NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *10 G 3.9110 8.3544 109.7364 45.1335 0.0000 174.4323 11 R 3.9977 8.3921 121.9178 56.0473 30.8343 174.1671 12 Q 4.5413 8.2338 122.5268 53.5251 33.2582 175.0729 13 S 4.0956 7.2086 115.3064 57.7322 63.5609 173.6948 14 K 4.3837 8.3408 120.4960 56.1136 34.9961 176.4995 15 G 3.9075 8.8813 107.0671 44.6919 0.0000 172.2800 16 V 4.4516 8.2086 117.7096 59.4857 33.8638 175.4469 17 L 3.6488 8.5706 125.2058 56.1339 41.7698 176.0611 18 L 4.4042 8.8516 126.6625 56.3997 42.9578 177.0936 19 L 4.7122 7.2970 116.4741 53.3109 46.4813 175.0959 20 R 5.0962 8.2859 121.3093 55.4131 33.1861 173.6876 21 T 4.6792 9.0505 119.6129 61.3296 71.8308 171.1967 22 L 5.1530 8.3958 125.1917 53.0087 44.2083 175.4392 23 A 3.8791 8.7442 128.1982 51.9920 19.5381 176.3687 24 M 4.8171 7.9864 121.4161 52.6314 35.3349 175.2634 25 P 4.1894 0.0000 0.0000 65.8036 31.6580 178.9226 26 S 4.1862 7.9728 110.8920 60.3434 63.2273 174.2897 27 D 4.8375 7.9357 121.4421 54.1776 40.7806 176.1973 28 T 4.7321 7.2635 109.8975 60.7486 70.3233 173.9536 29 N 4.7406 8.9188 120.6617 51.0796 39.6278 175.5864 30 A 4.0088 8.3661 119.9249 55.3084 18.4411 178.6154 31 N 4.4076 7.9802 111.7637 54.6440 38.7341 176.3999 32 G 3.9040 8.2670 106.5694 44.9347 0.0000 173.1715 33 D 4.8343 7.7029 119.5491 53.1440 43.0878 175.4544 34 I 4.2350 8.4151 121.8190 61.0052 37.7674 176.5218 35 F 4.3535 9.3619 130.1135 58.5890 40.0020 176.4372 36 G 3.4142 8.8498 112.2470 47.7053 0.0000 176.1001 37 G 2.9683 5.3800 107.3052 46.9518 0.0000 175.4188 38 W 4.1557 7.5810 130.0572 60.3478 30.7704 178.2200 39 I 3.6832 7.9517 119.3037 64.7357 36.6891 178.0349 40 M 4.1523 8.2400 119.5322 58.6889 31.7844 179.1108 41 S 4.0894 7.9359 115.1862 61.5248 62.9409 176.7522 42 Q 3.6528 7.5664 120.7086 59.0075 28.2769 178.6423 43 M 3.9273 8.0248 119.4573 58.3094 32.0217 178.7170 44 A 3.2216 7.9630 120.7870 55.1404 18.6264 179.3827 45 M 3.9794 8.0081 116.8677 58.5384 32.1428 178.7913 46 G 3.4915 8.1271 106.0935 47.5750 0.0000 175.7852 47 G 3.5408 8.0152 108.7895 47.5167 0.0000 175.4449 48 A 2.9755 7.7481 123.4546 54.3794 18.2113 179.7622 49 I 3.4735 7.3131 117.7304 64.4559 37.1188 178.4471 50 L 4.2419 7.7432 122.0551 57.4282 41.7830 178.7360 51 A 3.8222 7.5656 120.7342 55.1295 18.3495 179.8250 52 K 4.0830 7.9495 118.4770 58.8815 31.9163 179.5136 53 E 3.8962 8.2842 119.0463 59.6266 29.2361 179.5207 54 I 3.7292 7.8560 118.4341 63.9454 37.2936 177.5851 55 A 4.2952 8.3171 119.8712 51.5913 18.8502 176.8555 56 H 4.1742 8.3165 113.1073 54.4033 27.2049 175.8748 57 G 3.8785 6.5987 103.6187 45.8824 0.0000 172.5359 58 R 4.1197 8.0030 120.1036 56.8127 31.3365 176.3743 59 V 5.2017 8.2354 114.2957 59.7331 36.2717 174.8171 60 V 4.6708 8.8124 120.6885 60.3004 34.8102 175.0212 61 T 4.4307 8.6233 119.0556 63.2280 69.2746 174.9827 62 V 4.4312 8.3417 118.6464 61.8573 34.3661 175.7425 63 A 4.5221 7.4440 119.7529 50.6279 22.8075 175.7699 64 V 4.2796 7.9463 119.1441 60.8176 32.6686 174.9020 65 E 4.1364 8.4375 126.8523 58.6361 30.4553 177.2953 66 S 4.6239 7.5908 113.5449 56.9263 66.2644 172.4409 67 M 5.0080 8.2228 124.2639 54.3008 35.4807 173.3583 68 N 4.7812 8.8123 122.7003 51.4438 42.3322 173.4221 69 F 4.6844 8.7325 123.2987 56.8713 39.1977 175.6404 70 I 4.2019 8.8258 125.6685 62.9704 37.6704 176.8048 71 K 4.7182 7.7775 117.8534 53.8294 36.1303 174.1109 72 P 4.6813 0.0000 0.0000 62.9873 32.5774 175.3847 73 I 4.5530 8.3281 121.1971 60.1728 39.7398 174.8917 74 S 5.0746 8.9697 121.5697 56.2652 65.8128 174.1258 75 V 3.6134 8.2454 122.1551 64.6269 31.6146 176.7404 76 G 3.9988 8.7765 114.8662 45.3048 0.0000 173.5815 77 D 4.4973 7.6457 120.0737 54.6567 42.2117 176.0233 78 V 4.2951 8.6255 122.9173 62.6752 33.1188 174.7829 79 V 4.9776 8.9974 127.7457 61.3903 34.2523 173.8920 80 C 5.3808 9.3974 125.2398 58.1289 32.0842 172.5788 81 C 5.3755 8.6204 119.6394 58.2622 30.6508 172.5831 82 Y 5.0053 9.5064 121.6127 56.0652 41.0527 174.9997 83 G 4.5026 9.2529 109.5347 44.4421 0.0000 171.3133 84 Q 4.8596 9.2375 124.9989 53.9232 31.9535 173.8618 85 C 4.6643 8.8400 127.9160 59.6851 31.5211 172.9703 86 L 4.4634 8.9778 127.0404 56.5583 42.6747 177.0937 87 K 4.4712 7.5582 116.7564 55.5289 35.6089 174.5274 88 V 4.7682 8.4604 125.6678 61.1453 34.2544 175.3202 89 G 4.1206 8.8069 118.5850 44.5567 0.0000 172.5555 90 R 4.0481 8.8227 118.5831 59.0393 30.3687 179.0130 91 S 4.8740 8.0203 109.9147 57.8692 65.7790 173.7744 92 S 5.2144 8.0318 115.5013 57.4658 65.5074 173.2544 93 I 5.0147 8.9874 122.1578 59.7081 41.0646 173.9448 94 K 5.1083 9.0358 128.9338 54.9625 34.2930 175.0813 95 I 5.1476 9.1482 127.8643 59.5162 41.4109 174.1760 96 K 4.8240 9.1182 129.1497 55.7772 33.6854 175.3347 97 V 5.0045 9.1349 127.8427 61.2625 34.1180 173.8864 98 E 5.2426 9.2669 127.1463 54.6991 32.5711 174.8850 99 V 4.9804 9.0467 124.0355 61.3040 33.5391 174.5963 100 W 5.2488 9.7652 127.4804 55.0033 32.9466 174.8540 101 V 5.0234 8.5007 115.3855 59.4797 34.8449 174.5912 102 K 5.0180 8.7868 124.1666 54.5737 35.5273 175.1646 103 K 4.6348 8.9895 127.2796 56.0838 32.2661 177.6760 104 V 3.6540 8.6231 118.0427 61.6201 33.8440 176.5788 105 A 4.7802 7.7508 121.6556 50.9765 19.6987 175.2851 106 S 4.6475 7.9071 111.9044 58.9860 65.8179 172.7067 107 E 4.7888 8.4250 120.8400 54.1522 30.7565 174.2349 108 P 4.5711 0.0000 0.0000 61.8449 32.5305 176.0189 109 I 3.9588 7.1867 121.5140 62.2066 37.5588 176.1368 110 G 4.1255 9.5239 113.4097 45.4754 0.0000 174.0069 111 E 4.2354 7.7359 120.6611 56.6153 30.6680 176.1100 112 R 5.7779 8.7722 124.3031 53.8956 33.8615 173.9772 113 Y 4.6893 7.6965 118.5184 56.2047 41.3925 172.5193 114 C 3.5321 7.5644 120.9303 58.8548 31.6381 173.3098 115 V 4.3845 8.5445 119.0799 62.5272 34.0027 175.8724 116 T 5.0285 7.3652 115.0285 62.4922 72.9345 172.3419 117 D 5.4237 8.6158 123.9684 52.1257 43.7652 173.7299 118 A 4.7500 8.5899 118.2769 51.2450 23.0997 175.5148 119 V 4.7947 8.3245 119.2659 61.2978 34.3551 174.4897 120 F 4.7447 9.5940 127.1928 56.1067 41.7829 174.9475 121 T 5.0533 8.6666 118.8805 61.9056 71.2491 173.2950 122 F 5.4012 9.5505 125.1081 55.6500 42.8625 174.6073 123 V 4.9554 8.6888 120.2129 60.9007 34.5792 174.6542 124 A 4.6464 9.2016 130.5508 52.2378 19.3099 176.7208 125 V 5.0400 8.5199 114.7861 59.5762 36.3151 175.6091 126 D 4.7470 8.7546 122.4356 52.2786 41.2844 176.7774 127 N 4.3579 8.6830 115.3685 56.4443 38.4339 175.8344 128 N 4.5246 8.3104 112.9587 53.3071 39.1047 175.7931 129 G 3.9160 8.2772 106.7290 45.5633 0.0000 173.5859 130 R 4.5215 8.2410 118.7060 53.8423 31.7797 176.0127 131 S 4.5876 8.5664 115.2089 59.1846 62.7786 173.6987 132 R 4.8108 8.6268 122.4476 54.4293 32.6722 174.8716 133 T 4.2693 8.4642 117.5678 63.2890 69.1541 174.5389 134 I 3.8670 8.6388 129.0393 60.7033 37.6206 174.5315 135 P 4.3322 0.0000 0.0000 62.9737 31.8611 176.2728 136 R 4.2226 8.4308 120.6743 57.6535 30.1890 176.9965 137 E 3.8591 8.0637 119.2852 57.5273 30.2756 176.0362 138 N 4.1561 8.4924 125.2684 54.4957 37.5815 175.4181 139 N 4.7263 7.2365 117.2841 52.3065 39.0199 173.3779 140 Q 4.0360 8.3031 126.5662 58.2830 29.2473 177.7722 141 E 4.0212 8.2527 119.6085 59.0381 29.5972 178.8062 142 L 3.9540 8.3260 120.5551 57.9494 42.1926 178.5269 143 E 3.9007 8.3385 119.4254 59.2697 29.4363 178.6955 144 K 3.9178 8.0153 119.2467 59.4475 32.2410 178.6176 145 A 4.0142 7.9188 120.6069 55.1972 18.3166 179.6754 146 L 3.9648 8.1499 117.3751 57.7992 41.4453 179.5413 147 A 4.0788 7.8881 119.9565 55.1552 18.4381 179.4113 148 L 4.1094 7.7455 117.5744 57.8482 41.4676 179.6851 149 I 3.7129 7.6742 118.9752 64.5665 37.1389 178.0978 150 S 4.2864 8.3018 115.5455 60.7110 62.6942 174.4586 151 E 4.2717 7.8683 123.0882 56.2835 29.4519 175.4487 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 *10 G 8.35 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 11 R 8.39 4.00 0.00 1.96 2.02 0.00 3.20 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.88 0.00 12 Q 8.23 4.54 0.00 1.94 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.73 0.00 0.00 0.00 0.00 0.00 2.19 2.47 0.00 13 S 7.21 4.10 0.00 2.72 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 14 K 8.34 4.38 0.00 1.87 1.75 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.51 1.58 7.81 15 G 8.88 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 16 V 8.21 4.45 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 0.77 0.00 0.00 0.93 0.00 0.00 17 L 8.57 3.65 0.00 1.50 1.52 0.30 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.85 4.40 0.00 1.38 1.69 0.90 0.89 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 19 L 7.30 4.71 0.00 1.42 1.40 0.83 0.65 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 20 R 8.29 5.10 0.00 1.69 1.71 0.00 3.22 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 21 T 9.05 4.68 4.33 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 0.00 0.00 0.00 1.55 0.00 0.00 22 L 8.40 5.15 0.00 1.68 1.53 1.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.74 3.88 1.12 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 24 M 7.99 4.82 0.00 1.86 1.84 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.63 0.00 25 P 0.00 4.19 0.00 2.13 2.07 0.00 3.55 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 2.08 2.05 0.00 26 S 7.97 4.19 0.00 3.96 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 27 D 7.94 4.84 0.00 2.32 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 0.00 0.00 0.00 0.00 28 T 7.26 4.73 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 1.25 0.00 0.00 29 N 8.92 4.74 0.00 2.95 3.14 0.00 0.00 7.19 7.35 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 30 A 8.37 4.01 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 31 N 7.98 4.41 0.00 2.93 2.89 0.00 0.00 7.21 8.06 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 32 G 8.27 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 33 D 7.70 4.83 0.00 2.64 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 34 I 8.42 4.23 1.87 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.48 0.76 0.00 0.00 35 F 9.36 4.35 0.00 2.99 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 36 G 8.85 3.41 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 0.00 37 G 5.38 2.97 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 38 W 7.58 4.16 0.00 3.59 3.45 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 39 I 7.95 3.68 2.22 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.99 1.06 0.00 0.00 40 M 8.24 4.15 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.05 2.78 0.00 41 S 7.94 4.09 0.00 3.80 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 42 Q 7.57 3.65 0.00 1.77 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 43 M 8.02 3.93 0.00 2.26 2.39 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.60 0.00 44 A 7.96 3.22 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.01 3.98 0.00 2.12 1.96 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 2.51 2.44 0.00 46 G 8.13 3.49 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 0.00 47 G 8.02 3.54 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 48 A 7.75 2.98 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 49 I 7.31 3.47 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.69 0.82 0.00 0.00 50 L 7.74 4.24 0.00 1.61 1.67 0.88 1.45 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 51 A 7.57 3.82 0.75 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 52 K 7.95 4.08 0.00 1.85 1.79 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.33 7.81 53 E 8.28 3.90 0.00 2.12 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 0.00 2.27 2.40 0.00 54 I 7.86 3.73 1.84 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 1.45 0.53 0.91 0.00 0.00 55 A 8.32 4.30 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 56 H 8.32 4.17 0.00 3.29 3.38 0.00 5.81 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 6.60 3.88 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 0.00 0.00 0.00 58 R 8.00 4.12 0.00 2.00 1.87 0.00 3.08 0.00 0.00 3.34 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 59 V 8.24 5.20 2.24 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 0.70 0.00 0.00 0.87 0.00 0.00 60 V 8.81 4.67 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 0.82 0.00 0.00 0.97 0.00 0.00 61 T 8.62 4.43 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 1.13 0.00 0.00 62 V 8.34 4.43 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 0.67 0.00 0.00 0.93 0.00 0.00 63 A 7.44 4.52 1.10 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 0.00 0.00 64 V 7.95 4.28 1.73 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 0.05 0.00 0.00 0.27 0.00 0.00 65 E 8.44 4.14 0.00 1.96 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 2.38 2.18 0.00 66 S 7.59 4.62 0.00 3.79 3.57 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 0.00 0.00 0.00 67 M 8.22 5.01 0.00 1.78 1.59 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.82 0.00 68 N 8.81 4.78 0.00 2.65 2.58 0.00 0.00 6.73 8.81 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 69 F 8.73 4.68 0.00 2.97 3.04 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 70 I 8.83 4.20 1.89 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.47 0.87 0.00 0.00 71 K 7.78 4.72 0.00 1.83 1.72 0.00 1.56 0.00 0.00 1.67 0.00 0.00 2.32 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.29 1.40 7.81 72 P 0.00 4.68 0.00 2.12 2.09 0.00 3.79 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 2.04 2.03 0.00 73 I 8.33 4.55 1.93 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.85 1.00 0.00 0.00 74 S 8.97 5.07 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 75 V 8.25 3.61 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 0.73 0.00 0.00 0.86 0.00 0.00 76 G 8.78 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.65 4.50 0.00 2.73 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 78 V 8.63 4.30 2.20 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 0.99 0.00 0.00 0.95 0.00 0.00 79 V 9.00 4.98 2.37 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 1.16 0.00 0.00 1.16 0.00 0.00 80 C 9.40 5.38 0.00 3.07 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 81 C 8.62 5.38 0.00 2.74 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 82 Y 9.51 5.01 0.00 3.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 G 9.25 4.50 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 0.00 0.00 0.00 84 Q 9.24 4.86 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.95 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 85 C 8.84 4.66 0.00 3.05 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 86 L 8.98 4.46 0.00 1.57 1.73 0.96 0.75 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 87 K 7.56 4.47 0.00 1.80 1.60 0.00 1.67 0.00 0.00 1.76 0.00 0.00 2.77 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.40 7.81 88 V 8.46 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 0.94 0.00 0.00 0.95 0.00 0.00 89 G 8.81 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 0.00 0.00 0.00 0.00 90 R 8.82 4.05 0.00 1.86 1.94 0.00 3.12 0.00 0.00 3.39 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 91 S 8.02 4.87 0.00 3.91 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 0.00 92 S 8.03 5.21 0.00 3.96 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 93 I 8.99 5.01 2.01 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 1.14 0.67 0.97 0.00 0.00 94 K 9.04 5.11 0.00 1.88 1.71 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.43 7.81 95 I 9.15 5.15 2.16 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 1.18 0.63 1.00 0.00 0.00 96 K 9.12 4.82 0.00 1.90 1.74 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.52 7.81 97 V 9.13 5.00 2.28 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 1.01 0.00 0.00 0.99 0.00 0.00 98 E 9.27 5.24 0.00 2.37 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 2.35 2.39 0.00 99 V 9.05 4.98 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 1.22 0.00 0.00 0.99 0.00 0.00 100 W 9.77 5.25 0.00 3.42 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 0.00 101 V 8.50 5.02 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 0.78 0.00 0.00 0.28 0.00 0.00 102 K 8.79 5.02 0.00 1.84 1.64 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.41 7.81 103 K 8.99 4.63 0.00 1.84 1.98 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.58 1.77 7.81 104 V 8.62 3.65 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 0.74 0.00 0.00 0.94 0.00 0.00 105 A 7.75 4.78 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.91 4.65 0.00 3.98 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 0.00 107 E 8.42 4.79 0.00 1.99 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 2.26 2.23 0.00 108 P 0.00 4.57 0.00 2.26 2.20 0.00 3.86 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.02 0.00 109 I 7.19 3.96 1.89 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 1.20 1.05 0.93 0.00 0.00 110 G 9.52 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 0.00 111 E 7.74 4.24 0.00 2.25 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 0.00 2.71 2.49 0.00 112 R 8.77 5.78 0.00 1.89 2.09 0.00 3.39 0.00 0.00 3.93 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 113 Y 7.70 4.69 0.00 2.89 3.01 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 0.00 114 C 7.56 3.53 0.00 1.23 2.24 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 0.00 115 V 8.54 4.38 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 0.79 0.00 0.00 1.02 0.00 0.00 116 T 7.37 5.03 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 1.12 0.00 0.00 117 D 8.62 5.42 0.00 2.86 2.71 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 0.00 118 A 8.59 4.75 1.13 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 0.00 119 V 8.32 4.79 2.02 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 0.98 0.00 0.00 0.93 0.00 0.00 120 F 9.59 4.74 0.00 3.20 2.44 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 0.00 121 T 8.67 5.05 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 1.21 0.00 0.00 122 F 9.55 5.40 0.00 2.97 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 0.00 123 V 8.69 4.96 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 1.08 0.00 0.00 0.96 0.00 0.00 124 A 9.20 4.65 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 0.00 125 V 8.52 5.04 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 0.83 0.00 0.00 0.92 0.00 0.00 126 D 8.75 4.75 0.00 2.89 2.84 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 0.00 127 N 8.68 4.36 0.00 2.74 2.94 0.00 0.00 6.80 8.00 0.00 0.00 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 N 8.31 4.52 0.00 2.86 2.86 0.00 0.00 7.05 7.65 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 0.00 129 G 8.28 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 0.00 130 R 8.24 4.52 0.00 2.05 1.85 0.00 3.16 0.00 0.00 3.10 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 131 S 8.57 4.59 0.00 3.83 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 0.00 132 R 8.63 4.81 0.00 1.77 1.83 0.00 3.12 0.00 0.00 3.27 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 133 T 8.46 4.27 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 0.00 134 I 8.64 3.87 1.95 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 1.29 0.47 0.92 0.00 0.00 135 P 0.00 4.33 0.00 2.10 2.03 0.00 3.81 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.95 0.00 136 R 8.43 4.22 0.00 1.80 2.00 0.00 3.37 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.53 0.00 137 E 8.06 3.86 0.00 2.03 1.81 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 2.37 2.35 0.00 138 N 8.49 4.16 0.00 2.79 2.77 0.00 0.00 6.99 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 0.00 139 N 7.24 4.73 0.00 2.90 2.63 0.00 0.00 7.30 7.25 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 0.00 140 Q 8.30 4.04 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 141 E 8.25 4.02 0.00 2.09 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 2.40 2.30 0.00 142 L 8.33 3.95 0.00 1.81 1.89 0.92 0.59 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 0.00 143 E 8.34 3.90 0.00 2.28 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 2.31 2.32 0.00 144 K 8.02 3.92 0.00 2.01 2.03 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.46 7.81 145 A 7.92 4.01 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 0.00 146 L 8.15 3.96 0.00 1.85 1.73 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 147 A 7.89 4.08 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 0.00 148 L 7.75 4.11 0.00 1.83 1.73 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 149 I 7.67 3.71 2.00 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 1.66 0.58 0.92 0.00 0.00 150 S 8.30 4.29 0.00 3.97 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 0.00 151 E 7.87 4.27 0.00 1.96 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 2.18 2.44 0.00 * Residues marked with a * may have inaccurate shift predictions.