NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3592 8.2649 123.5815 51.8370 19.9912 176.2892 3 R 3.8901 8.5094 116.1929 58.9592 30.1128 176.3768 4 R 3.9344 8.4720 117.5805 56.4269 31.0042 178.7982 5 R 4.7592 7.8956 125.6268 55.2089 33.8509 175.4472 6 R 4.3367 8.3870 115.6269 57.3432 30.8946 178.3477 7 A 3.3875 7.3675 127.1217 52.6700 17.8547 180.7156 8 E 4.3924 8.3685 120.4964 58.0032 30.4845 175.7586 9 V 3.8703 8.2766 127.9333 61.8159 29.5911 175.3380 10 R 3.9759 8.1188 120.8800 56.1414 29.8170 176.5146 11 Q 4.6030 8.3340 119.9435 54.5104 31.2296 174.5241 12 L 4.5929 8.0855 121.4797 53.0478 43.7295 176.8694 13 Q 4.2900 8.5469 123.3128 54.4111 28.0517 172.8215 14 P 3.9946 0.0000 0.0000 60.3622 32.8625 175.7632 15 D 4.5903 8.8676 120.9955 55.2565 41.5214 176.7030 16 L 4.8198 8.4200 122.3889 54.1742 42.2703 177.1850 17 V 4.5287 7.8527 117.7218 63.6010 37.2844 174.2704 18 Y 4.4108 8.6859 114.4407 55.7301 39.9057 173.9922 19 G 4.3101 8.4543 108.5740 46.2502 0.0000 172.2291 20 D 4.7098 7.9322 125.0602 53.8271 43.6975 177.3486 21 V 4.1134 8.6120 117.3486 61.6517 31.4105 176.1407 22 L 4.5726 7.7447 122.2229 55.3709 43.6311 177.7952 23 V 3.7753 7.1703 112.9618 63.7294 31.3376 177.4677 24 T 4.0452 7.6534 108.9691 65.1113 69.1847 176.2233 25 A 3.9760 8.0138 123.8786 54.8704 18.3016 178.9691 26 F 3.9706 8.3343 118.2686 61.7378 39.0454 176.9768 27 I 3.6147 7.5111 117.7684 63.0853 37.0997 177.8104 28 N 4.4247 8.5149 118.7029 56.1896 38.2401 177.5052 29 K 3.9003 7.6852 118.0036 59.5210 32.3041 179.1402 30 I 3.5929 7.0727 118.9004 63.1046 37.2404 176.6106 31 M 4.1677 7.0312 119.4482 55.2066 33.0022 175.4868 32 R 4.5231 7.9870 123.7058 55.5359 33.5069 175.1162 33 D 4.3215 9.2791 122.3058 55.7721 37.7909 174.1846 34 G 3.9425 8.2389 102.4668 46.7074 0.0000 175.8637 35 K 4.3510 7.2619 119.3079 54.2346 30.8120 177.7608 36 K 3.9533 7.9012 121.2411 59.4711 32.5580 177.2699 37 N 4.3752 8.5503 116.6264 55.6090 38.6559 175.4089 38 L 3.9913 8.5074 123.5702 58.5260 42.5060 177.5674 39 A 4.0361 8.2217 119.6351 53.2616 18.2080 178.7386 40 A 4.1822 7.4176 118.2634 55.7295 19.2808 179.7156 41 R 3.6836 8.1369 113.6060 60.0014 30.2745 177.7842 42 I 3.8749 8.2507 118.6025 64.8345 37.5915 178.0707 43 F 4.3659 8.2270 121.0971 61.6100 39.0611 176.6889 44 Y 3.8293 7.9878 115.9141 60.5167 37.6142 177.3882 45 D 4.6168 8.3435 119.1613 57.2483 40.8283 178.8820 46 A 4.0032 8.0234 121.2534 55.4751 18.6321 179.2267 47 C 3.8474 7.5090 114.7064 62.9729 28.0993 176.6565 48 K 3.9308 8.5282 120.2231 59.7663 31.2143 179.2599 49 I 3.7578 7.4932 119.4687 64.8709 36.9587 177.8543 50 I 3.5329 7.8594 120.5210 64.2830 36.6547 177.8761 51 Q 4.1534 8.3781 118.7228 61.5041 28.9169 180.7566 52 E 3.2933 7.7019 113.8795 57.1767 29.6719 178.3046 53 K 4.1806 7.6548 121.0770 58.7106 33.6694 177.7092 54 T 4.1017 7.9482 118.5275 63.3116 67.1171 174.9960 55 G 4.1353 8.4838 116.7650 45.8916 0.0000 171.7876 56 Q 4.6574 7.7468 118.0397 53.0405 31.5345 175.6405 57 E 4.0863 8.5841 119.5966 56.2606 29.4448 177.2140 58 P 4.7526 0.0000 0.0000 62.8005 30.9433 177.0853 59 L 4.4387 8.8450 122.3125 55.9844 44.4602 177.7344 60 K 4.2301 7.9393 117.9885 57.9752 32.2933 178.0585 61 V 3.8579 7.7966 117.4466 64.5140 31.5620 176.9571 62 F 4.2699 7.7989 119.5537 60.6688 39.7388 177.1257 63 K 3.6578 7.5435 117.8553 59.3607 32.2721 178.2577 64 Q 3.9749 8.6665 119.7875 59.6566 28.9874 177.2871 65 A 3.9222 7.3782 120.6562 55.6959 17.9738 179.3535 66 V 3.2440 7.5407 114.2444 66.1088 31.3669 178.4401 67 E 3.8732 7.7749 117.9270 59.2979 29.6165 178.3313 68 N 4.5012 8.2416 115.1943 54.6050 39.9048 175.5581 69 V 4.4514 7.3854 120.8159 62.1972 31.3861 175.8618 70 K 4.5230 7.6306 118.8981 53.6358 34.3221 175.0449 71 P 4.4179 0.0000 0.0000 62.7790 30.7363 176.1508 72 R 4.0740 8.9730 124.9689 59.2629 30.1982 176.0903 73 M 5.3669 7.7833 114.6884 53.4580 35.9463 173.9091 74 E 4.8323 9.5967 120.1472 54.6392 33.8976 175.0194 75 V 4.8683 8.3991 112.9406 60.0394 33.3991 175.5654 76 R 4.7142 9.1725 125.8321 54.1322 32.5798 176.8703 77 S 4.6891 8.7708 119.5760 59.1594 64.1454 173.9644 78 R 4.6376 7.9336 121.9064 56.1467 33.7637 173.2717 79 R 4.0552 8.3226 126.9075 56.2684 30.9660 176.2248 80 V 4.0778 7.3378 125.8794 61.1433 33.6969 176.5059 81 G 3.9192 8.4062 107.9809 47.0668 0.0000 172.9107 82 G 3.7444 7.2818 114.2713 44.5106 0.0000 176.8136 83 A 4.0589 8.6119 130.0409 52.1276 18.6521 176.0015 84 N 4.6895 8.2578 116.4776 52.3802 40.1605 174.6420 85 Y 4.9363 8.3012 120.0010 56.2449 41.5346 175.0773 86 Q 4.6419 8.3652 121.7092 54.4324 29.2644 175.1092 87 V 4.0511 8.5585 126.4602 62.5405 33.1219 172.6694 88 P 5.2959 0.0000 0.0000 62.1898 32.7303 174.6047 89 M 5.0054 9.7080 123.8177 53.3632 37.2029 173.9747 90 E 4.6147 8.6668 119.3095 56.2652 30.5916 176.8074 91 V 4.0363 8.1059 124.1621 61.5661 32.6055 175.9148 92 S 4.1848 8.7754 122.1728 57.8448 62.7798 172.9288 93 P 4.2016 0.0000 0.0000 66.1736 31.1240 178.4147 94 R 4.1019 7.8238 116.3464 56.9735 30.7783 178.3522 95 R 4.2250 7.5917 119.5461 58.3883 30.1190 177.9397 96 Q 3.8842 8.3598 118.4125 59.0451 28.5703 178.3060 97 Q 3.8346 7.8469 120.4267 58.6803 29.1031 178.0273 98 S 3.9812 7.8520 114.5942 61.7616 62.8881 176.6505 99 L 3.2351 7.6591 122.8039 56.8442 41.0910 179.3158 100 A 4.2330 7.1888 120.8591 55.3357 18.5469 179.3187 101 L 4.0783 8.1360 117.6266 57.3159 41.7942 179.3041 102 R 3.8078 7.9102 118.2136 59.7227 29.7631 178.3228 103 W 4.5574 7.7884 118.2909 59.9560 29.1186 178.3058 104 L 4.2098 8.1224 118.7191 58.0000 41.1450 179.7545 105 V 3.6370 7.9216 117.2552 66.2104 31.5243 177.9268 106 Q 3.9727 8.2782 117.3547 59.0678 28.4371 178.6199 107 A 4.0963 9.1033 120.7947 54.8074 18.5542 179.4754 108 A 4.1306 8.0270 119.5976 55.6474 18.4395 179.7037 109 N 4.4524 7.9841 113.0426 55.9385 38.6740 177.0368 110 Q 4.2087 7.9203 117.9383 56.4577 29.2699 176.5987 111 R 4.2652 7.2883 120.3803 55.1989 30.8563 175.0661 112 P 4.6064 0.0000 0.0000 63.3034 31.1606 176.1855 113 E 4.3633 7.6230 119.3479 56.7054 30.4047 176.2645 114 R 4.3555 8.3967 116.2211 57.9613 32.2346 177.1987 115 R 4.1324 7.8298 118.7963 55.2890 30.2436 176.9805 116 A 3.9923 8.8913 126.0942 55.2134 18.0565 179.1543 117 A 3.8820 7.8984 118.7717 55.4337 18.7215 179.4917 118 V 3.4804 7.7862 116.7596 66.7467 31.4334 178.0689 119 R 3.8974 7.9200 117.0603 59.1398 29.8536 178.6782 120 I 3.8890 7.8823 120.1670 64.3767 37.2762 177.7374 121 A 4.2701 8.0233 122.4811 54.5553 18.5307 178.7920 122 H 4.1703 8.9404 113.6649 59.0609 28.9902 177.2098 123 E 3.9632 8.3363 120.6329 59.8095 29.5408 178.9843 124 L 3.6968 7.6852 117.1101 58.4076 41.5595 179.1553 125 M 4.0792 8.1452 118.6758 58.1965 31.8862 178.0812 126 D 5.1581 8.3710 119.1781 57.1392 40.7088 178.9386 127 A 4.0216 8.8894 121.6464 55.2985 17.9998 179.5530 128 A 4.0496 7.6032 118.0488 55.1641 18.9044 179.3836 129 E 4.1222 8.3329 116.6831 57.5855 29.1503 178.6593 130 G 3.7163 9.0788 106.3467 45.2154 0.0000 174.8277 131 K 4.6392 7.7743 119.1835 55.5694 33.9870 176.0300 132 G 4.0368 8.0230 123.0819 45.1464 0.0000 171.8690 133 G 3.5572 9.1763 105.2982 47.0446 0.0000 175.3583 134 A 4.1691 8.0605 122.2456 53.7120 18.5671 179.7952 135 V 3.5514 7.6855 117.0431 66.0678 31.8182 177.7912 136 K 3.8237 7.4753 117.9740 59.4836 31.8054 178.8843 137 K 3.5110 7.5383 119.2640 59.3354 32.0856 178.7336 138 K 3.9806 7.6423 119.0733 59.6360 32.0040 178.5511 139 E 3.9782 8.3795 117.9385 59.3901 29.6058 178.8209 140 D 4.3571 8.5413 118.2491 57.4148 41.2543 178.5272 141 V 3.5816 8.1937 118.0718 65.6546 31.4877 177.2627 142 E 4.3815 8.0761 117.9591 59.0052 29.3761 178.8331 143 R 3.9293 8.0010 118.2840 59.4307 29.9621 178.6434 144 M 4.0141 8.1397 117.7097 57.5901 31.9660 176.8755 145 A 4.1608 6.8439 119.4723 53.2723 19.5061 176.7176 146 E 4.2558 9.1047 122.5381 57.5703 27.8437 177.1496 147 A 3.9504 7.3453 117.9309 54.5999 18.5221 178.5774 148 N 5.1010 7.7833 113.7454 53.2515 39.6543 177.1460 149 R 3.9353 8.5469 123.9908 59.3749 30.2565 176.8689 150 A 3.9993 7.8766 121.2744 55.5110 18.3541 178.9631 151 Y 4.2555 7.1861 111.3519 58.1911 37.8514 177.5247 152 A 4.2039 8.4927 126.5664 55.6211 18.6577 180.8298 153 H 4.5816 8.2898 106.2606 56.6036 28.1130 175.1508 154 Y 5.1311 8.1879 116.3173 58.0304 38.3272 176.4970 155 R 4.6762 8.2684 119.0086 54.8252 31.3675 177.2223 156 W 4.5492 9.0573 119.4939 56.5516 28.2786 175.1910 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 A 8.26 4.36 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 3 R 8.51 3.89 0.00 1.90 2.01 0.00 3.38 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 4 R 8.47 3.93 0.00 1.80 1.77 0.00 3.17 0.00 0.00 3.22 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 5 R 7.90 4.76 0.00 1.75 1.87 0.00 3.24 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 6 R 8.39 4.34 0.00 1.75 1.88 0.00 3.37 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 7 A 7.37 3.39 1.06 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 0.00 0.00 0.00 0.00 0.00 8 E 8.37 4.39 0.00 1.85 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 2.12 2.28 0.00 9 V 8.28 3.87 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 0.86 0.00 0.00 0.91 0.00 0.00 10 R 8.12 3.98 0.00 1.95 1.93 0.00 3.04 0.00 0.00 3.13 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 11 Q 8.33 4.60 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 12 L 8.09 4.59 0.00 1.66 1.56 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.55 4.29 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.67 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 14 P 0.00 3.99 0.00 2.12 2.04 0.00 3.78 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 15 D 8.87 4.59 0.00 2.82 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 16 L 8.42 4.82 0.00 1.72 1.66 0.95 0.85 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 V 7.85 4.53 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 0.56 0.00 0.00 0.64 0.00 0.00 18 Y 8.69 4.41 0.00 3.38 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 19 G 8.45 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 0.00 0.00 0.00 0.00 20 D 7.93 4.71 0.00 2.86 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 21 V 8.61 4.11 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 0.90 0.00 0.00 0.95 0.00 0.00 22 L 7.74 4.57 0.00 1.56 1.98 0.90 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.17 3.78 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 0.56 0.00 0.00 0.99 0.00 0.00 24 T 7.65 4.05 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 1.41 0.00 0.00 25 A 8.01 3.98 1.35 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 26 F 8.33 3.97 0.00 3.17 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 27 I 7.51 3.61 1.91 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 1.10 0.43 0.85 0.00 0.00 28 N 8.51 4.42 0.00 2.86 2.80 0.00 0.00 6.84 7.47 0.00 0.00 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 K 7.69 3.90 0.00 1.48 1.76 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.42 7.81 30 I 7.07 3.59 1.60 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 0.81 -0.04 0.78 0.00 0.00 31 M 7.03 4.17 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.48 0.00 32 R 7.99 4.52 0.00 1.84 1.74 0.00 3.28 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 33 D 9.28 4.32 0.00 2.83 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 34 G 8.24 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 0.00 0.00 0.00 35 K 7.26 4.35 0.00 1.96 1.77 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.63 7.81 36 K 7.90 3.95 0.00 1.77 1.90 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.46 7.81 37 N 8.55 4.38 0.00 2.76 2.63 0.00 0.00 6.84 6.66 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 38 L 8.51 3.99 0.00 1.80 1.69 0.94 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.22 4.04 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 40 A 7.42 4.18 1.65 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 0.00 0.00 41 R 8.14 3.68 0.00 2.01 2.07 0.00 3.17 0.00 0.00 3.20 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.79 0.00 42 I 8.25 3.87 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 1.44 0.74 0.96 0.00 0.00 43 F 8.23 4.37 0.00 2.93 2.95 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 44 Y 7.99 3.83 0.00 3.20 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 45 D 8.34 4.62 0.00 2.89 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 46 A 8.02 4.00 1.49 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 47 C 7.51 3.85 0.00 3.05 2.91 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 48 K 8.53 3.93 0.00 1.99 1.87 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.74 7.81 49 I 7.49 3.76 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 1.78 1.13 0.97 0.00 0.00 50 I 7.86 3.53 2.10 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 1.72 1.10 0.92 0.00 0.00 51 Q 8.38 4.15 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.60 0.00 0.00 0.00 0.00 0.00 2.61 2.61 0.00 52 E 7.70 3.29 0.00 2.18 1.84 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 2.48 2.57 0.00 53 K 7.65 4.18 0.00 1.91 1.85 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.40 7.81 54 T 7.95 4.10 4.37 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 1.26 0.00 0.00 55 G 8.48 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 0.00 0.00 0.00 56 Q 7.75 4.66 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.81 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 57 E 8.58 4.09 0.00 2.12 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 2.45 2.42 0.00 58 P 0.00 4.75 0.00 2.08 2.13 0.00 3.79 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 59 L 8.85 4.44 0.00 1.79 1.74 0.87 0.81 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 60 K 7.94 4.23 0.00 1.94 1.80 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.55 7.81 61 V 7.80 3.86 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 1.00 0.00 0.00 0.97 0.00 0.00 62 F 7.80 4.27 0.00 3.07 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 K 7.54 3.66 0.00 1.75 1.94 0.00 1.66 0.00 0.00 1.62 0.00 0.00 3.09 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.44 7.81 64 Q 8.67 3.97 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.44 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 65 A 7.38 3.92 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 66 V 7.54 3.24 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 0.76 0.00 0.00 0.07 0.00 0.00 67 E 7.77 3.87 0.00 2.09 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 0.00 2.28 2.36 0.00 68 N 8.24 4.50 0.00 2.98 2.86 0.00 0.00 6.83 8.52 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 69 V 7.39 4.45 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 1.39 0.00 0.00 1.03 0.00 0.00 70 K 7.63 4.52 0.00 1.72 1.83 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.58 7.81 71 P 0.00 4.42 0.00 2.32 2.50 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 72 R 8.97 4.07 0.00 2.12 2.00 0.00 3.09 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 73 M 7.78 5.37 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 74 E 9.60 4.83 0.00 2.03 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 2.20 2.29 0.00 75 V 8.40 4.87 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 0.80 0.00 0.00 0.97 0.00 0.00 76 R 9.17 4.71 0.00 1.83 1.98 0.00 3.40 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 1.60 1.62 0.00 77 S 8.77 4.69 0.00 3.81 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 78 R 7.93 4.64 0.00 1.83 1.88 0.00 2.31 0.00 0.00 2.25 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.93 0.00 79 R 8.32 4.06 0.00 1.67 1.65 0.00 3.22 0.00 0.00 3.05 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.67 0.00 80 V 7.34 4.08 1.56 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 0.60 0.00 0.00 0.33 0.00 0.00 81 G 8.41 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 G 7.28 3.74 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 0.00 0.00 0.00 83 A 8.61 4.06 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 84 N 8.26 4.69 0.00 2.55 2.69 0.00 0.00 6.73 7.46 0.00 0.00 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 Y 8.30 4.94 0.00 2.82 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 86 Q 8.37 4.64 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.96 0.00 0.00 0.00 0.00 0.00 2.18 2.50 0.00 87 V 8.56 4.05 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 1.15 0.00 0.00 1.20 0.00 0.00 88 P 0.00 5.30 0.00 2.17 2.11 0.00 4.07 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.26 0.00 89 M 9.71 5.01 0.00 1.81 1.95 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.59 0.00 90 E 8.67 4.61 0.00 1.84 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 0.00 2.32 2.32 0.00 91 V 8.11 4.04 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 0.70 0.00 0.00 1.02 0.00 0.00 92 S 8.78 4.18 0.00 3.84 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 93 P 0.00 4.20 0.00 2.22 2.28 0.00 3.71 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 2.05 1.98 0.00 94 R 7.82 4.10 0.00 1.86 1.96 0.00 3.09 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.58 0.00 95 R 7.59 4.22 0.00 1.82 2.05 0.00 3.17 0.00 0.00 3.25 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.51 0.00 96 Q 8.36 3.88 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.59 0.00 0.00 0.00 0.00 0.00 2.54 2.70 0.00 97 Q 7.85 3.83 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.63 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 98 S 7.85 3.98 0.00 3.99 4.05 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 99 L 7.66 3.24 0.00 1.00 0.13 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.19 4.23 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 0.00 101 L 8.14 4.08 0.00 1.85 1.76 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.91 3.81 0.00 1.75 1.79 0.00 3.19 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 1.71 1.72 0.00 103 W 7.79 4.56 0.00 3.50 3.09 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 0.00 104 L 8.12 4.21 0.00 2.05 2.00 1.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.92 3.64 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 1.00 0.00 0.00 0.88 0.00 0.00 106 Q 8.28 3.97 0.00 2.40 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.43 2.63 0.00 107 A 9.10 4.10 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.03 4.13 1.54 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 0.00 109 N 7.98 4.45 0.00 2.75 2.91 0.00 0.00 7.18 7.84 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 0.00 110 Q 7.92 4.21 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.68 0.00 111 R 7.29 4.27 0.00 2.10 2.04 0.00 3.17 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.78 0.00 112 P 0.00 4.61 0.00 2.19 2.15 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 113 E 7.62 4.36 0.00 1.95 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 2.36 2.41 0.00 114 R 8.40 4.36 0.00 1.76 1.93 0.00 3.21 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 115 R 7.83 4.13 0.00 1.87 1.88 0.00 3.17 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 116 A 8.89 3.99 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 0.00 117 A 7.90 3.88 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 0.00 118 V 7.79 3.48 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 0.69 0.00 0.00 0.95 0.00 0.00 119 R 7.92 3.90 0.00 2.06 2.11 0.00 3.45 0.00 0.00 3.50 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.85 0.00 120 I 7.88 3.89 2.01 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 1.54 0.70 1.34 0.00 0.00 121 A 8.02 4.27 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 0.00 122 H 8.94 4.17 0.00 3.16 3.39 0.00 5.67 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.34 3.96 0.00 2.16 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 0.00 2.59 2.51 0.00 124 L 7.69 3.70 0.00 2.04 1.77 1.10 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 125 M 8.15 4.08 0.00 2.09 2.27 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 2.87 2.60 0.00 126 D 8.37 5.16 0.00 2.92 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 0.00 127 A 8.89 4.02 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 0.00 128 A 7.60 4.05 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 0.00 129 E 8.33 4.12 0.00 2.18 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 2.33 2.50 0.00 130 G 9.08 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 0.00 0.00 0.00 131 K 7.77 4.64 0.00 1.85 1.79 0.00 1.55 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.38 7.81 132 G 8.02 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 0.00 0.00 0.00 133 G 9.18 3.56 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 0.00 134 A 8.06 4.17 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 3.55 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 1.06 0.00 0.00 1.00 0.00 0.00 136 K 7.48 3.82 0.00 1.82 1.81 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.69 1.59 7.81 137 K 7.54 3.51 0.00 1.51 1.13 0.00 0.61 0.00 0.00 0.92 0.00 0.00 2.57 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.01 0.77 7.81 138 K 7.64 3.98 0.00 2.10 2.02 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.39 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.62 1.78 7.81 139 E 8.38 3.98 0.00 2.01 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 2.35 2.54 0.00 140 D 8.54 4.36 0.00 2.76 2.68 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 0.00 141 V 8.19 3.58 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 0.98 0.00 0.00 0.55 0.00 0.00 142 E 8.08 4.38 0.00 2.27 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 2.36 2.66 0.00 143 R 8.00 3.93 0.00 2.06 1.98 0.00 3.12 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 1.64 1.92 0.00 144 M 8.14 4.01 0.00 2.04 2.34 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 2.69 2.55 0.00 145 A 6.84 4.16 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 0.00 0.00 0.00 0.00 0.00 146 E 9.10 4.26 0.00 2.21 2.16 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 2.29 2.24 0.00 147 A 7.35 3.95 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 0.00 148 N 7.78 5.10 0.00 2.83 3.09 0.00 0.00 6.63 7.51 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 0.00 149 R 8.55 3.94 0.00 1.82 1.92 0.00 3.39 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 150 A 7.88 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 7.19 4.26 0.00 2.92 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 0.00 152 A 8.49 4.20 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 0.00 153 H 8.29 4.58 0.00 3.33 3.36 0.00 5.47 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.19 5.13 0.00 3.14 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 0.00 155 R 8.27 4.68 0.00 1.92 1.99 0.00 3.20 0.00 0.00 3.33 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 156 W 9.06 4.55 0.00 3.53 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