NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 L 4.2762 8.1844 120.6273 54.3479 42.9796 176.1088 7 S 4.2384 8.7580 118.5136 55.3134 62.9638 171.3267 8 P 4.4086 0.0000 0.0000 63.7366 33.2451 174.5044 9 L 5.0151 7.3268 123.0620 53.3001 44.1111 175.3746 10 S 4.8716 8.9982 119.7316 57.2727 67.3596 172.0290 11 T 5.0582 8.0184 113.5833 61.6702 71.0467 171.8855 12 H 4.7235 8.3818 118.0689 55.4821 33.3839 172.2569 13 V 4.5472 8.4714 126.9878 61.0017 33.7516 173.9002 14 L 4.7931 8.5282 130.0139 53.0481 44.9531 174.5869 15 N 5.0868 9.2646 126.2314 53.2911 39.0518 175.2141 16 A 4.3214 9.5486 129.9250 54.2444 18.8331 178.5481 17 A 4.2234 8.6511 117.5428 54.4386 18.7244 177.9561 18 Q 4.5499 8.1320 111.6726 54.7781 30.6508 176.1903 19 G 3.9609 8.2958 105.6402 46.3766 0.0000 173.6394 20 V 4.6564 7.3758 110.8186 58.1519 36.0650 173.5404 21 P 4.5471 0.0000 0.0000 62.9552 31.8944 177.3921 22 G 3.8192 9.0902 111.3367 44.5480 0.0000 172.2283 23 A 4.5612 8.3561 127.5586 51.8240 20.1083 176.4762 24 N 4.1954 8.8129 116.9700 54.6298 36.7856 173.9603 25 M 4.6058 8.3604 118.0686 54.4112 34.3432 175.2266 26 T 4.5585 8.4849 122.6549 63.7154 70.3061 173.4482 27 I 4.8640 8.5645 125.7326 59.4324 41.4114 174.3969 28 V 4.7782 8.6527 126.4022 60.8625 34.7035 173.6736 29 L 5.1519 9.1448 129.5818 53.7499 44.1663 174.7926 30 H 5.4900 9.3167 123.0440 53.9960 32.8920 172.7022 31 R 4.8582 9.0950 120.5629 54.1045 33.1879 174.4849 32 L 3.6397 8.3576 128.5977 54.6996 42.5754 175.7970 33 D 4.3718 8.5466 127.4567 53.4068 41.0683 174.7469 34 P 4.2032 0.0000 0.0000 65.2099 31.5278 177.7959 35 V 3.6764 7.3395 117.8097 65.1723 31.8096 176.5849 36 S 4.4335 7.7093 113.9437 58.0468 64.3618 173.9407 37 S 4.6062 8.0889 115.4737 57.8932 63.0004 174.2994 38 A 4.3852 7.2468 122.1817 50.7480 20.9843 178.0224 39 W 4.6543 8.5240 120.0724 56.3071 30.1626 175.7785 40 N 4.8379 9.3995 124.1248 51.4141 39.5416 174.7176 41 I 3.7418 8.5641 124.9930 61.9119 38.1127 174.3712 42 L 4.6649 9.3462 128.8938 56.2551 43.6287 176.6765 43 T 4.7807 7.5227 111.6046 60.8609 71.0698 171.9542 44 T 4.8669 8.4994 116.7794 60.1575 71.4304 173.0111 45 G 4.2919 8.7747 112.9289 44.8853 0.0000 170.5292 46 I 5.3420 8.1040 119.0262 59.4096 41.2798 175.7267 47 T 4.2597 8.7863 117.7810 62.0070 69.8710 174.6481 48 N 4.6528 8.9481 123.1287 52.3325 38.7795 175.0998 49 D 4.3837 8.5389 116.6691 56.8650 41.0249 176.6687 50 D 4.6117 8.3209 117.3386 53.7318 41.2522 176.5565 51 G 3.8881 8.3640 105.2441 46.0625 0.0000 173.8222 52 R 4.8648 8.1289 118.5462 54.5416 32.2238 175.0923 53 C 4.8257 8.0737 119.2471 56.7092 31.6987 171.8776 54 P 4.4016 0.0000 0.0000 62.6414 31.9042 175.8801 55 G 3.9079 8.5281 105.6401 46.8786 0.0000 175.5339 56 L 4.1244 8.0638 120.8874 57.1533 41.8753 177.8315 57 I 4.5136 7.1948 116.2658 58.7339 40.8077 173.7001 58 T 4.2662 8.2180 116.8778 60.6437 71.7948 175.2580 59 K 4.0623 8.6020 122.5418 60.2048 31.9017 178.7972 60 E 4.1021 8.1550 116.8786 59.0026 29.5745 177.9595 61 N 4.7594 7.9337 115.2023 54.1911 40.2404 175.5073 62 F 4.7713 7.8195 122.7021 57.4428 37.7264 174.1845 63 I 4.3158 7.8615 118.2965 57.7705 39.9352 176.4364 64 A 4.0412 8.4066 124.2334 51.4776 18.9744 178.2643 65 G 3.7146 7.5746 107.9250 45.8014 0.0000 170.3080 66 V 4.6560 7.3497 118.9991 61.5121 33.4135 175.3603 67 Y 5.0586 8.7962 125.1737 56.0146 41.6890 174.5637 68 K 4.7748 8.8645 121.8050 55.0535 35.7947 174.6284 69 M 5.0287 9.2384 127.1299 53.5372 34.7520 174.6202 70 R 5.0618 8.7271 124.4791 54.5776 32.7189 174.3098 71 F 4.9078 9.5494 125.5832 55.8588 41.4522 175.9485 72 E 4.5002 8.9073 125.5838 55.8883 26.7159 177.4275 73 T 4.2433 8.1293 114.0469 64.3186 69.6506 177.1659 74 G 3.7330 8.2480 108.6641 47.6621 0.0000 175.7672 75 K 4.0359 8.1722 120.8557 59.2032 32.2893 178.4514 76 Y 3.9912 8.0419 119.6655 60.7890 38.6296 178.4990 77 W 4.1653 8.6490 119.9382 59.5664 29.0528 178.1421 78 D 4.5905 8.7201 119.4100 56.7396 40.4807 177.9921 79 A 4.0655 7.8043 119.6943 53.9869 18.4126 178.4066 80 L 4.3605 7.0187 115.1769 53.9904 41.8263 177.0494 81 G 3.9246 8.0824 106.8315 46.2643 0.0000 173.2612 82 E 4.7782 8.4173 118.2832 54.2377 33.2996 174.9270 83 T 4.3421 8.0818 114.1240 61.1472 67.5229 173.3074 84 C 4.4323 7.9918 125.4004 56.9607 34.5680 174.7782 85 F 4.2652 8.4882 128.8078 60.4173 39.0796 174.8027 86 Y 4.4776 6.7532 116.2266 55.2536 39.1326 173.9382 87 P 4.6190 0.0000 0.0000 65.8587 32.6045 175.4376 88 Y 5.1353 6.9884 115.4412 55.9885 41.1264 174.1443 89 V 4.2413 9.0463 119.8145 61.1087 34.5235 173.7642 90 E 5.1748 9.0343 127.3307 54.8827 31.3867 175.2050 91 I 4.5413 9.1552 126.6311 59.7217 39.3268 174.7997 92 V 4.9745 8.5818 127.3230 61.1523 33.4360 174.6378 93 F 5.1726 8.8004 121.5236 55.9598 41.6879 173.0027 94 T 4.9864 8.7360 117.1862 62.2394 70.3465 173.9100 95 I 4.3646 9.1479 127.7189 59.9319 38.6639 176.3409 96 T 4.2119 8.8293 116.6614 61.1949 70.6661 173.5815 97 N 4.8649 7.7256 120.4586 52.2461 40.0878 173.4675 98 T 4.5978 8.6135 118.9393 62.1676 67.6226 174.6364 99 S 4.6458 8.8690 115.4753 59.0715 63.5019 174.1384 100 Q 4.5356 7.7942 119.1122 54.3141 30.4039 174.4478 101 H 4.4819 8.3459 120.1300 56.2773 31.5294 173.4946 102 Y 4.7368 8.5397 122.9773 56.5752 40.8908 173.8432 103 H 5.0878 9.0248 125.4434 54.7446 31.8448 173.9857 104 V 4.5577 8.4202 126.0647 60.4060 31.6535 172.9092 105 P 4.7704 0.0000 0.0000 61.1577 33.8545 175.0831 106 L 4.5646 8.5332 121.0819 53.1910 45.1234 174.4040 107 L 4.9578 8.8112 128.9856 53.4255 44.1296 174.7959 108 L 5.3789 8.9194 127.6989 53.7171 45.7401 175.4571 109 S 5.3879 8.7955 120.7961 56.8993 65.8216 173.6362 110 R 3.2294 8.1417 117.0097 58.5255 29.8347 177.8281 111 F 4.8316 7.7770 113.7094 56.6289 40.3700 174.4686 112 S 4.9116 8.0285 114.6669 57.9048 65.3277 172.3117 113 Y 5.4747 7.7541 118.2207 56.5591 40.5602 173.4322 114 S 4.7257 9.1754 114.0572 57.6660 66.8876 172.7109 115 T 4.9554 8.2388 113.9277 61.1274 70.6257 173.1011 116 T 4.6291 8.1706 121.5292 61.5453 72.5682 173.8249 117 R 4.1176 8.7890 126.9569 56.6792 30.8601 175.6164 118 G 4.2955 9.4684 113.0119 44.3256 0.0000 172.9231 119 S 4.8153 8.1970 113.0566 57.1363 62.4682 173.5517 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 6 L 8.18 4.28 0.00 1.64 1.68 0.90 0.54 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 7 S 8.76 4.24 0.00 3.89 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.41 0.00 1.48 2.15 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.83 0.00 9 L 7.33 5.02 0.00 1.13 1.26 0.95 0.93 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 10 S 9.00 4.87 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 11 T 8.02 5.06 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 1.26 0.00 0.00 12 H 8.38 4.72 0.00 3.27 3.15 0.00 5.69 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.47 4.55 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 0.58 0.00 0.00 0.95 0.00 0.00 14 L 8.53 4.79 0.00 1.67 1.42 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 15 N 9.26 5.09 0.00 2.78 2.90 0.00 0.00 6.66 8.24 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 16 A 9.55 4.32 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.65 4.22 1.58 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 18 Q 8.13 4.55 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.46 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 19 G 8.30 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 20 V 7.38 4.66 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 0.85 0.00 0.00 0.96 0.00 0.00 21 P 0.00 4.55 0.00 2.09 2.15 0.00 3.68 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 2.05 2.14 0.00 22 G 9.09 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 23 A 8.36 4.56 1.25 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 24 N 8.81 4.20 0.00 2.90 2.97 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 25 M 8.36 4.61 0.00 2.00 1.74 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 26 T 8.48 4.56 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 1.18 0.00 0.00 27 I 8.56 4.86 1.70 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 0.75 1.12 0.43 0.00 0.00 28 V 8.65 4.78 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 1.00 0.00 0.00 0.86 0.00 0.00 29 L 9.14 5.15 0.00 1.75 1.51 1.15 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 30 H 9.32 5.49 0.00 3.01 3.42 0.00 5.80 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 9.09 4.86 0.00 1.37 1.54 0.00 2.89 0.00 0.00 2.82 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.50 0.00 32 L 8.36 3.64 0.00 0.47 1.06 -0.31 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.55 4.37 0.00 2.54 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 34 P 0.00 4.20 0.00 1.99 1.99 0.00 3.61 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 35 V 7.34 3.68 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 0.73 0.00 0.00 0.88 0.00 0.00 36 S 7.71 4.43 0.00 3.95 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 37 S 8.09 4.61 0.00 3.73 3.65 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 38 A 7.25 4.39 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 39 W 8.52 4.65 0.00 3.15 3.08 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 40 N 9.40 4.84 0.00 2.71 2.75 0.00 0.00 6.19 7.29 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 41 I 8.56 3.74 1.79 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 1.24 0.46 0.89 0.00 0.00 42 L 9.35 4.66 0.00 1.75 1.71 0.95 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 43 T 7.52 4.78 4.31 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 1.27 0.00 0.00 44 T 8.50 4.87 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 45 G 8.77 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 0.00 0.00 0.00 0.00 46 I 8.10 5.34 1.86 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 1.39 0.61 0.96 0.00 0.00 47 T 8.79 4.26 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 48 N 8.95 4.65 0.00 2.96 3.04 0.00 0.00 6.73 8.80 0.00 0.00 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 D 8.54 4.38 0.00 2.70 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 50 D 8.32 4.61 0.00 2.62 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 51 G 8.36 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 0.00 0.00 0.00 52 R 8.13 4.86 0.00 1.91 1.86 0.00 3.07 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.64 0.00 53 C 8.07 4.83 0.00 2.86 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 54 P 0.00 4.40 0.00 2.07 1.96 0.00 3.85 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 2.02 2.08 0.00 55 G 8.53 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 56 L 8.06 4.12 0.00 1.61 1.73 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 57 I 7.19 4.51 1.92 0.00 0.00 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 1.60 1.28 0.77 0.00 0.00 58 T 8.22 4.27 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 1.23 0.00 0.00 59 K 8.60 4.06 0.00 1.92 1.91 0.00 1.75 0.00 0.00 1.89 0.00 0.00 3.11 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.57 1.69 7.81 60 E 8.16 4.10 0.00 2.00 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 2.34 2.46 0.00 61 N 7.93 4.76 0.00 2.74 2.95 0.00 0.00 7.17 8.36 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 62 F 7.82 4.77 0.00 3.13 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 63 I 7.86 4.32 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.79 0.93 0.00 0.00 64 A 8.41 4.04 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 65 G 7.57 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 0.00 0.00 0.00 66 V 7.35 4.66 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 1.22 0.00 0.00 0.87 0.00 0.00 67 Y 8.80 5.06 0.00 1.48 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 0.00 0.00 0.00 0.00 68 K 8.86 4.77 0.00 0.79 0.93 0.00 1.13 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.91 1.00 7.81 69 M 9.24 5.03 0.00 1.68 2.18 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.35 0.00 70 R 8.73 5.06 0.00 1.70 1.62 0.00 2.79 0.00 0.00 3.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00 71 F 9.55 4.91 0.00 2.81 2.87 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 72 E 8.91 4.50 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 2.41 2.46 0.00 73 T 8.13 4.24 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 1.23 0.00 0.00 74 G 8.25 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 75 K 8.17 4.04 0.00 2.04 1.93 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.56 7.81 76 Y 8.04 3.99 0.00 3.01 3.07 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 0.00 0.00 0.00 0.00 77 W 8.65 4.17 0.00 3.47 3.33 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 0.00 78 D 8.72 4.59 0.00 2.92 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 79 A 7.80 4.07 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 80 L 7.02 4.36 0.00 1.78 1.66 -0.06 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 81 G 8.08 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 82 E 8.42 4.78 0.00 2.09 1.78 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 2.30 2.43 0.00 83 T 8.08 4.34 4.22 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 1.13 0.00 0.00 84 C 7.99 4.43 0.00 2.97 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 85 F 8.49 4.27 0.00 2.35 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 0.00 0.00 0.00 86 Y 6.75 4.48 0.00 2.98 2.92 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 87 P 0.00 4.62 0.00 2.21 2.31 0.00 3.49 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.80 0.00 88 Y 6.99 5.14 0.00 3.07 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 89 V 9.05 4.24 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 0.35 0.00 0.00 -0.10 0.00 0.00 90 E 9.03 5.17 0.00 1.92 1.79 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 2.22 2.55 0.00 91 I 9.16 4.54 2.18 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 1.23 0.80 1.13 0.00 0.00 92 V 8.58 4.97 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 1.04 0.00 0.00 0.90 0.00 0.00 93 F 8.80 5.17 0.00 3.15 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 8.74 4.99 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 1.24 0.00 0.00 95 I 9.15 4.36 1.72 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.54 0.37 0.00 0.00 96 T 8.83 4.21 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 1.23 0.00 0.00 97 N 7.73 4.86 0.00 2.87 2.92 0.00 0.00 7.00 7.58 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 98 T 8.61 4.60 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 99 S 8.87 4.65 0.00 3.91 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 0.00 100 Q 7.79 4.54 0.00 1.87 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.94 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 101 H 8.35 4.48 0.00 3.17 3.08 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 8.54 4.74 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 0.00 103 H 9.02 5.09 0.00 3.26 3.17 0.00 5.54 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.42 4.56 1.88 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 0.72 0.00 0.00 0.24 0.00 0.00 105 P 0.00 4.77 0.00 2.07 1.98 0.00 3.77 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.95 0.00 106 L 8.53 4.56 0.00 0.51 0.88 0.54 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.81 4.96 0.00 1.77 1.50 1.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.92 5.38 0.00 1.70 1.41 1.10 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.80 5.39 0.00 4.11 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 0.00 110 R 8.14 3.23 0.00 1.17 0.91 0.00 2.75 0.00 0.00 2.55 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.54 0.00 111 F 7.78 4.83 0.00 2.93 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 0.00 112 S 8.03 4.91 0.00 4.02 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 0.00 113 Y 7.75 5.47 0.00 2.86 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 0.00 114 S 9.18 4.73 0.00 3.83 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 0.00 115 T 8.24 4.96 4.21 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 1.24 0.00 0.00 116 T 8.17 4.63 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 1.22 0.00 0.00 117 R 8.79 4.12 0.00 1.86 1.88 0.00 3.37 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 1.70 1.74 0.00 118 G 9.47 4.30 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 0.00 119 S 8.20 4.82 0.00 3.73 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