NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3627 8.3349 115.3974 57.9704 64.1948 173.4010 3 H 4.6922 5.2900 114.9741 56.5199 37.6121 174.1778 4 Y 4.5403 6.6506 115.1711 60.1285 38.8415 176.4068 5 D 4.6280 7.6618 119.3050 53.2179 40.9176 175.4022 6 I 3.5367 8.3905 122.7920 62.2702 35.4426 173.9837 7 L 4.0329 7.6626 118.5769 56.5010 40.3332 176.5467 8 Q 4.4141 9.2221 120.9310 55.4282 30.9617 175.2753 9 A 4.5824 7.3723 121.4429 51.2638 21.0331 172.9222 10 P 5.0011 0.0000 0.0000 62.2439 32.9369 176.1880 11 V 4.0531 8.3805 123.3076 63.6562 31.6637 174.9883 12 I 4.0084 9.1227 126.0184 61.3076 37.5627 179.1676 13 S 3.7603 9.5261 119.7636 57.4641 64.2810 173.1365 14 E 4.1000 8.4599 116.9356 58.9552 29.8958 178.0136 15 K 3.9442 8.3730 120.6810 58.1307 32.1371 178.4344 16 A 4.1409 7.7915 120.0751 55.8315 18.0873 179.2009 17 Y 3.8543 7.3292 116.0184 60.7968 38.6549 178.0513 18 S 4.2899 8.8292 116.7649 61.1540 62.9606 176.3819 19 A 3.9052 8.8179 124.7524 54.9849 17.9216 179.3788 20 M 4.0360 7.6032 118.3947 58.0107 32.0559 177.7854 21 E 4.2211 7.3558 115.0489 57.3989 29.4550 177.3214 22 R 4.4435 7.0213 114.3438 55.3113 29.3877 175.4433 23 G 3.5836 8.6725 106.6663 47.1039 0.0000 173.3419 24 V 4.3374 7.0153 118.6078 60.7035 34.2499 173.8232 25 Y 4.6995 8.2187 124.8543 56.3958 41.6804 175.3461 26 S 4.6353 7.7739 114.6680 58.3703 65.8371 173.4381 27 F 5.3669 8.5023 119.0770 54.3195 42.1569 173.7786 28 W 4.8413 10.0400 120.5322 56.4180 29.8787 177.2028 29 V 4.0883 8.3368 120.3457 60.2935 33.6194 175.3586 30 S 4.6350 7.4716 113.6570 57.5283 63.2965 172.2295 31 P 4.1325 0.0000 0.0000 66.5300 31.4800 177.7744 32 K 4.3064 7.6393 123.7265 55.4458 31.0417 177.4039 33 A 4.6942 8.0439 131.9645 55.1080 19.6974 177.0098 34 T 3.6409 6.9997 111.8483 57.8422 73.1593 172.9391 35 K 3.8211 8.8409 124.9532 60.6431 32.1169 178.4393 36 T 3.8473 8.0573 109.1319 64.6080 68.4413 175.4628 37 E 3.8536 7.9664 121.0314 58.8890 29.5696 179.4127 38 I 3.6369 7.7606 117.8181 64.2886 37.8271 177.7041 39 K 3.9459 8.3347 119.2461 60.3283 31.7644 177.2392 40 D 4.2891 9.4192 118.4422 56.4099 40.7039 179.2498 41 A 3.4274 9.1238 115.6131 53.0835 19.5505 179.4185 42 I 3.4070 8.1361 112.8929 63.8565 38.8301 178.2769 43 Q 4.2199 8.3963 116.2742 60.2316 28.7379 179.1865 44 Q 4.0796 7.9915 118.0783 57.2376 28.9590 176.8535 45 A 5.0250 9.0342 123.2928 52.3063 20.5075 177.3977 46 F 4.4301 7.7647 111.0092 55.5469 41.2529 174.3816 47 G 3.8653 8.5276 109.7101 46.0891 0.0000 173.3862 48 V 4.1977 7.1713 126.0338 61.5183 32.7885 171.4759 49 R 5.6588 8.0580 116.9143 54.1199 31.6838 175.2779 50 V 4.3746 7.8891 116.4383 61.6697 33.9702 174.9214 51 I 4.0159 8.8151 129.1132 63.8271 37.6218 176.5608 52 G 4.3501 7.8993 106.9301 44.6360 0.0000 171.1087 53 I 5.3082 8.1245 119.7950 59.4283 41.2429 174.0573 54 S 4.8437 9.3226 123.4534 57.0436 66.2066 172.7269 55 T 4.9436 8.0093 115.2744 61.6241 70.2051 172.4113 56 M 4.4946 7.9614 122.1101 54.3996 36.5448 174.7875 57 N 4.8315 8.9916 120.0895 53.9625 40.1018 175.4038 58 V 4.3385 8.7040 122.0381 61.3025 34.3097 173.0763 59 P 4.4821 0.0000 0.0000 63.4675 31.3703 174.2717 60 G 4.0314 8.9907 102.7010 47.9968 0.0000 175.1770 61 K 4.4349 6.8257 117.6564 57.3620 30.2126 174.1590 62 R 4.6622 8.7117 126.6690 55.5891 30.3678 175.9271 63 K 5.2158 7.5615 115.4826 55.7452 33.2212 173.6304 64 R 4.3754 7.7129 115.1613 56.6291 32.0973 175.9529 65 V 4.0677 7.5860 112.8067 62.4014 34.2760 171.5831 66 G 3.9615 8.7988 108.0319 46.2790 0.0000 174.6559 67 R 3.8302 8.3377 121.6400 57.6418 30.2563 176.3878 68 F 4.6550 9.7546 115.5251 59.5777 39.8690 181.5344 69 I 2.7201 7.7074 110.8606 59.8626 40.6602 177.1488 70 G 4.3918 7.8589 112.2292 47.0505 0.0000 171.1786 71 Q 4.4427 7.9905 117.8646 55.2688 31.5809 175.3975 72 R 4.3711 8.4629 122.4674 57.3102 30.3250 176.0057 73 N 4.6197 8.7454 110.5654 54.4080 43.5695 175.7257 74 D 4.2361 7.5926 112.5298 55.0884 38.3753 172.9026 75 R 4.9502 8.4129 128.5617 54.6245 34.0875 175.3495 76 K 4.7629 8.8793 115.3020 55.2162 31.2891 177.1282 77 K 3.4816 8.3315 121.7028 57.2049 33.2647 175.5893 78 A 4.9646 8.9014 127.8566 50.1551 22.8424 174.5946 79 I 4.6570 9.2998 121.9072 59.5394 40.8288 175.2426 80 V 4.9240 8.7664 118.9709 59.4756 36.0563 174.8133 81 R 4.7047 8.4736 123.1463 54.4439 32.3562 175.2635 82 L 4.8755 8.0245 123.8659 54.4394 43.4122 176.4134 83 A 4.4063 8.2922 122.9302 50.8931 20.0390 177.4995 84 E 3.9329 8.8743 118.9417 59.1478 30.0282 178.0289 85 G 3.9006 7.6626 108.5784 44.5948 0.0000 172.3059 86 Q 3.9520 7.6596 118.1591 56.1628 30.0138 175.7096 87 S 4.5248 9.0727 117.5213 56.9922 63.4111 171.3349 88 I 4.3361 7.4467 113.5517 60.1661 40.6733 176.7922 89 E 3.6105 9.1700 124.4593 57.0119 28.9740 176.4051 90 A 4.7159 8.6658 131.2070 52.9603 21.7209 178.9215 91 L 4.5254 7.6019 116.0177 54.9049 40.6168 177.3894 92 A 4.5974 9.1326 119.6631 52.9878 21.3327 179.5463 93 G 3.8399 8.7510 105.3987 48.5617 0.0000 173.2335 94 Q 3.9563 8.1473 123.5454 55.0834 27.5968 176.5918 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 S 8.33 4.36 0.00 3.83 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 H 5.29 4.69 0.00 2.41 2.85 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 6.65 4.54 0.00 3.05 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 5 D 7.66 4.63 0.00 2.84 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 6 I 8.39 3.54 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 1.49 0.71 0.91 0.00 0.00 7 L 7.66 4.03 0.00 1.43 1.60 1.01 0.47 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 8 Q 9.22 4.41 0.00 2.02 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 9 A 7.37 4.58 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 10 P 0.00 5.00 0.00 2.23 2.27 0.00 3.93 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 11 V 8.38 4.05 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 0.61 0.00 0.00 0.25 0.00 0.00 12 I 9.12 4.01 1.93 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.06 1.00 0.00 0.00 13 S 9.53 3.76 0.00 4.21 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 0.00 14 E 8.46 4.10 0.00 2.21 2.22 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 2.31 2.39 0.00 15 K 8.37 3.94 0.00 1.76 1.89 0.00 2.00 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.32 7.81 16 A 7.79 4.14 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 17 Y 7.33 3.85 0.00 3.08 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 S 8.83 4.29 0.00 3.92 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.82 3.91 1.15 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 0.00 0.00 20 M 7.60 4.04 0.00 1.80 1.66 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.06 0.00 21 E 7.36 4.22 0.00 2.07 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 0.00 2.16 2.41 0.00 22 R 7.02 4.44 0.00 1.80 1.85 0.00 3.07 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.35 0.00 23 G 8.67 3.58 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 0.00 0.00 0.00 24 V 7.02 4.34 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.81 0.00 0.00 25 Y 8.22 4.70 0.00 2.63 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 0.00 0.00 0.00 0.00 26 S 7.77 4.64 0.00 3.59 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 8.50 5.37 0.00 3.18 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 W 10.04 4.84 0.00 3.26 3.24 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 29 V 8.34 4.09 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 0.79 0.00 0.00 1.09 0.00 0.00 30 S 7.47 4.63 0.00 3.96 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 31 P 0.00 4.13 0.00 2.06 2.11 0.00 3.70 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 2.07 2.20 0.00 32 K 7.64 4.31 0.00 1.76 1.79 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.45 7.81 33 A 8.04 4.69 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 34 T 7.00 3.64 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 35 K 8.84 3.82 0.00 1.85 1.89 0.00 1.74 0.00 0.00 1.88 0.00 0.00 3.15 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.55 7.81 36 T 8.06 3.85 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 37 E 7.97 3.85 0.00 2.36 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 0.00 2.35 2.41 0.00 38 I 7.76 3.64 1.98 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.37 1.15 0.00 0.00 39 K 8.33 3.95 0.00 1.87 2.06 0.00 1.88 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.49 7.81 40 D 9.42 4.29 0.00 2.79 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 41 A 9.12 3.43 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 42 I 8.14 3.41 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.29 1.13 0.00 0.00 43 Q 8.40 4.22 0.00 2.35 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.69 0.00 0.00 0.00 0.00 0.00 2.52 2.60 0.00 44 Q 7.99 4.08 0.00 1.67 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 45 A 9.03 5.02 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 7.76 4.43 0.00 3.00 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 47 G 8.53 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.17 4.20 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 0.76 0.00 0.00 0.95 0.00 0.00 49 R 8.06 5.66 0.00 1.95 2.02 0.00 2.60 0.00 0.00 3.82 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 50 V 7.89 4.37 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 0.92 0.00 0.00 0.99 0.00 0.00 51 I 8.82 4.02 1.95 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 1.17 0.66 0.91 0.00 0.00 52 G 7.90 4.35 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 0.00 53 I 8.12 5.31 1.90 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 1.43 0.68 0.92 0.00 0.00 54 S 9.32 4.84 0.00 3.81 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 8.01 4.94 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 56 M 7.96 4.49 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.56 0.00 57 N 8.99 4.83 0.00 2.65 2.81 0.00 0.00 6.69 7.68 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 58 V 8.70 4.34 2.38 0.00 0.00 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 1.15 0.00 0.00 59 P 0.00 4.48 0.00 2.23 2.13 0.00 3.90 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 2.03 2.00 0.00 60 G 8.99 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 61 K 6.83 4.43 0.00 1.81 2.10 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.84 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.39 1.45 7.81 62 R 8.71 4.66 0.00 2.01 1.89 0.00 3.07 0.00 0.00 3.38 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 63 K 7.56 5.22 0.00 2.03 2.17 0.00 1.80 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.21 1.31 7.81 64 R 7.71 4.38 0.00 1.79 1.96 0.00 3.26 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 65 V 7.59 4.07 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 0.70 0.00 0.00 0.94 0.00 0.00 66 G 8.80 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.34 3.83 0.00 1.36 1.77 0.00 3.07 0.00 0.00 3.11 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 68 F 9.75 4.66 0.00 3.09 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 69 I 7.71 2.72 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.36 0.92 0.00 0.00 70 G 7.86 4.39 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 0.00 71 Q 7.99 4.44 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.86 0.00 0.00 0.00 0.00 0.00 2.13 2.25 0.00 72 R 8.46 4.37 0.00 1.84 1.92 0.00 3.45 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 73 N 8.75 4.62 0.00 2.59 2.72 0.00 0.00 7.03 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 74 D 7.59 4.24 0.00 2.75 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 75 R 8.41 4.95 0.00 1.70 2.08 0.00 2.21 0.00 0.00 2.41 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.31 0.00 76 K 8.88 4.76 0.00 1.83 1.83 0.00 1.95 0.00 0.00 1.95 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.49 7.81 77 K 8.33 3.48 0.00 0.79 1.18 0.00 1.31 0.00 0.00 0.95 0.00 0.00 2.49 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.15 0.87 7.81 78 A 8.90 4.96 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 79 I 9.30 4.66 1.80 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.56 0.85 0.00 0.00 80 V 8.77 4.92 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 0.87 0.00 0.00 1.10 0.00 0.00 81 R 8.47 4.70 0.00 1.84 1.76 0.00 3.07 0.00 0.00 3.16 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 82 L 8.02 4.88 0.00 1.66 1.68 0.95 0.83 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 83 A 8.29 4.41 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 84 E 8.87 3.93 0.00 1.92 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 0.00 2.30 2.40 0.00 85 G 7.66 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 86 Q 7.66 3.95 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.07 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 87 S 9.07 4.52 0.00 4.17 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 88 I 7.45 4.34 1.54 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 0.57 0.24 -0.49 0.00 0.00 89 E 9.17 3.61 0.00 2.16 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 2.26 2.41 0.00 90 A 8.67 4.72 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 91 L 7.60 4.53 0.00 1.68 1.84 1.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 92 A 9.13 4.60 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 93 G 8.75 3.84 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 0.00 0.00 0.00 94 Q 8.15 3.96 0.00 2.62 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.49 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00