NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.5528 8.4244 119.1658 52.0781 40.8315 173.7701 4 Q 4.3431 7.8344 118.8835 54.5970 31.7454 173.1384 5 Y 5.1441 9.3141 121.1361 56.5246 42.8876 173.3441 6 Y 5.3859 9.5109 121.5560 56.0114 43.0144 174.1638 7 G 4.1933 8.5123 112.6832 44.5440 0.0000 172.2166 8 T 3.7160 7.8938 116.1814 59.9598 68.4380 171.1968 9 G 4.0123 9.7126 113.8758 44.6210 0.0000 172.9434 10 R 5.2440 7.9937 117.7696 56.5667 31.7134 173.8810 11 R 4.2873 8.2111 113.0940 56.9391 31.1950 174.0281 12 K 3.9297 9.4859 117.1930 58.0164 29.3267 175.4663 13 S 3.6600 7.9737 106.6073 59.2409 61.7474 170.9960 14 S 5.5686 8.1732 116.1281 56.8284 63.7549 172.4627 15 A 4.8046 8.6858 130.5297 50.8593 19.8470 175.8225 16 A 5.0370 8.5051 123.9816 50.2990 22.7173 176.1301 17 R 4.4379 8.1821 116.6225 54.9449 34.0793 174.5830 18 V 4.3340 8.4166 125.0586 61.2369 34.2114 174.6947 19 F 6.1881 8.1941 123.8304 54.1430 40.0225 172.3972 20 I 4.1150 8.2432 121.9908 61.5622 38.4583 174.6085 21 K 5.0579 8.8383 128.0433 53.6903 35.9415 173.5061 22 P 4.4793 0.0000 0.0000 61.4406 32.2023 175.3614 23 G 4.4824 9.3505 123.3482 45.8328 0.0000 175.0311 24 N 3.7929 8.9654 124.2313 52.4626 39.3586 176.2924 25 G 4.9244 8.5627 99.6130 44.3612 0.0000 174.8255 26 K 4.4420 8.0215 119.0672 56.2922 34.3450 177.8693 27 I 4.5143 8.2210 122.8913 60.2925 41.2446 174.3693 28 V 5.0060 8.2884 127.3487 60.3956 33.4422 173.9224 29 I 4.1607 8.0387 129.0435 59.9591 38.3909 176.0555 30 N 3.8375 9.5407 127.8174 54.4317 36.0481 175.5428 31 Q 3.7394 8.1346 115.7858 56.5924 28.9859 172.3938 32 R 4.5086 7.1388 115.7482 54.8810 32.7504 175.1302 33 S 4.6553 8.1014 112.7601 57.6236 63.5262 174.1155 34 L 3.9369 8.3599 127.4547 58.7992 41.7975 179.4877 35 E 4.3507 8.1453 116.5443 58.3541 29.4079 178.0027 36 Q 4.3235 7.7312 116.3777 56.4433 28.6751 175.1750 37 Y 4.5320 7.6218 119.3250 58.8471 40.8548 176.6481 38 F 5.3691 8.1880 117.5419 56.9602 39.9027 175.1896 39 G 3.6874 8.0975 110.6930 46.6644 0.0000 174.2809 40 R 3.9128 8.8731 122.9112 57.0453 28.7322 175.1196 41 E 4.7629 7.6285 114.0324 53.9635 32.6035 176.9759 42 T 4.0347 8.5402 113.1371 63.4262 67.5212 174.6787 43 A 4.0021 8.2998 125.2723 54.8474 19.0509 180.3667 44 R 4.3747 8.0008 106.6421 57.7325 29.4741 177.5993 45 M 4.2672 8.2663 120.0677 58.2661 32.4876 178.7435 46 V 3.7811 7.4944 113.2522 64.0007 31.5269 178.7036 47 V 3.5600 7.8326 110.5563 64.0745 31.0375 177.6865 48 R 4.3693 7.8547 115.9343 56.3864 30.2762 178.1861 49 Q 4.0373 7.9483 119.5413 58.7388 28.6361 177.7643 50 P 4.1233 0.0000 0.0000 65.7298 31.3027 178.2635 51 L 3.9770 7.6327 118.2124 57.6965 41.5376 179.0801 52 E 4.2055 9.2253 117.5834 59.1546 29.4589 178.7518 53 L 4.3733 7.4429 119.2248 56.2455 42.6836 176.6750 54 V 4.4811 7.8567 112.3505 60.8595 32.7050 172.0814 55 D 4.5455 8.7943 124.8698 54.2426 40.9400 173.4090 56 M 4.3937 8.3828 119.7601 56.0737 34.9767 173.7684 57 V 3.8038 8.7658 122.6965 63.4599 31.3129 172.8983 58 E 4.7244 7.9428 114.1912 55.9586 29.8227 175.7198 59 K 4.5276 7.8144 117.3923 56.9379 34.4953 176.4100 60 L 4.9532 7.2578 116.7530 56.0599 43.7163 171.6116 61 D 5.6162 9.0341 117.8997 50.5356 42.6920 174.8932 62 L 5.8177 8.5159 119.4454 52.6142 46.5392 174.7789 63 Y 5.0431 8.6521 121.3854 56.2140 40.2907 173.9242 64 I 4.2889 8.2046 127.5225 61.0292 38.5949 175.6943 65 T 4.6330 9.2493 123.5068 61.4325 69.8761 173.0132 66 V 4.6686 7.4523 124.1592 59.8915 34.5955 175.0827 67 K 4.3946 9.6420 119.6640 57.6122 36.4437 171.8230 68 G 4.3584 8.6362 114.5563 46.6685 0.0000 171.3456 69 G 4.2095 9.5261 108.9411 43.5873 0.0000 176.9712 70 G 4.0188 8.5858 116.3300 44.0462 0.0000 172.0347 71 I 3.9717 7.6631 118.9232 63.6960 36.7509 177.8095 72 S 4.0561 8.0793 115.0253 61.8550 62.8365 177.1867 73 G 3.5196 7.9752 108.3760 47.8466 0.0000 174.6764 74 Q 4.1244 9.2132 124.9200 58.4387 28.9875 178.4256 75 A 4.2158 8.4024 121.1468 55.3374 18.1714 179.4540 76 G 3.6887 8.1514 102.9720 47.9971 0.0000 174.8875 77 A 4.1743 8.5633 123.8080 54.9201 18.3000 179.5538 78 I 3.5811 7.8924 118.1425 64.7990 37.2766 178.4521 79 R 3.7466 7.9477 119.2313 59.6499 29.6910 177.9682 80 H 4.2377 8.1201 117.8974 59.3150 29.9000 177.4016 81 G 3.6423 7.9237 108.2812 47.3089 0.0000 174.9754 82 I 3.5976 7.8743 122.1027 64.6427 36.9407 178.3384 83 T 3.8521 7.7844 113.5327 65.3374 67.3143 176.0745 84 R 3.9216 7.9774 120.1812 59.0850 30.1289 178.6375 85 A 4.0900 7.8072 119.9410 55.2855 18.3883 179.3049 86 L 3.9176 7.9027 117.4591 58.0956 41.3475 179.3863 87 M 4.3211 7.9096 119.3164 57.8831 32.2156 177.6945 88 E 4.1730 7.9879 118.1842 59.5943 29.7376 178.3919 89 Y 4.0527 7.3882 118.0533 59.1186 38.7254 174.9702 90 D 4.1720 7.8324 120.7091 53.1903 43.1248 175.2962 91 E 4.2002 8.6496 127.2814 58.5410 29.8377 179.7256 92 S 4.2802 8.1923 115.8183 61.1075 63.0253 175.7938 93 L 4.2296 7.8236 121.1044 57.6298 40.1493 179.1102 94 R 3.9125 7.5639 118.8801 59.5947 29.5346 178.4974 95 S 4.0377 7.7765 111.4712 61.2408 61.9968 175.6966 96 E 4.2557 7.8880 119.2624 57.8799 30.1031 178.2595 97 L 4.3046 7.7387 119.3915 57.8859 41.7314 179.3561 98 R 3.8482 8.2432 118.9584 59.2546 29.8198 178.1702 99 K 3.1793 7.4152 117.1188 58.8175 32.0371 177.3344 100 A 4.2888 7.0000 117.6907 50.4855 20.5253 175.8697 101 G 3.5161 8.4468 106.2613 46.7311 0.0000 172.8383 102 F 5.1371 7.5878 118.3589 59.5190 41.8657 179.0258 103 V 4.0087 8.0641 111.9723 64.2633 31.5906 177.2700 104 T 3.9636 7.2225 108.4593 61.5690 69.0333 173.3728 105 R 4.2143 8.2149 123.9651 54.3218 30.8152 175.9989 106 D 4.4912 8.3911 125.0067 54.1281 39.2976 175.9798 107 A 4.1634 8.3129 128.3982 54.0983 18.8951 178.4979 108 R 3.8477 6.8714 114.6801 57.1555 30.5086 175.6860 109 Q 4.5405 8.3847 121.5701 54.2319 32.0482 173.7366 110 V 3.5803 8.2529 122.4015 63.5647 31.9585 174.9947 111 E 4.5830 8.4445 125.0190 54.1700 30.8902 176.3060 112 R 3.8810 8.5383 120.0974 56.1991 29.7668 176.1784 113 K 4.1520 8.4537 121.8843 56.0526 32.0543 176.7604 114 K 4.2702 8.4467 126.5227 55.7581 32.9127 177.0276 115 V 3.8886 8.0307 121.8764 62.8829 32.2934 174.6846 116 G 4.2431 9.0595 111.5064 46.1805 0.0000 173.7309 117 L 4.5397 6.8375 119.5403 53.7415 43.4251 175.9707 118 R 4.5599 8.2205 117.9052 56.6497 32.0519 176.6452 119 K 4.2925 8.0258 115.9133 56.1573 32.6873 176.0392 120 A 3.9362 8.2849 118.7352 53.4445 17.7638 177.8352 121 R 4.6761 8.1142 110.6771 57.0615 37.7400 175.9550 122 R 3.8551 8.1043 119.0022 56.5632 30.2703 174.9779 123 R 4.7000 8.3874 124.9997 53.3446 31.4035 174.2889 124 P 4.2807 0.0000 0.0000 62.4481 31.5163 176.1046 125 Q 4.0768 8.8097 121.2279 56.8968 28.5270 176.9079 126 F 4.4775 9.2727 116.0217 56.2822 38.5404 176.5011 127 S 2.9578 6.9507 113.0458 58.3982 63.7902 171.7020 128 K 3.6122 7.6556 121.6452 56.0838 32.6937 176.9152 129 R 4.4581 8.3873 125.2568 56.5606 30.3243 174.7699 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 3 N 8.42 4.55 0.00 2.60 2.57 0.00 0.00 6.88 6.19 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 4 Q 7.83 4.34 0.00 2.07 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.66 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 5 Y 9.31 5.14 0.00 3.15 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 6 Y 9.51 5.39 0.00 3.20 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 7 G 8.51 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 7.89 3.72 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 1.31 0.00 0.00 9 G 9.71 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 0.00 0.00 0.00 10 R 7.99 5.24 0.00 1.99 1.86 0.00 2.73 0.00 0.00 3.96 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.47 0.00 11 R 8.21 4.29 0.00 1.94 1.97 0.00 3.08 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.45 0.00 12 K 9.49 3.93 0.00 1.90 1.90 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.34 1.39 7.81 13 S 7.97 3.66 0.00 4.17 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 0.00 14 S 8.17 5.57 0.00 3.98 3.86 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 0.00 0.00 0.00 15 A 8.69 4.80 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 16 A 8.51 5.04 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 17 R 8.18 4.44 0.00 1.73 1.85 0.00 3.13 0.00 0.00 3.12 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 18 V 8.42 4.33 1.87 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 0.92 0.00 0.00 0.78 0.00 0.00 19 F 8.19 6.19 0.00 3.55 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 20 I 8.24 4.11 2.05 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 1.19 0.54 0.86 0.00 0.00 21 K 8.84 5.06 0.00 1.82 1.90 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.38 7.81 22 P 0.00 4.48 0.00 2.12 2.04 0.00 3.98 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 2.00 2.02 0.00 23 G 9.35 4.48 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 0.00 0.00 0.00 24 N 8.97 3.79 0.00 3.09 2.81 0.00 0.00 5.89 6.92 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 25 G 8.56 4.92 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 26 K 8.02 4.44 0.00 1.75 1.76 0.00 1.63 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.48 7.81 27 I 8.22 4.51 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 1.25 1.12 0.93 0.00 0.00 28 V 8.29 5.01 2.32 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 1.14 0.00 0.00 0.99 0.00 0.00 29 I 8.04 4.16 1.52 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 1.26 0.83 0.56 0.00 0.00 30 N 9.54 3.84 0.00 2.20 2.61 0.00 0.00 7.05 7.57 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 31 Q 8.13 3.74 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 32 R 7.14 4.51 0.00 1.87 1.79 0.00 3.18 0.00 0.00 3.11 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 33 S 8.10 4.66 0.00 3.86 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 34 L 8.36 3.94 0.00 1.94 1.70 1.04 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.15 4.35 0.00 2.13 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 0.00 2.43 2.50 0.00 36 Q 7.73 4.32 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 37 Y 7.62 4.53 0.00 2.61 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 38 F 8.19 5.37 0.00 3.18 2.93 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 39 G 8.10 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 0.00 0.00 0.00 40 R 8.87 3.91 0.00 1.97 2.02 0.00 3.19 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 41 E 7.63 4.76 0.00 2.22 1.77 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 2.22 2.44 0.00 42 T 8.54 4.03 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 1.15 0.00 0.00 43 A 8.30 4.00 0.56 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 0.00 0.00 44 R 8.00 4.37 0.00 2.04 2.38 0.00 3.09 0.00 0.00 3.50 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.70 0.00 45 M 8.27 4.27 0.00 2.04 2.11 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 2.54 2.82 0.00 46 V 7.49 3.78 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 0.97 0.00 0.00 0.92 0.00 0.00 47 V 7.83 3.56 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 0.93 0.00 0.00 1.00 0.00 0.00 48 R 7.85 4.37 0.00 1.95 1.94 0.00 3.21 0.00 0.00 3.30 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 49 Q 7.95 4.04 0.00 2.10 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.54 0.00 50 P 0.00 4.12 0.00 2.08 1.76 0.00 3.47 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 51 L 7.63 3.98 0.00 1.78 1.73 0.97 0.92 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 52 E 9.23 4.21 0.00 2.08 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 2.45 2.46 0.00 53 L 7.44 4.37 0.00 1.93 2.06 1.02 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.86 4.48 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 1.03 0.00 0.00 55 D 8.79 4.55 0.00 2.85 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 56 M 8.38 4.39 0.00 1.90 1.92 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 2.47 2.55 0.00 57 V 8.77 3.80 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 0.84 0.00 0.00 0.94 0.00 0.00 58 E 7.94 4.72 0.00 2.07 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 2.27 2.23 0.00 59 K 7.81 4.53 0.00 1.76 1.80 0.00 1.95 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.36 1.32 7.81 60 L 7.26 4.95 0.00 1.97 1.66 0.83 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 61 D 9.03 5.62 0.00 2.72 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 62 L 8.52 5.82 0.00 1.62 1.72 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.65 5.04 0.00 3.07 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 64 I 8.20 4.29 1.73 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 1.19 0.63 0.86 0.00 0.00 65 T 9.25 4.63 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 1.12 0.00 0.00 66 V 7.45 4.67 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 0.74 0.00 0.00 1.04 0.00 0.00 67 K 9.64 4.39 0.00 1.81 1.90 0.00 1.27 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.23 1.34 7.81 68 G 8.64 4.36 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 0.00 69 G 9.53 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 0.00 0.00 0.00 0.00 70 G 8.59 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 7.66 3.97 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 1.68 0.57 0.80 0.00 0.00 72 S 8.08 4.06 0.00 3.96 4.08 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 73 G 7.98 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.21 4.12 0.00 2.77 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.87 2.57 0.00 75 A 8.40 4.22 0.81 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 76 G 8.15 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 0.00 0.00 0.00 77 A 8.56 4.17 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 78 I 7.89 3.58 2.10 0.00 0.00 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 1.43 0.87 0.91 0.00 0.00 79 R 7.95 3.75 0.00 1.81 1.99 0.00 2.66 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.66 0.00 80 H 8.12 4.24 0.00 3.25 3.42 0.00 5.85 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 81 G 7.92 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 0.00 0.00 0.00 82 I 7.87 3.60 1.95 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.66 0.83 0.00 0.00 83 T 7.78 3.85 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 1.29 0.00 0.00 84 R 7.98 3.92 0.00 1.83 1.79 0.00 3.24 0.00 0.00 3.02 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.49 0.00 85 A 7.81 4.09 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 86 L 7.90 3.92 0.00 1.87 1.76 0.93 0.80 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 87 M 7.91 4.32 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.58 0.00 88 E 7.99 4.17 0.00 2.26 2.35 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 2.47 2.39 0.00 89 Y 7.39 4.05 0.00 1.56 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 90 D 7.83 4.17 0.00 2.22 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 0.00 0.00 0.00 0.00 91 E 8.65 4.20 0.00 2.01 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 2.53 2.27 0.00 92 S 8.19 4.28 0.00 3.98 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 93 L 7.82 4.23 0.00 1.94 1.94 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.56 3.91 0.00 2.08 2.03 0.00 3.33 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 95 S 7.78 4.04 0.00 3.92 3.86 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 0.00 0.00 0.00 96 E 7.89 4.26 0.00 2.08 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 2.33 0.00 97 L 7.74 4.30 0.00 1.97 1.99 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.24 3.85 0.00 1.86 2.01 0.00 3.11 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 1.59 1.62 0.00 99 K 7.42 3.18 0.00 1.89 1.86 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.42 7.81 100 A 7.00 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.45 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 F 7.59 5.14 0.00 3.07 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 0.00 103 V 8.06 4.01 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 0.77 0.00 0.00 0.96 0.00 0.00 104 T 7.22 3.96 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 0.00 105 R 8.21 4.21 0.00 1.79 1.85 0.00 3.37 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.54 0.00 106 D 8.39 4.49 0.00 2.71 2.54 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 0.00 107 A 8.31 4.16 1.29 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 0.00 108 R 6.87 3.85 0.00 1.99 1.93 0.00 3.18 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 109 Q 8.38 4.54 0.00 2.16 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.83 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 110 V 8.25 3.58 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 0.85 0.00 0.00 0.93 0.00 0.00 111 E 8.44 4.58 0.00 1.99 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 2.24 2.27 0.00 112 R 8.54 3.88 0.00 1.91 1.96 0.00 3.03 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 113 K 8.45 4.15 0.00 1.74 1.78 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.46 7.81 114 K 8.45 4.27 0.00 1.86 1.70 0.00 1.83 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.52 1.58 7.81 115 V 8.03 3.89 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 0.70 0.00 0.00 0.93 0.00 0.00 116 G 9.06 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 0.00 0.00 0.00 0.00 117 L 6.84 4.54 0.00 1.57 1.94 0.95 0.80 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 0.00 118 R 8.22 4.56 0.00 1.71 1.87 0.00 3.30 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 119 K 8.03 4.29 0.00 1.77 1.64 0.00 1.92 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.39 7.81 120 A 8.28 3.94 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 0.00 121 R 8.11 4.68 0.00 1.76 1.92 0.00 3.34 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 1.57 1.71 0.00 122 R 8.10 3.86 0.00 1.89 1.91 0.00 3.20 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 123 R 8.39 4.70 0.00 1.84 1.86 0.00 3.26 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 124 P 0.00 4.28 0.00 2.20 2.10 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 125 Q 8.81 4.08 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 126 F 9.27 4.48 0.00 3.19 3.16 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 0.00 127 S 6.95 2.96 0.00 3.90 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 0.00 128 K 7.66 3.61 0.00 1.64 1.77 0.00 1.59 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.51 7.81 129 R 8.39 4.46 0.00 1.98 1.78 0.00 3.40 0.00 0.00 3.40 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.81 0.00