NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3178 8.3044 118.1911 55.2089 32.4881 174.6856 2 H 4.2904 8.6803 121.1121 54.9178 29.8597 172.9223 3 L 4.7788 7.7746 126.9505 52.4928 45.5809 176.8951 4 T 4.1104 8.3009 112.6082 60.9631 70.8425 173.9941 5 P 4.2246 0.0000 0.0000 65.6350 31.3399 178.9139 6 E 3.9523 8.0470 117.0261 59.5682 29.5027 179.1120 7 E 3.9597 8.1109 118.5403 58.9570 29.4488 179.1034 8 K 3.7466 8.0556 119.8106 59.7631 32.2179 178.7714 9 S 4.0772 8.1751 112.9526 61.1453 62.3707 176.0334 10 A 3.9669 7.8950 123.4025 55.0654 18.1761 179.7714 11 V 3.3398 7.6522 116.6230 66.4409 31.3896 178.1623 12 T 3.9181 7.6189 113.7492 66.6913 68.1027 176.0348 13 A 4.1716 8.2644 122.6216 55.2279 18.4811 179.5123 14 L 3.8016 7.9365 118.4118 57.9424 42.1958 178.9122 15 W 4.2665 8.7435 128.3090 59.9453 30.4218 177.7646 16 G 3.8257 7.8368 103.3632 46.3861 0.0000 174.6722 17 K 4.4327 7.6695 118.8715 55.3099 33.0043 176.4425 18 V 3.5659 6.8031 120.5051 62.0580 32.1366 175.8291 19 N 4.4800 8.1763 125.5022 52.0673 38.8012 175.2669 20 V 3.4260 8.0809 127.7888 66.3873 31.6145 176.7732 21 D 4.2887 8.1240 117.5741 57.5039 40.5968 178.1133 22 E 3.8173 8.4337 119.1326 59.6095 29.6643 179.2775 23 V 3.5638 7.7806 118.0712 65.8708 31.5085 178.1392 24 G 3.6067 8.1366 105.5230 47.8741 0.0000 175.9655 25 G 3.6909 8.0929 108.4336 47.1530 0.0000 175.4634 26 E 3.9062 8.4653 121.5637 59.0935 29.7217 178.8499 27 A 4.0159 8.4499 121.1471 55.1512 18.5710 179.3432 28 L 3.8984 8.2783 119.1011 58.0999 42.1927 179.4254 29 G 3.5566 8.3672 105.8557 48.0377 0.0000 175.9864 30 R 3.9260 8.1876 120.9775 58.3834 29.9283 178.9702 31 L 3.9522 7.7966 120.3665 58.3356 41.7279 179.1873 32 L 3.9233 7.7712 118.5858 57.2748 41.1921 179.7306 33 V 3.5828 7.2231 117.5450 65.7356 31.7555 178.0053 34 V 3.5438 7.7627 116.9426 64.2212 32.7880 175.5299 35 Y 3.8633 7.2870 116.1441 53.7308 37.9215 173.6838 36 P 4.4119 0.0000 0.0000 64.4537 31.6727 177.5293 37 W 4.2963 7.9614 114.4965 58.8931 27.8894 177.5947 38 T 4.1699 7.5193 110.4059 63.5400 68.3667 176.0285 39 Q 4.3789 8.2637 121.8431 57.9004 28.4989 177.9860 40 R 3.7373 7.3634 117.1200 58.5410 29.2685 177.7546 41 F 4.5053 6.9238 114.6741 57.1467 39.5541 175.6922 42 F 4.6253 7.7732 118.4932 56.7753 39.9525 177.1545 43 E 4.0307 8.4139 123.0302 59.4560 29.4062 178.9617 44 S 4.4658 8.0623 110.5033 59.1841 63.5089 174.6603 45 F 4.5527 8.4199 119.8481 58.6306 40.0332 176.1683 46 G 4.0318 7.4576 106.0596 44.3567 0.0000 175.2521 47 D 4.5681 8.5866 126.5960 53.9144 41.1174 175.4707 48 L 4.9104 8.3495 125.3959 54.4066 43.5397 177.8011 49 S 4.2656 8.2000 115.7427 60.6227 63.2607 174.8581 50 T 4.7132 7.4443 109.6505 58.2648 72.8708 172.8691 51 P 4.1939 0.0000 0.0000 65.9539 31.3849 178.6463 52 D 4.3191 8.0916 116.7913 57.3982 40.5756 178.5833 53 A 4.0066 7.7368 119.9499 55.0777 18.5218 179.6642 54 V 3.6923 8.2504 117.0479 66.5631 31.4928 178.3543 55 M 4.2384 8.6108 117.3771 57.3574 31.7507 177.9520 56 G 4.0951 7.6670 103.7764 43.4221 0.0000 173.1803 57 N 4.6279 7.5331 121.1678 51.9259 40.0410 173.8973 58 P 4.2476 0.0000 0.0000 66.1390 31.3193 178.7124 59 K 3.6548 8.3584 118.2705 58.8436 31.6941 179.5364 60 V 3.8082 7.8781 118.1990 65.9484 31.6469 178.1401 61 K 3.9779 7.9998 117.6194 59.2683 31.7738 179.1311 62 A 3.9828 8.0894 121.1024 55.6487 18.3857 179.2439 63 H 4.3797 8.5528 116.8054 59.1148 29.8560 177.4796 64 G 4.0127 8.4066 108.0111 48.1589 0.0000 175.8389 65 K 3.9674 7.9567 120.7717 58.6362 31.9292 179.3335 66 K 3.9634 7.7839 120.6051 59.1801 32.1485 178.9364 67 W 4.2802 8.3929 116.8998 59.6848 28.2551 178.0701 68 L 3.1318 6.2664 121.0490 56.9803 41.2514 179.1844 69 G 3.6293 7.9547 105.8181 47.7171 0.0000 175.6082 70 A 4.1315 7.7529 121.9158 54.7787 18.8476 179.1002 71 F 4.3437 8.6086 119.5497 61.4503 39.5060 177.2569 72 S 3.8550 8.7247 113.0404 61.6393 62.2014 176.0158 73 D 4.5338 8.2666 121.2728 56.9156 40.3760 179.0075 74 G 3.5392 7.8051 106.3143 47.4915 0.0000 175.6515 75 L 3.8097 7.1829 119.4912 56.5063 41.5956 178.3245 76 A 4.2709 7.2488 118.9799 52.5785 19.6185 176.5811 77 H 4.8621 8.2915 115.5040 54.7245 29.7488 175.4853 78 L 3.9607 7.9496 119.7814 57.5885 41.8684 178.8070 79 D 4.5178 7.9088 116.7876 56.2081 41.6994 176.5727 80 N 5.0174 7.9924 117.6705 51.5186 40.2325 174.4353 81 L 4.0734 8.0105 122.9865 57.2399 42.0708 178.5977 82 K 4.0300 8.1499 118.1353 59.6829 31.8465 179.2656 83 G 3.6516 8.1531 103.8360 48.3099 0.0000 175.2598 84 T 3.8105 7.6269 116.8268 65.3620 68.5333 175.8763 85 F 4.8002 7.9818 117.1264 56.9515 39.3218 177.1357 86 A 4.0811 7.6388 123.0327 55.8971 18.1526 180.5377 87 T 3.8359 7.8787 113.2212 66.9381 68.5954 176.8177 88 L 4.1610 8.0366 120.3145 57.6891 41.5759 179.4241 89 S 4.2983 8.5816 113.6385 61.5529 62.3194 176.0337 90 E 3.9300 8.2591 121.3100 59.1688 29.1642 179.1273 91 L 3.9014 8.0411 120.2420 58.7082 42.2137 178.9023 92 H 4.1799 8.5757 116.0208 58.7522 28.7064 176.9908 93 C 3.6135 7.6002 120.5188 62.0309 31.1827 175.3343 94 D 4.4140 8.1994 120.5640 56.4481 40.5526 177.4921 95 K 4.2798 7.7730 117.1899 57.3010 33.6821 177.4149 96 L 4.1350 7.6691 116.6283 54.8489 42.3886 176.0199 97 H 4.1330 7.1651 113.2130 56.6337 26.5289 175.2090 98 V 3.6154 8.0049 119.2160 61.1507 32.1174 174.8025 99 D 4.3607 8.8708 127.2448 53.9069 41.5414 174.9755 100 P 3.4382 0.0000 0.0000 65.3146 31.8906 177.9717 101 E 3.8850 8.3447 118.6634 59.3500 29.3130 178.5811 102 N 4.2613 8.1165 116.7118 56.1743 38.5014 177.2981 103 F 4.3893 7.3373 119.2864 60.5473 38.9197 177.9627 104 R 3.9930 7.9003 117.3596 59.1615 30.0018 178.8189 105 L 3.8193 7.6598 118.3741 57.6910 41.4647 179.4023 106 L 4.0080 8.0627 120.4200 57.7932 42.0239 179.2250 107 G 3.6452 8.0715 105.9263 47.9524 0.0000 175.5257 108 N 4.5024 8.2799 119.0727 55.8956 38.4917 177.8149 109 V 3.6552 7.9629 119.9071 65.7490 31.6027 177.7070 110 L 3.9973 8.3104 120.5607 58.2964 41.9180 179.1935 111 V 3.6385 7.7600 117.8412 66.2420 31.4094 177.7618 112 C 4.1359 8.1592 116.5257 62.7064 27.8741 176.3036 113 V 3.5186 7.9551 119.8763 66.0040 31.1136 178.0457 114 L 3.7816 7.8135 118.4833 57.6477 41.3307 179.4740 115 A 3.6552 7.3008 120.5839 55.2306 18.0898 179.1797 116 H 4.1175 8.0740 115.9967 59.5448 29.9596 176.7507 117 H 3.8497 8.1633 119.6380 58.6092 29.9798 176.5219 118 F 4.6808 8.4414 118.2533 56.7743 39.6784 177.1641 119 G 3.8075 8.8356 108.6136 46.0515 0.0000 177.3395 120 K 4.0333 8.8792 122.4532 59.1524 32.4251 177.7640 121 E 4.1067 8.0152 119.4726 58.1300 30.0619 176.9514 122 F 4.6211 8.0254 123.3230 57.1266 37.8259 175.2655 123 T 4.1868 7.3697 115.7400 60.3193 71.2947 173.4830 124 P 4.1684 0.0000 0.0000 65.5241 31.4343 177.2604 125 P 4.2323 0.0000 0.0000 65.3978 31.2654 178.8773 126 V 3.5763 7.3475 115.9170 65.7474 31.3342 177.9010 127 Q 3.5040 7.8663 119.2525 59.0424 29.0215 177.8852 128 A 4.0163 8.0686 121.5733 55.3133 18.4489 179.5007 129 A 3.9263 7.9206 118.6985 55.6486 18.4241 179.5766 130 Y 4.0148 8.1867 115.1992 61.1108 37.9934 178.5609 131 Q 4.1512 8.7538 119.7632 58.7519 28.6939 178.8898 132 K 3.9925 8.0150 119.1932 59.3289 32.0365 179.4114 133 V 3.5388 7.6587 118.1282 66.3339 31.4583 178.5076 134 V 3.8686 8.2855 111.9305 64.4456 31.3861 178.5454 135 A 4.1402 8.2115 120.6883 54.9947 18.2310 179.9481 136 G 3.5537 8.3134 104.5695 47.8986 0.0000 176.2121 137 V 3.4832 8.2647 120.9010 65.5887 31.4270 177.9997 138 A 3.8692 8.1961 120.6806 55.2590 18.0754 179.4283 139 N 4.3162 8.3433 114.8100 56.2833 38.3862 177.5779 140 A 4.0406 7.8689 121.4780 55.1095 18.5506 179.3909 141 L 3.9441 7.7866 116.1967 56.7507 41.9529 178.4137 142 A 4.3727 7.5453 119.5583 52.4533 19.0908 178.1645 143 H 4.0932 7.8597 117.2752 58.9328 29.9518 175.9411 144 K 4.5376 8.1587 115.9412 56.2778 32.0010 176.0739 145 Y 4.1802 8.0611 117.8060 58.1791 38.4199 175.6427 146 H 4.5200 8.3257 118.1080 55.9512 28.7144 173.0789 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 M 8.30 4.32 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.63 0.00 2 H 8.68 4.29 0.00 3.22 3.25 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.77 4.78 0.00 1.53 1.44 0.81 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.30 4.11 4.39 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 1.27 0.00 0.00 5 P 0.00 4.22 0.00 2.15 2.11 0.00 3.58 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 2.09 2.14 0.00 6 E 8.05 3.95 0.00 2.03 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 2.39 2.45 0.00 7 E 8.11 3.96 0.00 1.98 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 2.30 2.29 0.00 8 K 8.06 3.75 0.00 1.99 1.92 0.00 1.44 0.00 0.00 1.48 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.43 7.81 9 S 8.18 4.08 0.00 3.92 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.89 3.97 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 11 V 7.65 3.34 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 0.50 0.00 0.00 0.48 0.00 0.00 12 T 7.62 3.92 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 1.23 0.00 0.00 13 A 8.26 4.17 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 14 L 7.94 3.80 0.00 1.87 1.98 -0.07 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.74 4.27 0.00 3.86 3.20 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 0.00 16 G 7.84 3.83 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 0.00 0.00 0.00 17 K 7.67 4.43 0.00 1.92 2.04 0.00 1.66 0.00 0.00 1.42 0.00 0.00 3.12 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.61 7.81 18 V 6.80 3.57 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 0.50 0.00 0.00 19 N 8.18 4.48 0.00 2.68 2.56 0.00 0.00 6.82 7.71 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 20 V 8.08 3.43 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 1.00 0.00 0.00 0.93 0.00 0.00 21 D 8.12 4.29 0.00 2.85 2.65 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 22 E 8.43 3.82 0.00 1.98 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 2.18 2.26 0.00 23 V 7.78 3.56 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 0.94 0.00 0.00 0.66 0.00 0.00 24 G 8.14 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.09 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 26 E 8.47 3.91 0.00 2.18 2.18 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 2.28 2.37 0.00 27 A 8.45 4.02 1.64 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 28 L 8.28 3.90 0.00 2.06 1.78 0.60 1.19 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 29 G 8.37 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 30 R 8.19 3.93 0.00 1.84 1.94 0.00 3.12 0.00 0.00 3.05 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 31 L 7.80 3.95 0.00 1.80 1.81 0.91 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.77 3.92 0.00 1.83 1.65 0.72 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.22 3.58 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 0.71 0.00 0.00 0.93 0.00 0.00 34 V 7.76 3.54 1.45 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 0.05 0.00 0.00 0.76 0.00 0.00 35 Y 7.29 3.86 0.00 2.53 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.41 0.00 2.23 2.13 0.00 3.79 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 37 W 7.96 4.30 0.00 3.50 3.47 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 38 T 7.52 4.17 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 39 Q 8.26 4.38 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 40 R 7.36 3.74 0.00 1.57 1.91 0.00 2.95 0.00 0.00 2.57 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.50 0.00 41 F 6.92 4.51 0.00 1.85 2.26 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 42 F 7.77 4.63 0.00 2.76 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.41 4.03 0.00 2.00 2.03 0.00 0.00 0.00 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 2.22 0.00 44 S 8.06 4.47 0.00 4.12 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 45 F 8.42 4.55 0.00 3.20 3.19 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 46 G 7.46 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.59 4.57 0.00 2.66 2.63 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 0.00 0.00 0.00 0.00 48 L 8.35 4.91 0.00 1.64 1.60 0.99 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.20 4.27 0.00 4.03 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 50 T 7.44 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 52 D 8.09 4.32 0.00 2.67 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 53 A 7.74 4.01 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.25 3.69 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 1.06 0.00 0.00 0.97 0.00 0.00 55 M 8.61 4.24 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.92 0.00 56 G 7.67 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 57 N 7.53 4.63 0.00 2.96 2.85 0.00 0.00 6.95 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 58 P 0.00 4.25 0.00 2.25 2.27 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 59 K 8.36 3.65 0.00 1.47 0.74 0.00 1.48 0.00 0.00 0.96 0.00 0.00 2.79 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.11 1.21 7.81 60 V 7.88 3.81 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 1.17 0.00 0.00 1.08 0.00 0.00 61 K 8.00 3.98 0.00 2.00 1.84 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.64 7.81 62 A 8.09 3.98 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 63 H 8.55 4.38 0.00 3.62 3.59 0.00 5.80 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 64 G 8.41 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 65 K 7.96 3.97 0.00 1.84 1.90 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.67 7.81 66 K 7.78 3.96 0.00 2.00 2.06 0.00 1.87 0.00 0.00 1.85 0.00 0.00 3.10 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.57 1.54 7.81 67 W 8.39 4.28 0.00 3.77 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 6.27 3.13 0.00 0.37 1.20 0.33 1.32 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 69 G 7.95 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.75 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 71 F 8.61 4.34 0.00 3.20 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 72 S 8.72 3.86 0.00 4.37 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 73 D 8.27 4.53 0.00 2.71 2.67 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 74 G 7.81 3.54 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 0.00 75 L 7.18 3.81 0.00 1.40 1.39 -0.55 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.25 4.27 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.29 4.86 0.00 3.03 3.14 0.00 5.83 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 78 L 7.95 3.96 0.00 1.54 1.66 0.79 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.91 4.52 0.00 2.63 2.69 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 80 N 7.99 5.02 0.00 2.72 2.60 0.00 0.00 7.04 6.20 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 81 L 8.01 4.07 0.00 1.77 1.86 0.95 0.94 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 82 K 8.15 4.03 0.00 1.75 1.78 0.00 1.27 0.00 0.00 1.39 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.45 7.81 83 G 8.15 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.63 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 0.44 0.00 0.00 85 F 7.98 4.80 0.00 3.14 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 86 A 7.64 4.08 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 87 T 7.88 3.84 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 88 L 8.04 4.16 0.00 2.03 1.88 1.24 0.95 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 89 S 8.58 4.30 0.00 4.03 4.15 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 90 E 8.26 3.93 0.00 2.25 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 2.34 2.54 0.00 91 L 8.04 3.90 0.00 1.89 1.93 0.92 0.87 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 92 H 8.58 4.18 0.00 3.55 3.71 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.60 3.61 0.00 1.23 2.43 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.20 4.41 0.00 2.70 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 95 K 7.77 4.28 0.00 1.80 1.78 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.50 7.81 96 L 7.67 4.13 0.00 1.67 1.55 0.69 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.17 4.13 0.00 3.48 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.00 3.62 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 0.03 0.00 0.00 0.27 0.00 0.00 99 D 8.87 4.36 0.00 2.79 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 0.00 100 P 0.00 3.44 0.00 1.96 1.86 0.00 3.44 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.68 0.00 101 E 8.34 3.89 0.00 2.09 1.90 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 2.29 2.39 0.00 102 N 8.12 4.26 0.00 2.39 2.66 0.00 0.00 6.93 8.86 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 0.00 103 F 7.34 4.39 0.00 3.11 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 0.00 104 R 7.90 3.99 0.00 1.97 1.97 0.00 3.12 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 105 L 7.66 3.82 0.00 1.65 1.25 0.73 -0.14 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 0.00 106 L 8.06 4.01 0.00 1.64 1.65 0.49 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.07 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.28 4.50 0.00 2.94 2.95 0.00 0.00 6.68 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.96 3.66 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 1.12 0.00 0.00 1.14 0.00 0.00 110 L 8.31 4.00 0.00 2.00 1.95 1.05 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.76 3.64 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 1.35 0.00 0.00 1.21 0.00 0.00 112 C 8.16 4.14 0.00 3.21 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 0.00 113 V 7.96 3.52 2.21 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 1.03 0.00 0.00 0.97 0.00 0.00 114 L 7.81 3.78 0.00 0.98 1.16 0.73 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.30 3.66 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.07 4.12 0.00 3.14 3.43 0.00 5.77 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.16 3.85 0.00 2.91 2.63 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.44 4.68 0.00 3.25 3.12 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 0.00 119 G 8.84 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 0.00 120 K 8.88 4.03 0.00 1.92 2.02 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.48 7.81 121 E 8.02 4.11 0.00 2.04 2.27 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 2.33 2.28 0.00 122 F 8.03 4.62 0.00 3.08 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 0.00 123 T 7.37 4.19 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 1.30 0.00 0.00 124 P 0.00 4.17 0.00 2.16 2.15 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 P 0.00 4.23 0.00 2.12 2.07 0.00 3.51 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 2.09 2.12 0.00 126 V 7.35 3.58 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 0.97 0.00 0.00 0.90 0.00 0.00 127 Q 7.87 3.50 0.00 1.76 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.44 2.60 0.00 128 A 8.07 4.02 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 0.00 129 A 7.92 3.93 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 0.00 130 Y 8.19 4.01 0.00 3.44 3.28 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 0.00 131 Q 8.75 4.15 0.00 2.26 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.63 0.00 132 K 8.01 3.99 0.00 2.03 1.85 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.61 7.81 133 V 7.66 3.54 2.26 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 1.01 0.00 0.00 0.80 0.00 0.00 134 V 8.29 3.87 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 1.02 0.00 0.00 1.16 0.00 0.00 135 A 8.21 4.14 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 0.00 136 G 8.31 3.55 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 0.00 137 V 8.26 3.48 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 0.70 0.00 0.00 0.96 0.00 0.00 138 A 8.20 3.87 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 0.00 139 N 8.34 4.32 0.00 2.89 2.89 0.00 0.00 6.90 6.38 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 0.00 140 A 7.87 4.04 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.79 3.94 0.00 1.03 0.61 0.04 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.55 4.37 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 0.00 143 H 7.86 4.09 0.00 3.30 3.52 0.00 5.74 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.16 4.54 0.00 1.87 1.84 0.00 1.76 0.00 0.00 1.81 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.60 7.81 145 Y 8.06 4.18 0.00 3.11 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 0.00 146 H 8.33 4.52 0.00 3.19 3.22 0.00 5.75 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