.67 4.22 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 0.00 130 P 0.00 4.74 0.00 2.19 2.16 0.00 3.73 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 1.88 1.95 0.00 131 H 7.62 4.69 0.00 3.36 3.75 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 9.38 4.35 2.45 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 1.14 0.00 0.00 1.08 0.00 0.00 133 F 8.98 5.32 0.00 3.01 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 0.00 134 F 8.09 4.95 0.00 2.70 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 0.00 135 R 8.54 4.67 0.00 1.12 0.84 0.00 2.21 0.00 0.00 2.64 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.20 0.00 136 I 8.38 4.78 1.84 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.12 0.92 0.00 0.00 137 L 8.66 4.21 0.00 1.95 1.49 0.78 0.89 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 0.00 138 I 8.26 4.10 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.64 0.92 0.00 0.00 139 E 9.00 4.43 0.00 1.97 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 2.26 2.41 0.00 140 Q 7.92 4.90 0.00 1.92 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.25 0.00 141 V 8.21 5.12 2.08 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 0.72 0.00 0.00 0.96 0.00 0.00 142 S 9.28 4.84 0.00 3.87 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 0.00 143 G 8.44 4.61 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 0.00 144 R 9.41 5.39 0.00 2.01 1.90 0.00 3.31 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 145 E 9.11 4.68 0.00 1.86 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.20 0.00 146 A 6.69 4.62 0.09 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 0.00 147 S 8.80 4.28 0.00 3.61 3.69 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.