NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5345 8.3649 120.5255 54.6106 42.1982 174.5708 2 C 4.4911 8.3226 117.6574 55.2054 36.6747 171.6994 3 L 4.2524 8.2981 121.6821 53.9379 42.9424 176.4946 4 S 4.4772 8.3382 116.8083 60.1060 63.0252 175.2232 5 G 3.9982 9.2891 114.0508 44.5930 0.0000 172.7961 6 W 4.8843 7.9459 119.4197 55.5030 30.4994 176.0262 7 S 5.0008 9.0127 121.5197 57.4482 64.1280 174.0178 8 S 5.2808 8.8155 118.9429 58.2340 64.6578 173.5932 9 Y 4.2090 9.2356 120.8979 57.8281 40.9978 174.4928 10 E 3.6753 9.2557 129.6112 57.4646 26.8642 174.5573 11 G 3.8104 8.2788 98.4331 46.4048 0.0000 172.6682 12 H 4.9049 7.6639 113.7569 54.5531 34.2766 172.3186 13 C 5.7292 8.6628 116.7091 55.6198 42.5852 172.8338 14 Y 5.9802 9.4025 120.1793 55.6236 41.8463 174.7320 15 K 4.3928 8.1512 121.1352 55.2321 35.5994 174.1952 16 A 4.6257 8.1439 129.4925 51.2352 20.0391 176.2667 17 F 4.1781 8.8634 120.6020 55.0235 41.9985 175.3505 18 E 3.8764 8.4098 123.9423 56.1220 29.8365 175.9570 19 K 4.2955 7.4860 116.2239 55.9362 33.9888 175.7306 20 Y 5.1408 8.6776 120.0597 56.2713 38.8464 174.9455 21 K 4.9300 8.8230 123.0204 54.0512 36.7814 175.9747 22 T 5.4541 8.2600 110.4908 60.4683 70.0829 175.2400 23 W 2.5700 7.9875 132.6288 60.3380 30.2512 178.1276 24 E 4.0327 8.1119 116.6136 59.6108 28.8347 178.7597 25 D 4.0710 7.5679 118.4106 56.9652 40.9409 178.3642 26 A 2.6071 7.7222 121.5492 54.8158 18.0953 179.3493 27 E 3.3376 7.2309 117.5248 58.8779 29.5260 179.0939 28 R 3.7982 7.2072 119.9029 58.7989 30.2604 178.5637 29 V 3.4777 7.7255 118.4231 66.2860 31.2294 177.3006 30 C 4.2881 7.6277 115.3156 60.1568 38.5205 175.9395 31 T 4.2157 7.5584 112.7370 64.3634 68.1938 176.6616 32 E 3.7221 8.1219 120.4058 58.8399 29.4637 178.9640 33 Q 4.3358 7.8587 117.5321 57.9389 29.4523 176.1852 34 A 4.4197 6.9492 119.8458 50.3657 22.4684 175.1708 35 K 4.0996 8.3352 121.6014 57.6517 32.4720 177.2957 36 G 3.8082 8.8570 113.4367 45.7642 0.0000 172.9837 37 A 4.5702 7.5228 122.3668 52.1281 19.6238 177.1689 38 H 4.9061 8.5814 116.1001 54.7837 33.5270 172.8956 39 L 4.6758 8.3678 119.0809 54.7009 42.3520 178.0216 40 V 3.8932 8.8744 122.3203 62.4629 32.3786 175.3258 41 S 4.7867 8.8910 118.9761 56.4978 63.6747 173.9528 42 I 4.3216 8.3457 127.4467 60.6971 36.8481 175.6272 43 E 4.7968 8.7844 124.1276 55.8713 30.4625 176.6519 44 S 4.7227 7.7422 112.6171 56.2737 66.7004 175.6676 45 S 4.2797 8.8153 119.9830 62.1302 62.5619 177.3861 46 G 3.8979 8.2151 107.6357 47.8337 0.0000 175.1448 47 E 4.0794 8.1221 119.9501 58.8955 29.6813 178.6617 48 A 4.1312 8.5400 121.5043 55.2283 18.3841 179.4215 49 D 4.2625 8.6070 117.8040 57.3118 40.9374 178.6578 50 F 3.7596 8.1903 121.3764 61.2593 39.3046 177.2180 51 V 3.2817 7.9667 117.8485 65.8113 31.2470 177.8012 52 A 3.9045 7.8880 120.4124 55.1872 18.2695 179.0082 53 Q 3.7131 8.1118 118.3868 59.3719 28.9740 178.2194 54 L 3.5507 7.7246 121.2144 58.0877 41.9511 179.3556 55 V 3.2261 7.4469 117.9943 66.1814 31.2700 178.2736 56 T 3.7866 7.4295 107.8101 64.3508 68.6021 175.7085 57 Q 4.2191 7.7573 119.7120 56.7440 29.2171 176.1364 58 N 4.7760 7.9294 114.7025 52.8101 39.3152 173.9827 59 M 4.6274 7.5661 118.3954 53.3422 34.3739 176.3387 60 K 4.0718 8.9077 122.8180 58.1568 32.6089 177.4875 61 R 4.6045 8.0833 117.7022 54.6495 31.5853 175.6422 62 L 4.9393 8.4969 124.7486 54.8851 42.3974 176.3824 63 D 4.7463 8.0750 115.4645 53.8420 41.5895 174.7080 64 F 4.9160 7.8083 115.2164 55.5837 43.0233 173.2113 65 Y 5.5959 8.8562 118.1746 56.4385 39.5681 175.5157 66 I 4.6634 8.3008 115.8561 58.6566 39.1375 174.9863 67 W 5.2074 9.0603 127.5828 57.0921 30.1754 175.1669 68 I 4.8356 8.7519 116.3143 58.7983 40.2787 175.3857 69 G 4.0971 9.0107 109.7500 45.7425 0.0000 172.9815 70 L 4.5982 7.6378 123.3444 53.4639 43.5597 175.5496 71 R 4.4613 7.9800 121.1428 55.0562 32.5709 174.0395 72 V 3.8362 7.8494 120.0860 61.7985 32.3384 175.6780 73 Q 3.8079 8.4794 127.0847 58.1175 28.5206 176.2616 74 G 3.6440 8.3190 113.1037 44.1899 0.0000 172.7394 75 K 4.0440 8.1099 118.4500 55.4195 30.5160 175.8501 76 V 4.1741 7.5031 121.2638 60.5158 33.7615 175.3742 77 K 3.5905 8.5770 127.3461 58.3768 32.3313 177.3430 78 Q 4.4595 7.3747 114.0776 55.0576 31.2771 174.0595 79 C 4.4401 8.4508 116.2851 59.4924 29.0065 173.2264 80 N 4.5531 7.8768 119.9707 52.5554 39.1850 174.6562 81 S 4.2499 8.8204 121.4808 60.8250 63.4751 173.6846 82 E 5.0603 7.7609 116.5473 53.9016 32.7604 174.2643 83 W 4.7074 9.1311 120.1199 55.8365 29.7657 178.0139 84 S 4.2597 8.9305 114.4719 60.7702 62.3072 174.7026 85 D 4.6155 8.2487 119.1424 53.2136 39.6658 177.0212 86 G 4.5582 8.5184 109.8078 45.8788 0.0000 174.3849 87 S 4.4700 8.4153 115.1169 57.7767 63.9502 174.0959 88 S 4.7055 8.4765 119.2503 58.3167 63.3628 174.1139 89 V 4.0879 8.1271 124.4486 62.7089 31.1812 174.2752 90 S 4.6330 8.5772 119.6621 59.9590 65.3100 173.4019 91 Y 4.3258 8.0353 122.8769 56.2293 39.2397 174.7569 92 E 4.4529 8.0265 123.9059 54.6568 33.1527 174.7062 93 N 4.8383 7.7753 117.1884 52.4546 39.0874 173.8031 94 W 4.3131 7.8858 117.7710 56.8422 30.4898 176.1733 95 I 4.4645 8.3261 120.2912 59.6044 38.5735 176.4371 96 E 3.7847 9.1408 125.4770 59.6587 29.3358 179.4845 97 A 2.7003 7.4788 118.3668 53.8122 18.4392 177.7757 98 E 4.2509 8.2960 114.3668 57.2654 29.8849 177.5713 99 S 4.1231 7.4300 115.5886 57.3975 61.6397 174.0240 100 K 4.4190 7.9638 127.2992 55.1463 30.6285 176.9082 101 T 4.2597 7.6413 108.4763 61.4791 70.0847 175.6769 102 C 5.0571 7.7279 120.1041 55.3041 40.0188 172.6244 103 L 5.5698 8.3603 118.3904 53.2960 45.1494 176.1127 104 G 4.6789 9.1489 108.4336 44.9950 0.0000 171.2211 105 L 5.5885 9.2097 120.4722 53.4736 44.1745 175.8712 106 E 4.6640 8.3322 118.0086 54.3329 33.1059 176.0643 107 K 2.9808 8.1367 122.1695 59.2848 32.4827 178.3383 108 E 3.9399 8.0594 118.4039 58.8555 29.6158 177.2954 109 T 4.4689 7.6547 107.1170 61.0371 69.2472 173.7926 110 D 4.1436 8.7830 119.2551 56.7669 39.0289 173.4488 111 F 3.9922 7.6011 111.3243 59.1353 37.1995 176.6882 112 R 4.7449 8.1557 116.2420 55.4818 31.9252 176.0376 113 K 4.4799 7.9271 116.5484 54.0745 35.2709 175.3585 114 W 5.1251 8.5052 122.1409 56.0706 30.0399 176.0005 115 V 4.5061 8.9714 119.4228 59.5330 33.6985 175.2123 116 N 5.2279 8.7893 122.8531 53.1959 38.9423 174.4949 117 I 4.7255 8.7426 116.7770 58.7249 42.0400 174.2312 118 Y 4.5102 8.6957 124.4595 58.0647 39.2440 177.9202 119 C 4.1312 8.8757 124.6989 59.4747 40.4323 175.1385 120 G 3.3948 5.7333 106.3428 45.4535 0.0000 173.7699 121 Q 4.4226 8.1709 119.7417 55.9394 30.3507 175.2749 122 Q 5.2007 8.6390 120.0331 54.6641 30.6772 174.6935 123 N 5.1171 9.3076 120.8035 50.7852 44.0773 172.4007 124 P 5.6236 0.0000 0.0000 62.4057 33.4096 174.9431 125 F 5.3004 8.1582 114.4762 56.3298 41.8983 173.2732 126 V 4.8729 8.2770 119.1925 61.5197 34.1365 174.0545 127 C 5.3587 9.2807 125.5831 56.0078 43.1283 172.3010 128 E 5.2906 9.4041 121.0539 54.5395 33.0696 175.2063 129 A 4.3841 8.9151 127.4119 52.1245 18.9840 175.7124 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 1 D 8.36 4.53 0.00 2.66 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 2 C 8.32 4.49 0.00 3.10 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 3 L 8.30 4.25 0.00 0.70 1.30 0.70 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.34 4.48 0.00 3.93 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 5 G 9.29 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 0.00 0.00 0.00 6 W 7.95 4.88 0.00 3.33 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 7 S 9.01 5.00 0.00 4.20 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 8 S 8.82 5.28 0.00 4.02 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 9 Y 9.24 4.21 0.00 1.43 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 0.00 0.00 0.00 0.00 10 E 9.26 3.68 0.00 1.49 1.67 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 1.78 1.47 0.00 11 G 8.28 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 H 7.66 4.90 0.00 3.05 2.80 0.00 5.56 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 C 8.66 5.73 0.00 2.91 3.27 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 14 Y 9.40 5.98 0.00 3.20 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 15 K 8.15 4.39 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.47 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.66 7.81 16 A 8.14 4.63 0.96 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 17 F 8.86 4.18 0.00 1.51 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.41 3.88 0.00 1.76 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 2.22 2.14 0.00 19 K 7.49 4.30 0.00 2.04 1.86 0.00 1.89 0.00 0.00 1.96 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.61 1.55 7.81 20 Y 8.68 5.14 0.00 2.83 2.83 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 0.00 0.00 0.00 0.00 21 K 8.82 4.93 0.00 1.50 1.56 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.43 7.81 22 T 8.26 5.45 4.46 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 0.00 0.00 0.00 1.27 0.00 0.00 23 W 7.99 2.57 0.00 1.78 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 24 E 8.11 4.03 0.00 2.15 2.25 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 2.29 2.30 0.00 25 D 7.57 4.07 0.00 2.74 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 26 A 7.72 2.61 0.39 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 27 E 7.23 3.34 0.00 1.16 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 2.05 2.13 0.00 28 R 7.21 3.80 0.00 1.78 1.94 0.00 3.37 0.00 0.00 3.10 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 29 V 7.73 3.48 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 0.83 0.00 0.00 0.88 0.00 0.00 30 C 7.63 4.29 0.00 3.03 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 31 T 7.56 4.22 4.16 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 1.22 0.00 0.00 32 E 8.12 3.72 0.00 2.08 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 2.32 2.36 0.00 33 Q 7.86 4.34 0.00 2.57 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.64 0.00 0.00 0.00 0.00 0.00 2.74 2.71 0.00 34 A 6.95 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 8.34 4.10 0.00 1.67 1.67 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.76 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.39 7.81 36 G 8.86 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.52 4.57 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 38 H 8.58 4.91 0.00 3.04 3.34 0.00 5.62 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.37 4.68 0.00 1.45 1.62 -0.11 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.87 3.89 2.40 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 1.06 0.00 0.00 1.26 0.00 0.00 41 S 8.89 4.79 0.00 4.04 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 42 I 8.35 4.32 2.20 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.71 1.24 0.00 0.00 43 E 8.78 4.80 0.00 2.21 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 2.33 2.31 0.00 44 S 7.74 4.72 0.00 4.09 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 45 S 8.82 4.28 0.00 3.93 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 46 G 8.22 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.12 4.08 0.00 2.41 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 0.00 2.51 2.62 0.00 48 A 8.54 4.13 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 49 D 8.61 4.26 0.00 2.90 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 50 F 8.19 3.76 0.00 2.16 2.47 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 0.00 0.00 0.00 0.00 51 V 7.97 3.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.99 0.00 0.00 52 A 7.89 3.90 1.55 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 0.00 0.00 53 Q 8.11 3.71 0.00 2.16 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.68 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 54 L 7.72 3.55 0.00 0.88 1.37 0.70 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 55 V 7.45 3.23 1.73 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 -0.26 0.00 0.00 0.69 0.00 0.00 56 T 7.43 3.79 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 1.22 0.00 0.00 57 Q 7.76 4.22 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 58 N 7.93 4.78 0.00 2.59 2.62 0.00 0.00 6.84 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 59 M 7.57 4.63 0.00 1.88 1.89 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.26 0.00 60 K 8.91 4.07 0.00 2.09 1.86 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.36 7.81 61 R 8.08 4.60 0.00 2.07 1.98 0.00 3.30 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.85 0.00 62 L 8.50 4.94 0.00 1.70 1.97 0.97 0.95 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 63 D 8.07 4.75 0.00 2.40 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 0.00 0.00 0.00 64 F 7.81 4.92 0.00 3.17 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 65 Y 8.86 5.60 0.00 2.75 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 66 I 8.30 4.66 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.39 1.06 0.00 0.00 67 W 9.06 5.21 0.00 3.31 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 68 I 8.75 4.84 1.84 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.66 1.03 0.00 0.00 69 G 9.01 4.10 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 0.00 0.00 0.00 70 L 7.64 4.60 0.00 1.39 1.31 0.61 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 71 R 7.98 4.46 0.00 1.15 0.86 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.13 0.00 72 V 7.85 3.84 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 0.64 0.00 0.00 0.81 0.00 0.00 73 Q 8.48 3.81 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.24 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 74 G 8.32 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 75 K 8.11 4.04 0.00 1.67 1.70 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.72 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.36 7.81 76 V 7.50 4.17 1.94 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 0.77 0.00 0.00 0.83 0.00 0.00 77 K 8.58 3.59 0.00 1.56 0.89 0.00 1.31 0.00 0.00 1.36 0.00 0.00 2.78 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.26 1.25 7.81 78 Q 7.37 4.46 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.89 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 79 C 8.45 4.44 0.00 2.92 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 80 N 7.88 4.55 0.00 2.65 2.65 0.00 0.00 7.09 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.82 4.25 0.00 4.04 4.10 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 82 E 7.76 5.06 0.00 2.34 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 83 W 9.13 4.71 0.00 3.59 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 84 S 8.93 4.26 0.00 4.04 4.10 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 85 D 8.25 4.62 0.00 2.79 2.82 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 86 G 8.52 4.56 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 87 S 8.42 4.47 0.00 4.12 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 88 S 8.48 4.71 0.00 3.96 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 89 V 8.13 4.09 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 0.69 0.00 0.00 0.32 0.00 0.00 90 S 8.58 4.63 0.00 4.07 3.97 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 91 Y 8.04 4.33 0.00 2.99 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 92 E 8.03 4.45 0.00 2.08 1.85 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 2.23 2.30 0.00 93 N 7.78 4.84 0.00 2.24 2.56 0.00 0.00 7.07 7.95 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 94 W 7.89 4.31 0.00 3.27 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 95 I 8.33 4.46 1.94 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 1.43 0.70 0.88 0.00 0.00 96 E 9.14 3.78 0.00 1.92 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 0.00 2.42 2.32 0.00 97 A 7.48 2.70 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.30 4.25 0.00 2.35 2.29 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 2.37 2.52 0.00 99 S 7.43 4.12 0.00 3.85 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 0.00 100 K 7.96 4.42 0.00 1.75 1.89 0.00 1.78 0.00 0.00 1.91 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.59 7.81 101 T 7.64 4.26 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 1.10 0.00 0.00 102 C 7.73 5.06 0.00 3.01 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 0.00 103 L 8.36 5.57 0.00 1.60 1.61 0.95 0.96 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 0.00 104 G 9.15 4.68 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 0.00 105 L 9.21 5.59 0.00 2.03 1.97 1.14 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.33 4.66 0.00 1.76 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.19 0.00 107 K 8.14 2.98 0.00 1.70 1.60 0.00 1.72 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.37 7.81 108 E 8.06 3.94 0.00 1.88 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 2.27 2.28 0.00 109 T 7.65 4.47 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 0.00 110 D 8.78 4.14 0.00 2.76 2.80 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 0.00 0.00 0.00 0.00 111 F 7.60 3.99 0.00 3.18 3.11 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 0.00 112 R 8.16 4.74 0.00 1.94 1.93 0.00 3.13 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.86 0.00 113 K 7.93 4.48 0.00 1.71 1.68 0.00 1.65 0.00 0.00 1.51 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 1.32 7.81 114 W 8.51 5.13 0.00 3.32 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 0.00 115 V 8.97 4.51 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.97 0.00 0.00 116 N 8.79 5.23 0.00 2.62 2.92 0.00 0.00 6.76 7.45 0.00 0.00 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 I 8.74 4.73 1.90 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 1.33 1.12 0.07 0.00 0.00 118 Y 8.70 4.51 0.00 3.15 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 0.00 119 C 8.88 4.13 0.00 2.69 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 0.00 120 G 5.73 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 Q 8.17 4.42 0.00 2.37 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.69 0.00 0.00 0.00 0.00 0.00 2.59 2.77 0.00 122 Q 8.64 5.20 0.00 1.93 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 123 N 9.31 5.12 0.00 1.53 2.66 0.00 0.00 6.63 7.93 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 0.00 124 P 0.00 5.62 0.00 1.99 1.84 0.00 4.18 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.20 0.00 125 F 8.16 5.30 0.00 3.12 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 V 8.28 4.87 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 1.16 0.00 0.00 0.88 0.00 0.00 127 C 9.28 5.36 0.00 2.98 3.27 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 0.00 128 E 9.40 5.29 0.00 2.00 1.72 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 1.92 1.47 0.00 129 A 8.92 4.38 1.05 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 0.00 0.00