NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2863 8.1749 117.3755 63.6504 69.4206 172.7413 3 I 4.2322 8.1592 126.4289 61.3361 38.8808 170.7031 4 V 4.3522 9.1430 124.2642 62.0006 34.9011 173.0701 5 I 4.9501 8.5096 128.6819 59.6452 39.5970 175.2319 6 R 4.6577 8.4247 124.3993 54.5485 32.9340 174.9560 7 T 4.0000 8.5779 118.8093 61.9933 67.8341 172.4155 8 K 4.2734 9.4609 128.8161 55.7428 33.4858 175.3858 9 K 4.4952 7.6493 119.8325 54.7334 34.7854 174.7918 10 I 5.0161 8.2994 125.7990 59.4123 39.8975 175.2049 11 L 4.7417 9.0650 126.3895 52.8810 45.4347 175.8217 12 V 4.1855 8.2498 120.1489 61.5016 33.3859 174.7457 13 N 4.7254 8.9598 129.3344 51.5241 39.0671 173.6404 14 P 4.5046 0.0000 0.0000 64.7452 32.1491 179.1435 15 L 4.0123 8.2014 117.7316 57.8401 41.4796 178.0359 16 L 4.9887 9.3025 115.9020 53.7993 40.7586 177.0716 17 S 3.5037 7.5960 112.8541 57.5153 61.4481 170.8465 18 R 4.5350 8.1509 122.6166 56.4096 33.5158 174.1845 19 R 4.8945 8.4696 116.5951 54.4968 32.3836 174.3466 20 Q 5.1427 8.5167 121.8887 54.1901 31.0691 174.6572 21 L 5.5979 8.2005 122.1320 53.4699 44.5042 175.4580 22 S 4.5173 8.2410 116.3445 57.6693 64.9087 173.0077 23 L 5.0078 9.2717 123.6750 53.1945 45.5160 175.6025 24 D 5.3093 8.8215 121.7422 52.3975 43.5173 174.3193 25 V 4.1180 8.8675 124.1530 62.4933 33.2023 174.6472 26 L 4.8481 9.0473 128.3615 53.0987 43.7552 176.1500 27 H 4.9809 9.2550 123.5925 54.2008 29.7182 170.5296 28 P 4.1162 0.0000 0.0000 65.4704 29.6529 172.8807 29 D 4.8040 7.4164 129.2659 54.6259 40.0710 178.0490 30 S 4.3467 7.3207 117.2690 57.3090 64.1584 172.1972 31 P 4.6064 0.0000 0.0000 61.6963 32.3216 175.5979 32 T 3.5026 8.3496 113.6572 63.7519 68.7136 174.0215 33 A 4.0767 8.0053 128.0829 51.7095 19.4254 177.7680 34 S 4.2856 8.3766 116.8138 57.5748 64.7895 175.3212 35 K 3.6050 8.5356 126.0674 59.7535 31.9443 178.3351 36 E 3.9010 8.2020 117.8638 59.7516 29.3477 179.3915 37 K 4.0254 7.8037 119.1661 59.6246 32.0970 178.9609 38 I 3.7611 7.8516 120.1710 63.9481 36.9476 178.1942 39 R 3.8905 8.1385 120.2113 59.5796 29.8657 178.3127 40 E 4.0897 7.8291 116.6314 58.9361 29.6901 178.5999 41 E 4.0211 8.0534 118.9423 58.5536 29.6076 178.7704 42 L 4.0149 7.7613 120.5447 58.1817 42.2653 178.4056 43 A 4.0333 7.8908 120.5825 55.3179 17.9215 179.8657 44 K 3.9074 7.8647 116.1805 59.8237 32.2497 179.3907 45 Q 4.1287 7.5724 115.7287 58.5779 28.6443 178.1405 46 L 4.1692 7.9287 118.9745 54.4334 42.9353 176.5137 47 K 3.7999 8.6001 116.3354 57.3100 29.0333 175.8080 48 V 4.4779 7.2015 115.9352 60.3738 35.2496 174.0171 49 D 4.3857 8.7476 123.4597 54.7103 41.7672 177.4526 50 A 4.0188 8.8009 128.8163 55.4115 18.5173 179.5337 51 R 4.1119 8.3533 109.5415 57.6856 29.2984 176.7825 52 N 4.6473 7.9754 116.2788 53.2970 39.1905 174.0334 53 V 4.7760 7.7657 119.4258 61.1727 33.3307 174.7401 54 V 4.5354 8.6764 129.0131 61.0136 33.6403 174.4994 55 V 4.8164 8.5244 127.4974 60.1344 33.5492 174.2685 56 Y 5.0032 8.5458 121.1373 55.1462 42.7111 174.2592 57 G 3.9472 9.2446 103.6338 46.7661 0.0000 172.2188 58 F 5.7928 8.7896 121.4102 55.1274 43.7289 173.5884 59 S 4.7125 8.3522 112.9535 58.7019 66.2454 173.5246 60 T 4.6255 8.5553 115.1749 63.0341 70.7239 173.5752 61 Q 3.9940 8.6765 125.2694 56.5188 29.1500 175.3208 62 Y 4.1742 9.2563 124.2441 57.8149 38.1203 175.7542 63 G 3.6703 8.6264 108.7950 46.5536 0.0000 171.1186 64 G 3.8648 8.4282 110.2133 45.1843 0.0000 172.1329 65 G 3.6790 8.1874 108.1644 45.4522 0.0000 172.6802 66 K 5.1309 7.6893 118.3343 54.3380 35.7485 175.2352 67 S 5.1870 9.0365 119.9865 57.1997 66.7220 173.2561 68 T 5.0015 8.4603 120.9211 62.5583 70.9211 173.9690 69 G 3.6182 8.3389 110.3453 46.5305 0.0000 171.6699 70 F 5.5064 8.4977 117.6608 55.5855 42.9486 174.6437 71 A 4.9358 8.7128 122.5543 50.2650 23.5712 174.5854 72 L 5.1310 9.2958 118.3358 53.0428 45.9311 176.3017 73 V 4.7407 8.6749 122.8234 61.4362 33.7548 173.8378 74 Y 4.8674 8.7439 125.4651 56.6456 40.0506 175.9867 75 D 4.3590 8.1398 122.5391 56.4388 41.3421 176.5990 76 N 4.8691 7.7033 118.5708 51.6044 40.0886 174.8866 77 Q 3.9308 8.8651 128.2926 58.2643 28.8424 177.6336 78 Q 4.1136 8.2017 118.5806 58.2238 29.4644 176.6088 79 Y 4.1760 9.1454 118.7366 60.6228 38.5246 177.0623 80 L 2.8921 8.1572 120.7090 58.2762 41.6985 178.7937 81 L 3.9990 8.0347 118.9327 57.6289 42.0585 178.2941 82 K 4.2627 8.3654 119.3536 58.6446 32.3016 177.9544 83 Y 4.2957 8.1704 115.7808 59.6293 38.8767 175.7494 84 E 4.0253 7.2289 117.8780 55.9572 30.5905 175.7327 85 P 4.4732 0.0000 0.0000 62.1439 32.0053 177.3691 86 N 4.3542 8.9487 119.0883 56.8612 38.5121 177.1596 87 Y 4.3615 7.9350 118.3597 59.7941 38.5199 177.8550 88 R 3.9693 7.3216 119.7517 58.4005 30.0016 178.8737 89 L 4.0438 7.6666 118.8383 57.7813 41.8498 179.3629 90 R 4.0037 7.7020 116.4896 58.9715 29.6763 179.2743 91 K 4.0883 7.4611 116.9101 58.7420 32.0888 178.4228 92 V 3.9623 7.0364 114.8023 61.5697 32.3034 175.3604 93 K 3.9374 7.7987 114.8078 58.7887 29.4819 176.0180 94 I 4.2165 8.0657 119.4870 61.9114 39.8086 177.3462 95 L 4.3282 7.7740 120.2300 57.4911 43.7295 175.5530 96 G 4.1155 7.7172 101.5250 44.5814 0.0000 175.3813 97 E 4.4005 8.6952 126.1668 55.5240 30.6766 176.6387 98 K 4.6424 7.9744 117.5337 54.5574 32.2784 174.3867 99 P 4.3736 0.0000 0.0000 63.2770 32.2957 178.0811 100 N 4.5810 8.3802 118.0275 53.9135 36.5473 175.3506 101 T 3.7295 8.5141 119.3200 67.3391 68.4838 177.5790 102 R 3.1575 6.4525 116.0713 57.3651 31.4503 177.5608 103 R 3.9278 8.1658 117.1003 59.8903 30.5556 178.8984 104 S 4.1791 8.0681 112.7288 61.7557 63.2336 176.0812 105 F 4.0322 8.6358 121.8511 60.3364 38.3094 177.9259 106 K 4.1135 8.5516 118.0180 59.3652 31.6648 179.2024 107 E 4.1681 8.1236 118.6418 58.9757 29.3637 179.1552 108 L 3.9777 8.3474 119.7525 57.3223 41.5529 179.0198 109 K 3.7972 7.9820 119.7074 59.7291 31.7966 178.4420 110 R 3.9198 7.2591 115.5820 59.6576 30.3698 178.8683 111 K 4.0993 7.8185 117.4930 59.6381 32.2501 179.3761 112 I 3.6734 7.9470 120.3243 64.5145 36.9228 178.2031 113 K 4.1544 8.2273 118.4557 58.1658 31.9180 177.1938 114 R 4.6316 8.0542 117.3205 56.3879 30.7018 174.9666 115 T 4.7051 7.9365 113.7572 62.0180 72.4506 172.9952 116 S 4.7775 8.1664 116.1182 56.7539 64.5359 175.2604 117 G 4.0775 8.6449 112.2594 48.7387 0.0000 175.8079 118 K 3.9078 8.0291 117.2255 59.9691 32.3421 178.1049 119 A 4.1301 8.3844 119.1214 55.4959 18.6059 179.8392 120 I 3.5326 7.5352 118.0176 64.8387 37.0389 177.6922 121 T 3.8651 7.3219 115.1478 66.8739 68.5993 176.0563 122 K 4.0192 8.1382 119.9931 59.7288 32.2456 178.8107 123 L 3.9049 8.0059 118.2292 58.3267 41.0864 179.4330 124 L 3.9474 8.2522 119.0102 57.6579 41.5308 178.0884 125 S 4.3572 8.0935 113.8742 58.0390 64.2832 174.7469 126 E 4.5836 7.5926 118.4250 57.7564 33.3670 174.4694 127 K 4.0840 8.0765 117.8401 57.4831 33.2096 176.6611 128 K 4.4367 8.2106 121.7150 54.7904 31.8730 176.6756 129 G 4.1057 8.4484 113.4840 46.1901 0.0000 171.6468 130 D 4.7093 8.7701 113.9705 55.2808 37.3163 175.5881 131 T 4.1982 7.8235 114.4446 63.5411 70.6976 174.2999 132 W 4.3233 8.8083 131.0258 60.4347 30.7370 177.9707 133 A 3.7307 8.1807 120.4816 55.0273 17.8425 179.4686 134 S 3.9679 7.8278 111.2062 61.5017 62.6649 176.1707 135 V 3.5788 7.6889 120.9468 66.1004 31.0469 178.0956 136 Q 3.7228 7.8161 117.8255 58.8984 28.6124 178.4467 137 S 3.9190 7.5999 114.9431 61.8507 62.4864 176.8566 138 K 4.0143 7.7285 120.5989 58.8457 31.9205 179.2836 139 K 4.1130 8.0041 118.8905 59.4526 32.0150 179.1632 140 S 4.0995 8.7692 114.4374 61.7039 62.1439 175.9891 141 D 4.3975 8.2054 121.3908 57.6918 40.1582 178.3257 142 H 4.3170 8.1307 118.7505 59.0186 29.5401 177.0728 143 L 4.0904 7.6920 120.5846 57.6992 41.5515 179.2572 144 K 4.0858 7.8074 117.2059 59.7668 32.4317 179.0833 145 N 4.4223 7.7985 115.0404 54.2170 38.8311 174.7662 146 F 5.0369 6.8771 121.0772 56.3273 41.4120 174.6287 147 V 3.0792 6.7977 123.3784 61.1660 33.8555 172.2403 148 A 4.3810 9.0627 126.0305 52.4158 20.7227 177.2294 149 K 4.6938 7.8499 117.7321 57.0404 32.0209 174.9676 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 T 8.17 4.29 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 1.21 0.00 0.00 3 I 8.16 4.23 1.96 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 1.24 0.37 0.99 0.00 0.00 4 V 9.14 4.35 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 1.02 0.00 0.00 0.94 0.00 0.00 5 I 8.51 4.95 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 1.41 0.94 0.96 0.00 0.00 6 R 8.42 4.66 0.00 1.76 1.80 0.00 3.12 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 7 T 8.58 4.00 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 1.19 0.00 0.00 8 K 9.46 4.27 0.00 1.70 1.55 0.00 2.04 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.36 7.81 9 K 7.65 4.50 0.00 1.53 1.59 0.00 1.56 0.00 0.00 1.76 0.00 0.00 2.81 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.35 7.81 10 I 8.30 5.02 1.82 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 1.27 0.54 0.90 0.00 0.00 11 L 9.06 4.74 0.00 1.48 1.51 0.91 0.60 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 12 V 8.25 4.19 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 0.74 0.00 0.00 0.89 0.00 0.00 13 N 8.96 4.73 0.00 2.77 2.76 0.00 0.00 6.92 8.19 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 14 P 0.00 4.50 0.00 2.22 2.05 0.00 3.65 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.06 0.00 15 L 8.20 4.01 0.00 1.92 1.83 0.96 0.99 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 16 L 9.30 4.99 0.00 1.66 2.22 1.07 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.60 3.50 0.00 3.80 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 18 R 8.15 4.53 0.00 1.29 0.76 0.00 2.49 0.00 0.00 2.75 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.25 0.00 19 R 8.47 4.89 0.00 1.78 2.03 0.00 2.70 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.50 0.00 20 Q 8.52 5.14 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 21 L 8.20 5.60 0.00 1.57 1.61 0.88 0.89 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 22 S 8.24 4.52 0.00 3.68 3.60 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 23 L 9.27 5.01 0.00 1.49 1.60 1.04 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.82 5.31 0.00 2.78 2.58 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 25 V 8.87 4.12 2.30 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 1.03 0.00 0.00 1.18 0.00 0.00 26 L 9.05 4.85 0.00 1.87 1.59 0.92 0.85 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 27 H 9.25 4.98 0.00 3.10 3.45 0.00 5.30 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.12 0.00 2.18 2.17 0.00 3.87 0.00 0.00 3.73 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 29 D 7.42 4.80 0.00 2.83 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 30 S 7.32 4.35 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 31 P 0.00 4.61 0.00 2.19 2.13 0.00 3.81 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 32 T 8.35 3.50 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 1.17 0.00 0.00 33 A 8.01 4.08 1.09 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 0.00 0.00 0.00 0.00 0.00 34 S 8.38 4.29 0.00 4.00 3.95 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 0.00 0.00 0.00 0.00 35 K 8.54 3.60 0.00 1.75 1.90 0.00 1.75 0.00 0.00 1.90 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.42 7.81 36 E 8.20 3.90 0.00 1.96 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 2.38 2.36 0.00 37 K 7.80 4.03 0.00 1.73 1.75 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.46 7.81 38 I 7.85 3.76 1.86 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.20 0.98 0.00 0.00 39 R 8.14 3.89 0.00 2.02 2.05 0.00 3.07 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 40 E 7.83 4.09 0.00 2.10 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 2.31 2.30 0.00 41 E 8.05 4.02 0.00 2.01 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 0.00 2.31 2.32 0.00 42 L 7.76 4.01 0.00 1.83 1.90 0.93 1.20 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 43 A 7.89 4.03 1.48 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 44 K 7.86 3.91 0.00 1.92 1.88 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.67 7.81 45 Q 7.57 4.13 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 46 L 7.93 4.17 0.00 1.63 1.71 0.91 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.60 3.80 0.00 1.88 1.93 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.45 7.81 48 V 7.20 4.48 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 0.82 0.00 0.00 0.97 0.00 0.00 49 D 8.75 4.39 0.00 2.77 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 50 A 8.80 4.02 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 51 R 8.35 4.11 0.00 1.84 1.93 0.00 2.21 0.00 0.00 2.96 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.54 0.00 52 N 7.98 4.65 0.00 2.94 3.15 0.00 0.00 6.35 7.56 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 53 V 7.77 4.78 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 0.76 0.00 0.00 0.95 0.00 0.00 54 V 8.68 4.54 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 0.90 0.00 0.00 55 V 8.52 4.82 2.17 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 0.89 0.00 0.00 1.39 0.00 0.00 56 Y 8.55 5.00 0.00 3.05 3.18 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 57 G 9.24 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 8.79 5.79 0.00 2.91 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 59 S 8.35 4.71 0.00 3.85 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 60 T 8.56 4.63 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 1.32 0.00 0.00 61 Q 8.68 3.99 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.94 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 62 Y 9.26 4.17 0.00 2.85 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 63 G 8.63 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.43 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 0.00 0.00 0.00 65 G 8.19 3.68 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 0.00 0.00 0.00 66 K 7.69 5.13 0.00 1.69 1.70 0.00 1.78 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.55 7.81 67 S 9.04 5.19 0.00 4.05 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 68 T 8.46 5.00 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 1.41 0.00 0.00 69 G 8.34 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 0.00 0.00 0.00 70 F 8.50 5.51 0.00 2.93 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 71 A 8.71 4.94 1.17 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 0.00 0.00 72 L 9.30 5.13 0.00 1.80 1.79 1.36 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 73 V 8.67 4.74 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 1.05 0.00 0.00 0.93 0.00 0.00 74 Y 8.74 4.87 0.00 2.96 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 75 D 8.14 4.36 0.00 2.51 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.70 4.87 0.00 2.70 3.10 0.00 0.00 6.76 7.12 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 77 Q 8.87 3.93 0.00 2.51 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.71 0.00 0.00 0.00 0.00 0.00 2.58 2.34 0.00 78 Q 8.20 4.11 0.00 2.34 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 79 Y 9.15 4.18 0.00 3.11 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 80 L 8.16 2.89 0.00 1.54 1.68 0.07 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.03 4.00 0.00 1.92 1.73 0.96 0.96 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 82 K 8.37 4.26 0.00 1.86 2.20 0.00 2.23 0.00 0.00 1.85 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.67 1.59 7.81 83 Y 8.17 4.30 0.00 3.20 3.29 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 84 E 7.23 4.03 0.00 1.95 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 2.03 2.24 0.00 85 P 0.00 4.47 0.00 1.56 1.92 0.00 3.38 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.07 0.00 86 N 8.95 4.35 0.00 2.80 2.95 0.00 0.00 6.78 7.48 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 87 Y 7.93 4.36 0.00 3.18 3.21 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 88 R 7.32 3.97 0.00 1.74 1.86 0.00 3.09 0.00 0.00 3.18 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.50 0.00 89 L 7.67 4.04 0.00 1.81 1.66 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.70 4.00 0.00 1.94 2.27 0.00 3.20 0.00 0.00 3.21 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.94 0.00 91 K 7.46 4.09 0.00 2.02 1.91 0.00 1.76 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.59 1.72 7.81 92 V 7.04 3.96 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 0.78 0.00 0.00 0.89 0.00 0.00 93 K 7.80 3.94 0.00 1.94 1.86 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.38 7.81 94 I 8.07 4.22 1.87 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 0.98 0.53 0.66 0.00 0.00 95 L 7.77 4.33 0.00 1.56 1.67 0.91 1.16 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 96 G 7.72 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 97 E 8.70 4.40 0.00 1.98 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 2.31 2.24 0.00 98 K 7.97 4.64 0.00 1.78 1.77 0.00 1.61 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.35 7.81 99 P 0.00 4.37 0.00 2.21 2.11 0.00 3.86 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 100 N 8.38 4.58 0.00 2.73 2.82 0.00 0.00 7.00 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 0.00 101 T 8.51 3.73 3.85 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 -0.51 0.00 0.00 102 R 6.45 3.16 0.00 1.80 1.69 0.00 3.37 0.00 0.00 3.33 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 103 R 8.17 3.93 0.00 1.88 2.02 0.00 3.36 0.00 0.00 3.40 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.68 0.00 104 S 8.07 4.18 0.00 4.14 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 0.00 105 F 8.64 4.03 0.00 3.29 3.21 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 0.00 106 K 8.55 4.11 0.00 2.02 1.89 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.64 1.65 7.81 107 E 8.12 4.17 0.00 2.22 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 2.34 2.65 0.00 108 L 8.35 3.98 0.00 1.69 1.61 0.72 0.61 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 0.00 109 K 7.98 3.80 0.00 2.06 1.95 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.51 7.81 110 R 7.26 3.92 0.00 2.07 1.96 0.00 3.38 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 111 K 7.82 4.10 0.00 1.74 1.83 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.65 7.81 112 I 7.95 3.67 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.05 0.89 0.00 0.00 113 K 8.23 4.15 0.00 2.00 1.83 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.48 7.81 114 R 8.05 4.63 0.00 1.86 1.87 0.00 3.26 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 115 T 7.94 4.71 4.23 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 0.00 0.00 0.00 1.20 0.00 0.00 116 S 8.17 4.78 0.00 3.83 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 0.00 117 G 8.64 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 0.00 0.00 0.00 118 K 8.03 3.91 0.00 1.73 1.81 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.56 7.81 119 A 8.38 4.13 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 0.00 120 I 7.54 3.53 2.00 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 1.62 0.84 0.89 0.00 0.00 121 T 7.32 3.87 4.23 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 0.00 0.00 0.00 1.20 0.00 0.00 122 K 8.14 4.02 0.00 1.93 1.86 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.49 7.81 123 L 8.01 3.90 0.00 1.89 1.70 0.94 0.59 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 0.00 124 L 8.25 3.95 0.00 1.93 1.72 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 125 S 8.09 4.36 0.00 3.99 3.94 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 0.00 126 E 7.59 4.58 0.00 1.91 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 2.21 2.26 0.00 127 K 8.08 4.08 0.00 1.54 1.60 0.00 0.77 0.00 0.00 1.38 0.00 0.00 2.70 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.29 1.17 7.81 128 K 8.21 4.44 0.00 2.14 1.91 0.00 1.92 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.52 1.62 7.81 129 G 8.45 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 0.00 130 D 8.77 4.71 0.00 2.86 3.10 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 0.00 131 T 7.82 4.20 4.38 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 1.37 0.00 0.00 132 W 8.81 4.32 0.00 3.38 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 0.00 133 A 8.18 3.73 1.33 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 0.00 0.00 134 S 7.83 3.97 0.00 3.91 4.09 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 0.00 0.00 0.00 135 V 7.69 3.58 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 1.01 0.00 0.00 1.06 0.00 0.00 136 Q 7.82 3.72 0.00 1.88 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.50 0.00 0.00 0.00 0.00 0.00 1.45 1.32 0.00 137 S 7.60 3.92 0.00 3.97 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 0.00 138 K 7.73 4.01 0.00 1.92 1.89 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.56 7.81 139 K 8.00 4.11 0.00 1.95 1.84 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.66 7.81 140 S 8.77 4.10 0.00 3.77 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 0.00 141 D 8.21 4.40 0.00 2.89 2.72 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 0.00 142 H 8.13 4.32 0.00 3.19 3.50 0.00 5.78 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 L 7.69 4.09 0.00 1.92 1.71 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.81 4.09 0.00 1.72 1.86 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.74 7.81 145 N 7.80 4.42 0.00 2.80 2.94 0.00 0.00 6.94 7.30 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 0.00 146 F 6.88 5.04 0.00 2.83 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 0.00 147 V 6.80 3.08 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 0.56 0.00 0.00 0.71 0.00 0.00 148 A 9.06 4.38 1.50 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 0.00 149 K 7.85 4.69 0.00 2.12 2.18 0.00 1.83 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.43 7.81