NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 E 4.3363 8.5445 116.7550 55.8897 31.0004 175.7818 *0 F 4.3434 7.8263 118.8658 55.3709 40.1693 176.5038 1 M 3.5529 9.2050 123.2751 56.1169 32.2196 175.9392 2 I 4.3002 7.5841 118.8504 59.6660 38.7701 175.0500 3 A 5.1253 8.4533 125.9810 50.8638 20.9548 175.2972 4 S 5.5113 7.5447 107.0739 58.4062 65.7239 175.0322 5 V 4.2992 8.0846 120.8120 61.4040 34.6188 173.5463 6 R 4.8205 8.7421 127.9170 54.3047 32.8503 175.0891 7 G 4.4638 7.9907 112.0691 45.6352 0.0000 170.5771 8 E 4.4997 7.9801 120.4023 55.8090 31.1239 176.7953 9 V 4.0907 8.5707 127.5036 63.1544 31.8008 176.4574 10 L 4.2413 8.9047 129.9184 57.2814 42.2820 177.6512 11 E 4.6813 7.9795 115.0654 54.7013 33.3413 174.7826 12 V 4.2499 8.4469 121.2979 61.2304 32.3060 174.5844 13 A 4.4685 7.7203 131.5569 50.9332 20.7205 176.4890 14 L 4.4416 8.2117 116.0665 55.2689 42.1365 176.8790 15 D 5.0523 7.6936 117.3317 53.2666 41.6564 174.5829 16 H 5.0760 7.6685 114.1001 55.4308 32.0362 172.2501 17 V 4.6389 9.0021 116.7208 60.6196 35.0894 173.3951 18 V 4.7676 8.5818 122.5550 61.5330 33.7424 174.3153 19 I 4.7531 9.2349 130.3727 59.3618 39.5998 174.5858 20 E 4.5539 9.2216 129.9430 56.0583 30.4965 175.3042 21 A 4.6803 9.0249 130.3846 49.5806 19.3971 175.1556 22 A 3.4216 8.6386 127.4955 53.4603 15.4604 177.7735 23 G 4.1074 8.4173 110.5341 45.7286 0.0000 173.9944 24 V 3.6752 7.4099 120.3257 61.6220 32.6149 175.6942 25 G 4.0427 8.4477 116.5164 46.0506 0.0000 171.9722 26 Y 4.6063 9.0009 125.5695 56.6077 39.9382 174.9920 27 R 4.9559 8.6778 124.1423 55.0518 31.4365 175.3617 28 V 4.5381 8.6345 120.0544 59.6516 35.0790 174.7354 29 N 5.2999 7.9812 119.3384 52.0100 41.3599 173.6910 30 A 4.6472 7.9370 122.4030 50.7876 23.2141 176.2729 31 T 4.0058 8.4463 109.2727 60.9529 69.8085 173.6703 32 P 4.1614 0.0000 0.0000 66.2836 31.0964 177.9477 33 A 3.9517 8.1266 117.1849 55.8300 18.2716 178.9832 34 T 3.9871 7.9298 112.1367 66.8995 68.6635 176.0570 35 L 3.9079 8.0249 120.0834 58.2853 41.5059 179.4918 36 A 3.9851 8.2907 119.4591 55.4808 18.4482 178.9223 37 T 4.0256 7.4238 102.8257 62.4864 68.6727 173.7687 38 L 4.6715 8.0501 123.3524 53.1941 43.6098 175.8769 39 R 4.6021 8.1876 122.2096 53.9069 32.3232 175.7409 40 Q 4.2206 8.3780 123.0966 57.1994 29.8078 174.5368 41 G 4.2456 8.8367 111.5571 45.3554 0.0000 174.2688 42 T 4.4630 7.1383 107.5396 60.1773 70.8608 174.6598 43 E 4.7221 8.6999 123.5010 56.8403 30.8607 175.4302 44 A 4.5484 8.2619 122.2255 51.2397 23.3599 175.4033 45 R 5.1535 8.4789 119.5460 53.4739 33.0419 174.2010 46 L 4.9444 8.4793 125.5540 52.9528 45.0432 175.4663 47 I 4.6382 8.5268 124.7221 61.0029 38.2146 174.9988 48 T 5.0808 9.1392 117.9586 60.0243 71.7950 173.0592 49 A 4.8912 9.3473 125.8290 50.8297 21.2313 175.3768 50 M 5.0139 8.7796 122.4594 53.9537 34.4609 175.1006 51 I 4.6108 9.1573 126.5591 59.6749 40.6403 174.3306 52 V 4.8319 8.5681 127.2045 61.3289 33.1126 174.8454 53 R 4.7803 8.6559 125.9251 54.2656 33.8120 175.4503 54 E 3.7419 8.8152 118.0377 59.1850 29.6331 177.1934 55 D 4.9459 7.3117 116.5833 53.2049 42.5774 175.0160 56 S 4.5462 7.4898 111.2797 58.1274 64.8484 174.8258 57 M 5.1736 8.5520 120.5168 54.5492 34.9379 174.5908 58 T 4.6692 8.9826 120.9251 61.7431 72.0008 173.6975 59 L 5.2331 8.1174 123.5046 53.3065 44.8274 174.8805 60 Y 4.6358 9.5416 120.8271 56.0190 40.9992 174.8748 61 G 4.1307 8.7360 112.1899 44.6350 0.0000 172.3963 62 F 5.1720 8.2602 119.8532 55.4892 43.8035 173.6030 63 P 4.5309 0.0000 0.0000 64.6411 32.0225 176.1458 64 D 4.8409 7.6774 117.8829 51.3121 43.2325 176.0302 65 G 3.7251 8.6196 106.5097 47.1482 0.0000 175.9170 66 E 3.7371 8.1221 120.6620 59.3945 29.4463 179.2793 67 T 3.8617 7.5691 115.4490 66.4428 68.7431 176.7169 68 R 2.9354 7.7796 120.5529 59.5149 30.0526 178.1028 69 D 4.3520 8.6805 119.0607 57.2476 40.7445 178.4629 70 L 3.8553 7.4401 119.3933 58.0909 42.1140 178.3458 71 F 4.0530 7.9902 120.4361 61.6973 38.9688 176.8475 72 L 3.6508 7.7759 117.0146 58.2432 41.6882 179.6290 73 T 3.9062 7.6341 115.0358 66.7023 68.4567 176.3080 74 L 3.8013 7.8551 120.9243 58.2474 41.4643 179.8588 75 L 3.9114 7.2008 116.8670 57.2012 41.5350 179.0160 76 S 4.2118 8.2939 113.0339 58.7081 63.5697 174.1387 77 V 3.9600 7.2685 124.0645 61.3806 32.2978 174.8984 78 S 4.2721 8.4853 123.0887 62.0722 62.4743 174.1293 79 G 3.9107 9.0743 113.8718 45.0187 0.0000 172.4508 80 V 4.0583 7.6818 119.7847 61.0440 31.8211 176.2307 81 G 4.0343 8.1772 114.2442 42.6619 0.0000 171.2909 82 P 4.2418 0.0000 0.0000 65.6997 31.3489 178.9393 83 R 4.0511 8.2078 116.2061 59.6121 29.9427 178.2156 84 L 3.9135 8.0722 118.8314 58.2724 42.1317 178.3607 85 A 4.0533 8.3005 120.5263 55.8635 18.3294 179.4749 86 M 4.1835 8.8085 117.0199 58.6708 31.8223 178.9167 87 A 4.1040 7.9580 119.8075 54.8506 18.7557 179.2587 88 A 4.1414 8.3740 119.8322 55.3921 18.3345 179.8725 89 L 4.4603 8.4358 118.6558 57.0747 41.5450 179.3205 90 A 4.1848 8.1095 119.9517 54.2544 18.2577 178.1726 91 V 4.0764 7.2625 114.0839 63.2913 33.5551 174.9774 92 H 4.7112 8.5556 117.3244 53.2183 30.3564 172.9937 93 D 4.6478 8.6639 124.4844 54.4305 42.5373 176.8198 94 A 3.9551 8.6213 121.3120 55.0344 18.0996 177.8631 95 P 4.1466 0.0000 0.0000 65.7969 31.4767 178.3908 96 A 4.0251 8.1502 118.6299 55.3323 18.1457 179.3133 97 L 3.8330 8.2788 118.7557 58.4131 42.3229 179.0052 98 R 3.8761 8.1491 118.3365 59.7548 30.0178 178.6831 99 Q 3.9742 7.8989 119.0288 58.8106 29.0611 177.9229 100 V 3.5605 7.4668 119.5207 66.2757 31.3688 178.1255 101 L 4.1184 8.0724 118.1850 57.3244 40.9397 179.4491 102 A 3.9458 7.9354 120.9648 55.3840 18.2429 179.5026 103 D 4.1427 8.3109 116.0772 55.2670 40.8241 177.3673 104 G 3.8232 7.3235 106.6570 46.9258 0.0000 175.3399 105 N 4.6541 8.3390 119.1533 51.9756 35.2289 174.4107 106 V 3.5187 7.8333 124.7393 65.8132 31.8291 176.3783 107 A 3.9605 8.0654 118.0960 55.5424 18.4012 178.7118 108 A 4.0873 8.0174 118.2355 55.7394 18.3615 179.6227 109 L 3.9567 7.8433 116.1441 58.4723 41.5558 180.1025 110 T 4.0719 8.1246 114.8037 66.3465 68.4059 175.9662 111 R 4.1648 7.8400 117.5847 56.0759 30.3230 176.4635 112 V 4.0120 7.5961 120.8899 60.8477 32.5060 173.3199 113 P 4.3825 0.0000 0.0000 65.2535 31.1292 176.3510 114 G 3.9881 9.2572 111.7724 45.0917 0.0000 172.8777 115 I 4.2784 7.1981 120.0578 58.7699 38.2471 176.3804 116 G 3.9769 8.3130 116.0424 44.2697 0.0000 172.0623 117 K 3.9348 8.5691 123.7114 60.1172 31.3859 174.7267 118 R 4.2100 8.0580 117.8196 59.1627 30.3943 178.9545 119 G 3.7020 8.1211 104.3961 47.8524 0.0000 175.0161 120 A 3.9965 7.8716 123.7292 55.0480 18.3508 179.5051 121 E 4.0483 8.2405 116.3825 58.9402 29.6506 179.2296 122 R 3.9060 7.9289 118.9566 59.8508 29.9805 178.0536 123 M 4.0131 7.9966 118.1242 58.2551 32.0451 178.3382 124 V 3.5249 7.8629 117.6956 66.2330 31.4080 178.2987 125 L 3.9194 7.8022 119.0317 58.0998 42.1773 178.2811 126 E 4.2574 8.1144 115.7553 57.4789 30.0063 177.6133 127 L 4.6381 8.1155 117.8595 54.2208 43.4428 178.2179 128 R 4.3642 7.8461 122.4632 59.6804 29.8501 178.4264 129 D 4.5184 8.0144 119.9799 58.2730 39.7070 179.9834 130 K 4.0779 7.9355 117.8850 57.9841 32.1156 177.3643 131 V 3.9045 7.0885 123.5272 62.7881 31.4576 175.0966 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 E 8.54 4.34 0.00 2.01 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 0.00 2.13 1.88 0.00 *0 F 7.83 4.34 0.00 2.36 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 1 M 9.21 3.55 0.00 2.17 2.27 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 2 I 7.58 4.30 1.84 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.72 0.79 0.00 0.00 3 A 8.45 5.13 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 4 S 7.54 5.51 0.00 3.89 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 5 V 8.08 4.30 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 0.82 0.00 0.00 0.67 0.00 0.00 6 R 8.74 4.82 0.00 1.81 1.75 0.00 3.51 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 1.58 1.66 0.00 7 G 7.99 4.46 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 0.00 0.00 0.00 8 E 7.98 4.50 0.00 2.07 1.83 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 2.37 2.50 0.00 9 V 8.57 4.09 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 0.87 0.00 0.00 0.97 0.00 0.00 10 L 8.90 4.24 0.00 1.56 1.69 0.93 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 11 E 7.98 4.68 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 2.27 2.32 0.00 12 V 8.45 4.25 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 0.80 0.00 0.00 0.91 0.00 0.00 13 A 7.72 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.21 4.44 0.00 1.62 1.69 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 15 D 7.69 5.05 0.00 2.67 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 16 H 7.67 5.08 0.00 3.36 3.36 0.00 5.46 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 9.00 4.64 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 0.54 0.00 0.00 1.00 0.00 0.00 18 V 8.58 4.77 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 1.08 0.00 0.00 0.93 0.00 0.00 19 I 9.23 4.75 1.93 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.48 0.96 0.00 0.00 20 E 9.22 4.55 0.00 2.04 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 2.30 2.25 0.00 21 A 9.02 4.68 1.44 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 0.00 0.00 0.00 22 A 8.64 3.42 1.41 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 0.00 0.00 23 G 8.42 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 24 V 7.41 3.68 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 0.10 0.00 0.00 0.83 0.00 0.00 25 G 8.45 4.04 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 0.00 0.00 0.00 26 Y 9.00 4.61 0.00 3.05 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 27 R 8.68 4.96 0.00 1.74 1.78 0.00 2.97 0.00 0.00 3.09 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.50 0.00 28 V 8.63 4.54 1.91 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 0.59 0.00 0.00 0.91 0.00 0.00 29 N 7.98 5.30 0.00 2.27 2.70 0.00 0.00 6.84 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 30 A 7.94 4.65 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.45 4.01 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 1.34 0.00 0.00 32 P 0.00 4.16 0.00 2.18 2.18 0.00 3.64 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 2.14 2.20 0.00 33 A 8.13 3.95 1.31 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 0.00 0.00 34 T 7.93 3.99 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 1.20 0.00 0.00 35 L 8.02 3.91 0.00 1.82 1.71 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.29 3.99 1.37 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 37 T 7.42 4.03 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 1.21 0.00 0.00 38 L 8.05 4.67 0.00 1.74 1.60 0.89 0.76 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 39 R 8.19 4.60 0.00 1.80 1.80 0.00 3.29 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.52 0.00 40 Q 8.38 4.22 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.64 0.00 0.00 0.00 0.00 0.00 2.33 2.55 0.00 41 G 8.84 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 0.00 0.00 0.00 0.00 42 T 7.14 4.46 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 1.21 0.00 0.00 43 E 8.70 4.72 0.00 2.01 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 2.37 2.32 0.00 44 A 8.26 4.55 1.20 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 0.00 0.00 45 R 8.48 5.15 0.00 1.77 1.77 0.00 3.02 0.00 0.00 2.25 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.47 0.00 46 L 8.48 4.94 0.00 1.60 1.45 0.89 0.66 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 47 I 8.53 4.64 1.98 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.67 1.03 0.00 0.00 48 T 9.14 5.08 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 1.21 0.00 0.00 49 A 9.35 4.89 1.64 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 0.00 0.00 50 M 8.78 5.01 0.00 2.34 2.00 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 2.55 2.60 0.00 51 I 9.16 4.61 2.15 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.78 1.00 0.00 0.00 52 V 8.57 4.83 2.11 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 0.84 0.00 0.00 0.97 0.00 0.00 53 R 8.66 4.78 0.00 1.85 1.82 0.00 3.36 0.00 0.00 3.11 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 54 E 8.82 3.74 0.00 1.93 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 2.30 2.34 0.00 55 D 7.31 4.95 0.00 2.56 2.60 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 0.00 0.00 0.00 56 S 7.49 4.55 0.00 3.96 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 57 M 8.55 5.17 0.00 1.90 2.02 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 58 T 8.98 4.67 4.49 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 0.88 0.00 0.00 59 L 8.12 5.23 0.00 1.66 1.45 0.85 0.79 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 60 Y 9.54 4.64 0.00 2.77 2.29 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 61 G 8.74 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 F 8.26 5.17 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 63 P 0.00 4.53 0.00 2.21 2.21 0.00 3.93 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 64 D 7.68 4.84 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 65 G 8.62 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 66 E 8.12 3.74 0.00 2.26 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 2.40 2.45 0.00 67 T 7.57 3.86 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 68 R 7.78 2.94 0.00 2.27 2.11 0.00 3.39 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.09 0.00 69 D 8.68 4.35 0.00 2.75 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 70 L 7.44 3.86 0.00 1.74 1.80 0.88 0.82 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 71 F 7.99 4.05 0.00 2.65 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 72 L 7.78 3.65 0.00 1.82 1.67 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.63 3.91 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 1.16 0.00 0.00 74 L 7.86 3.80 0.00 1.62 1.65 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.20 3.91 0.00 1.58 1.51 0.41 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.29 4.21 0.00 3.92 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 77 V 7.27 3.96 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 0.99 0.00 0.00 0.93 0.00 0.00 78 S 8.49 4.27 0.00 3.88 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 79 G 9.07 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 0.00 0.00 0.00 80 V 7.68 4.06 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 0.74 0.00 0.00 0.94 0.00 0.00 81 G 8.18 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 82 P 0.00 4.24 0.00 2.34 1.92 0.00 3.65 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.10 0.00 83 R 8.21 4.05 0.00 1.91 2.10 0.00 3.19 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.82 0.00 84 L 8.07 3.91 0.00 1.78 1.94 0.95 1.01 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 85 A 8.30 4.05 1.45 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 0.00 0.00 0.00 86 M 8.81 4.18 0.00 2.14 2.47 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 3.09 0.00 87 A 7.96 4.10 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 88 A 8.37 4.14 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 89 L 8.44 4.46 0.00 1.85 1.81 1.13 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.11 4.18 1.41 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 0.00 0.00 91 V 7.26 4.08 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 0.81 0.00 0.00 1.02 0.00 0.00 92 H 8.56 4.71 0.00 3.40 3.19 0.00 5.89 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 D 8.66 4.65 0.00 2.70 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 94 A 8.62 3.96 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 95 P 0.00 4.15 0.00 2.17 2.14 0.00 3.63 0.00 0.00 3.77 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 96 A 8.15 4.03 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 97 L 8.28 3.83 0.00 2.00 1.83 0.93 0.84 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 98 R 8.15 3.88 0.00 1.86 1.99 0.00 3.30 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.92 0.00 99 Q 7.90 3.97 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 100 V 7.47 3.56 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 0.92 0.00 0.00 0.92 0.00 0.00 101 L 8.07 4.12 0.00 1.90 1.67 0.89 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 102 A 7.94 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.31 4.14 0.00 2.77 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 0.00 104 G 7.32 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 0.00 105 N 8.34 4.65 0.00 2.80 2.72 0.00 0.00 6.85 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 0.00 106 V 7.83 3.52 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 1.07 0.00 0.00 0.96 0.00 0.00 107 A 8.07 3.96 1.32 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 0.00 108 A 8.02 4.09 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 0.00 109 L 7.84 3.96 0.00 1.83 1.75 0.91 1.00 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 0.00 110 T 8.12 4.07 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 1.22 0.00 0.00 111 R 7.84 4.16 0.00 2.00 1.98 0.00 3.44 0.00 0.00 3.16 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 112 V 7.60 4.01 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 1.00 0.00 0.00 1.01 0.00 0.00 113 P 0.00 4.38 0.00 2.10 2.02 0.00 3.72 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 2.05 2.10 0.00 114 G 9.26 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 0.00 0.00 0.00 115 I 7.20 4.28 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.74 0.92 0.00 0.00 116 G 8.31 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 0.00 117 K 8.57 3.93 0.00 1.77 1.84 0.00 1.82 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.11 7.81 118 R 8.06 4.21 0.00 1.77 2.04 0.00 3.18 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 119 G 8.12 3.70 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 0.00 0.00 0.00 120 A 7.87 4.00 1.41 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 0.00 0.00 121 E 8.24 4.05 0.00 2.04 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 2.31 2.55 0.00 122 R 7.93 3.91 0.00 2.06 1.91 0.00 3.23 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.66 0.00 123 M 8.00 4.01 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.57 0.00 124 V 7.86 3.52 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 0.98 0.00 0.00 1.01 0.00 0.00 125 L 7.80 3.92 0.00 1.68 1.86 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 126 E 8.11 4.26 0.00 1.96 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 2.30 2.63 0.00 127 L 8.12 4.64 0.00 1.67 1.62 0.88 0.76 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 0.00 128 R 7.85 4.36 0.00 2.20 1.97 0.00 3.10 0.00 0.00 3.10 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 129 D 8.01 4.52 0.00 2.72 2.66 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 0.00 130 K 7.94 4.08 0.00 1.86 1.87 0.00 1.82 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.42 7.81 131 V 7.09 3.90 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 0.76 0.00 0.00 0.90 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.