NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4314 8.1633 120.3494 55.6829 34.0167 177.3890 2 N 4.0477 8.2643 114.3877 54.9768 39.4115 173.3143 3 R 4.6556 7.7127 117.8760 55.0277 30.8984 175.9275 4 G 4.0891 7.9501 106.7371 47.8000 0.0000 173.3080 5 A 4.1260 7.9117 122.5651 55.1380 18.5832 179.4550 6 L 3.9597 7.8564 117.9401 57.8926 42.0190 178.7876 7 I 3.6369 8.0722 119.7053 63.7058 37.0091 177.6915 8 K 4.3695 7.3483 121.1879 58.2449 32.3580 178.5285 9 L 3.8479 8.0764 118.8329 56.9056 41.6439 179.5458 10 V 3.5851 7.5293 118.0207 65.7867 31.4214 177.0156 11 E 4.1801 9.1702 119.6265 58.8914 30.3666 177.7892 12 S 4.3172 7.1282 114.9507 58.4944 60.0743 173.9806 13 R 4.5800 7.6755 112.8406 55.7235 30.9987 176.2249 14 Y 4.2805 7.3765 115.0813 58.2398 38.0481 175.9618 15 V 4.3322 7.3209 114.3005 60.7588 32.8145 174.8474 16 R 4.7616 7.9002 115.8692 55.2821 30.7961 174.6507 17 T 4.5534 8.2029 110.2505 61.4570 69.2083 175.2274 18 D 4.6434 8.4710 120.0121 56.4871 39.2206 177.5388 19 L 4.0406 7.0834 117.6065 53.8700 42.0273 175.2885 20 P 4.5671 0.0000 0.0000 62.6611 32.1499 175.0508 21 E 4.7996 8.3922 118.3520 54.9633 31.4466 175.7974 22 F 4.9873 7.6770 115.8598 55.6604 40.6502 173.6948 23 R 4.4847 9.0176 118.6878 54.3494 32.1004 172.5267 24 P 3.9908 0.0000 0.0000 61.4982 31.6252 173.5827 25 G 3.9994 8.0326 116.3146 45.6820 0.0000 173.6692 26 D 4.6158 8.3152 120.7605 53.1274 41.1111 174.3971 27 T 4.6494 8.8969 115.9774 60.4516 69.3289 173.6778 28 V 4.5780 7.9926 126.6942 59.8173 34.8799 174.5334 29 R 4.7493 8.7798 122.6279 54.8215 31.9143 175.1036 30 V 4.3085 8.6087 120.2836 59.7690 34.5779 175.4801 31 S 4.6521 8.4830 121.5011 57.4742 63.5621 172.7605 32 Y 4.8824 8.5233 126.3657 56.4753 40.7679 174.2716 33 K 4.7912 7.3630 123.8189 55.0340 33.4026 176.1671 34 V 4.3436 8.3226 124.8038 61.0155 34.6771 175.3560 35 K 4.3784 8.7863 127.0492 54.2374 30.5973 174.0797 36 E 4.2457 8.1727 117.9206 56.5640 30.9025 177.8499 37 G 4.0212 8.5398 114.6583 46.0736 0.0000 174.1835 38 N 4.7279 8.6855 120.3378 52.6498 38.5820 175.2961 39 R 4.3811 7.4652 115.2333 56.9104 32.0012 175.0067 40 T 4.6847 8.1056 109.6492 64.3093 72.5788 171.9570 41 R 5.1404 8.1899 125.5947 54.6261 33.2181 173.2649 42 I 4.9512 8.4267 118.9409 60.0805 39.8283 174.8273 43 Q 4.6565 9.0878 128.7440 54.3598 31.2174 174.0261 44 D 5.1655 8.8251 126.5999 53.7173 42.4623 175.6043 45 F 5.1148 9.0202 124.8309 56.4714 42.2553 173.2762 46 E 4.7373 8.4430 126.9088 54.8831 31.7391 174.5218 47 G 3.8639 7.8945 112.9447 45.4401 0.0000 171.9456 48 I 4.2103 7.9109 120.4153 61.0919 38.5695 175.9478 49 V 4.6015 8.0860 124.5849 61.0654 32.6280 176.6054 50 I 4.0732 8.7880 126.0527 62.3534 39.1376 175.5797 51 R 4.6395 7.2169 116.1624 55.4054 34.0684 173.9256 52 I 5.1619 8.4360 125.8110 59.7375 40.4978 174.6294 53 R 4.5307 8.7134 125.2021 54.6423 31.0718 175.8780 54 R 4.7373 8.4608 123.1079 54.9634 32.4256 176.7500 55 N 4.9344 8.5140 117.9597 52.8924 41.2165 175.3786 56 G 3.8906 8.1445 115.3854 46.7987 0.0000 173.4037 57 F 4.4047 8.9394 125.0681 59.9529 40.3152 174.8863 58 N 4.0084 7.8721 120.5722 53.0607 35.3722 174.0226 59 T 4.7411 7.0616 112.7900 61.1700 73.1079 174.4917 60 T 5.2506 8.5142 111.5634 60.9523 73.0161 172.1586 61 F 6.1761 9.1211 115.0730 55.4830 41.9438 173.3707 62 T 4.8734 8.6106 109.2447 59.8629 72.0654 172.5289 63 V 4.8740 8.7631 124.5451 61.1549 34.2328 174.0736 64 R 5.4085 9.1308 128.3452 54.6488 32.9881 174.4976 65 K 4.6329 8.9530 123.0932 55.7175 36.4563 175.0331 66 V 4.2847 8.3923 123.3696 62.2651 32.1744 174.9466 67 S 4.4692 9.3370 124.3200 57.6880 63.8622 172.9520 68 Y 4.1140 8.9186 124.7017 60.5191 34.6143 170.1411 69 G 4.1735 8.2160 102.5931 45.7986 0.0000 170.8368 70 V 4.4315 7.8248 118.3807 60.4842 34.7628 175.1250 71 G 4.0849 8.8505 115.2274 46.6251 0.0000 172.8103 72 V 4.7507 8.8789 121.9466 61.2556 35.5451 173.4223 73 E 5.3718 8.7377 125.0001 54.7588 33.3680 175.0255 74 R 4.2861 8.9458 121.8951 54.2251 33.7815 174.3896 75 I 4.3385 7.6475 123.5177 59.5587 39.1552 174.9911 76 F 4.8167 8.3417 125.4454 55.0131 42.4824 173.1857 77 P 4.4617 0.0000 0.0000 62.4646 30.6576 177.8097 78 L 4.1384 8.6427 126.2266 58.3317 42.9876 178.7892 79 H 4.9131 7.8739 114.8349 55.8464 29.0074 175.6127 80 S 4.6698 8.1928 113.5788 57.2783 63.7391 171.9991 81 P 4.5220 0.0000 0.0000 65.4123 31.8020 178.3679 82 L 3.9777 7.8015 117.0046 56.5462 42.3866 177.2969 83 I 4.0119 7.2094 120.4729 61.2741 37.0230 175.2894 84 Q 4.2964 8.9479 130.8614 57.1587 28.9005 176.2930 85 K 4.7586 7.5455 115.3497 54.7187 37.0859 175.2532 86 I 4.8324 7.8497 118.2919 58.7611 37.1399 174.3620 87 D 4.4102 8.2102 121.1015 54.9937 42.1550 175.6627 88 I 4.4337 8.2852 118.8352 60.1182 39.1495 175.1037 89 V 4.1780 8.3934 117.9198 62.7815 32.7091 175.8314 90 Q 4.7076 7.8240 119.9928 54.2708 32.9698 173.3908 91 R 4.9998 8.5068 121.2775 54.6107 34.2557 174.5855 92 G 4.2173 8.4302 107.5806 44.9810 0.0000 172.2868 93 R 4.2743 8.4060 119.5973 55.5799 30.5824 176.9655 94 A 4.1436 8.8199 126.5173 54.3072 19.1175 179.5321 95 R 3.9596 8.1899 111.2352 56.8093 29.7143 174.6421 96 R 4.6210 7.8139 114.9801 55.1905 33.0324 172.6675 97 A 4.2541 7.9461 121.6089 52.4222 20.0652 176.8929 98 K 4.1938 8.1085 119.4536 54.6194 33.2172 178.4482 99 L 4.9463 8.0204 129.3376 55.0306 39.7659 177.5342 100 Y 4.2087 7.8138 117.1146 60.6298 38.4803 178.7487 101 F 4.3795 8.6251 115.7226 59.7051 37.9558 177.5151 102 I 3.5655 6.1808 113.1584 63.2194 37.5761 177.2945 103 R 4.0305 7.7677 120.1277 59.3415 30.1536 176.8502 104 N 4.3250 7.4905 113.1773 55.2154 38.1096 176.6642 105 L 4.3479 8.2148 126.6415 54.3079 41.1114 174.2789 106 S 4.8599 8.0088 115.2410 55.3373 67.0502 172.7281 107 D 4.5748 8.2466 127.9743 54.5709 39.7674 178.4020 108 R 4.3019 8.4858 122.6469 56.8842 30.9742 176.6497 109 E 4.2048 8.2393 117.5184 59.3917 29.5855 178.3395 110 I 3.6863 7.8013 118.3235 64.3060 37.8083 177.3257 111 R 3.8705 8.0685 117.4999 59.3643 29.9392 177.9334 112 R 4.0541 7.6493 117.2500 60.0206 30.2475 178.7523 113 K 4.4463 8.2598 116.3490 57.5296 32.8782 177.1122 114 L 4.6227 7.7974 119.0082 52.5276 42.2608 176.2877 115 R 4.2578 7.9449 120.6616 54.3876 31.5074 175.7020 116 A 4.5775 8.2364 121.1379 51.8466 19.4328 178.3470 117 D 4.6565 8.3014 126.8085 53.2222 39.7362 177.4614 118 R 3.9792 7.8064 117.6429 57.7947 31.1413 178.9736 119 K 4.0621 8.7784 120.9052 59.2511 32.5037 178.7682 120 R 4.1217 8.0451 113.1624 57.3485 29.8214 177.9752 121 I 4.1444 7.6498 119.9938 63.6042 37.6041 177.5984 122 D 4.6997 7.7885 119.7009 57.4430 40.9902 179.0002 123 Q 4.1557 8.0632 118.4237 59.3712 28.7416 177.4187 124 D 4.5268 8.6655 120.6935 57.0495 40.5654 179.3167 125 R 4.3230 7.6707 115.3536 57.3962 30.3945 176.7264 126 A 4.4722 8.8996 119.9118 53.4934 21.6828 178.2417 127 A 4.2944 8.4958 118.2619 53.0310 18.8211 177.9786 128 E 4.4897 7.9983 115.3197 57.5702 31.4627 177.5346 129 R 4.0583 7.5050 117.3900 58.8354 30.7285 178.1869 130 A 4.1342 8.4442 116.7444 53.1757 17.4402 178.0794 131 A 4.3289 7.6463 121.9195 54.3928 19.7575 180.3008 132 K 3.8400 7.9539 118.0790 58.4522 32.5847 177.8147 133 E 4.2862 8.0419 114.5316 55.9826 29.8880 176.0282 134 E 4.0779 8.3021 121.8302 55.5973 28.9320 175.3952 135 A 3.7054 8.2281 131.5104 51.9668 16.2957 178.3060 136 Q 4.6429 7.2755 118.7535 54.9479 30.9530 173.7746 137 K 4.1904 7.8615 121.8764 56.6080 32.3126 177.1857 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 8.16 4.43 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.63 0.00 2 N 8.26 4.05 0.00 2.83 2.91 0.00 0.00 6.58 6.78 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 3 R 7.71 4.66 0.00 1.78 1.76 0.00 3.18 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 4 G 7.95 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 0.00 0.00 0.00 5 A 7.91 4.13 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 6 L 7.86 3.96 0.00 1.78 1.68 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.07 3.64 2.03 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 1.65 0.92 0.91 0.00 0.00 8 K 7.35 4.37 0.00 1.95 1.95 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.33 7.81 9 L 8.08 3.85 0.00 1.72 1.74 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.53 3.59 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 0.88 0.00 0.00 0.97 0.00 0.00 11 E 9.17 4.18 0.00 2.04 1.83 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 2.28 2.35 0.00 12 S 7.13 4.32 0.00 4.15 3.75 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 13 R 7.68 4.58 0.00 1.83 2.12 0.00 3.01 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.51 0.00 14 Y 7.38 4.28 0.00 2.27 2.94 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 15 V 7.32 4.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.96 0.00 0.00 16 R 7.90 4.76 0.00 2.11 1.88 0.00 3.08 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 17 T 8.20 4.55 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 1.21 0.00 0.00 18 D 8.47 4.64 0.00 2.82 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 19 L 7.08 4.04 0.00 1.76 1.72 1.00 1.05 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 20 P 0.00 4.57 0.00 2.06 2.04 0.00 3.62 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 1.99 2.10 0.00 21 E 8.39 4.80 0.00 1.95 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 2.14 2.24 0.00 22 F 7.68 4.99 0.00 3.25 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 23 R 9.02 4.48 0.00 1.92 1.93 0.00 2.77 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 24 P 0.00 3.99 0.00 2.23 2.05 0.00 3.70 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 1.98 2.01 0.00 25 G 8.03 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 26 D 8.32 4.62 0.00 2.97 2.81 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 27 T 8.90 4.65 4.18 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 1.19 0.00 0.00 28 V 7.99 4.58 1.71 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 0.50 0.00 0.00 0.67 0.00 0.00 29 R 8.78 4.75 0.00 1.68 1.91 0.00 3.36 0.00 0.00 3.22 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.93 0.00 30 V 8.61 4.31 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 0.74 0.00 0.00 0.66 0.00 0.00 31 S 8.48 4.65 0.00 3.75 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 32 Y 8.52 4.88 0.00 2.93 2.85 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 0.00 33 K 7.36 4.79 0.00 1.41 1.60 0.00 1.58 0.00 0.00 1.56 0.00 0.00 2.85 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.32 1.37 7.81 34 V 8.32 4.34 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 1.06 0.00 0.00 1.10 0.00 0.00 35 K 8.79 4.38 0.00 1.77 1.75 0.00 1.71 0.00 0.00 0.61 0.00 0.00 3.05 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.38 1.42 7.81 36 E 8.17 4.25 0.00 2.08 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 2.27 2.31 0.00 37 G 8.54 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.69 4.73 0.00 2.83 2.94 0.00 0.00 5.87 7.66 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 39 R 7.47 4.38 0.00 1.94 2.02 0.00 3.07 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 40 T 8.11 4.68 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 1.18 0.00 0.00 41 R 8.19 5.14 0.00 1.89 2.05 0.00 3.28 0.00 0.00 3.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 42 I 8.43 4.95 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.53 0.95 0.00 0.00 43 Q 9.09 4.66 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.95 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 44 D 8.83 5.17 0.00 2.65 2.61 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 45 F 9.02 5.11 0.00 3.13 2.99 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 0.00 0.00 0.00 46 E 8.44 4.74 0.00 1.90 1.70 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 2.07 2.18 0.00 47 G 7.89 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 48 I 7.91 4.21 1.79 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 1.23 0.56 0.90 0.00 0.00 49 V 8.09 4.60 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 1.02 0.00 0.00 1.27 0.00 0.00 50 I 8.79 4.07 1.75 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.33 0.51 0.00 0.00 51 R 7.22 4.64 0.00 1.51 1.41 0.00 3.19 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.66 0.00 52 I 8.44 5.16 1.83 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.84 0.87 0.00 0.00 53 R 8.71 4.53 0.00 1.92 2.09 0.00 2.78 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 54 R 8.46 4.74 0.00 1.80 1.86 0.00 3.20 0.00 0.00 3.09 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 55 N 8.51 4.93 0.00 2.61 2.67 0.00 0.00 7.03 7.98 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 56 G 8.14 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 0.00 0.00 0.00 57 F 8.94 4.40 0.00 2.94 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 58 N 7.87 4.01 0.00 2.64 2.45 0.00 0.00 5.85 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 59 T 7.06 4.74 4.34 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 1.21 0.00 0.00 60 T 8.51 5.25 4.40 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 1.19 0.00 0.00 61 F 9.12 6.18 0.00 3.45 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 62 T 8.61 4.87 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 1.13 0.00 0.00 63 V 8.76 4.87 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 0.78 0.00 0.00 1.27 0.00 0.00 64 R 9.13 5.41 0.00 1.83 1.67 0.00 3.14 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.70 0.00 65 K 8.95 4.63 0.00 1.71 1.59 0.00 1.36 0.00 0.00 1.39 0.00 0.00 3.23 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.59 1.46 7.81 66 V 8.39 4.28 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 0.77 0.00 0.00 0.93 0.00 0.00 67 S 9.34 4.47 0.00 3.88 3.77 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 68 Y 8.92 4.11 0.00 3.17 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 69 G 8.22 4.17 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 0.00 70 V 7.82 4.43 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 0.97 0.00 0.00 0.99 0.00 0.00 71 G 8.85 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 72 V 8.88 4.75 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 0.96 0.00 0.00 1.02 0.00 0.00 73 E 8.74 5.37 0.00 1.81 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 74 R 8.95 4.29 0.00 1.26 0.66 0.00 2.21 0.00 0.00 2.46 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.52 0.00 75 I 7.65 4.34 1.62 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 1.18 0.35 0.76 0.00 0.00 76 F 8.34 4.82 0.00 1.72 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 77 P 0.00 4.46 0.00 2.15 2.00 0.00 3.86 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 2.21 2.10 0.00 78 L 8.64 4.14 0.00 1.88 1.75 0.97 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 79 H 7.87 4.91 0.00 3.32 3.64 0.00 5.76 0.00 0.00 0.00 0.00 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.19 4.67 0.00 4.06 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 81 P 0.00 4.52 0.00 2.26 2.12 0.00 3.76 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 82 L 7.80 3.98 0.00 1.08 0.74 0.98 0.86 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 83 I 7.21 4.01 1.95 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.66 0.98 0.00 0.00 84 Q 8.95 4.30 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.66 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 85 K 7.55 4.76 0.00 1.80 1.87 0.00 1.56 0.00 0.00 1.73 0.00 0.00 2.74 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.37 7.81 86 I 7.85 4.83 1.82 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.45 0.86 0.00 0.00 87 D 8.21 4.41 0.00 2.80 2.53 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 88 I 8.29 4.43 1.79 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.62 0.83 0.00 0.00 89 V 8.39 4.18 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 0.59 0.00 0.00 0.91 0.00 0.00 90 Q 7.82 4.71 0.00 2.09 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 91 R 8.51 5.00 0.00 1.76 1.77 0.00 3.47 0.00 0.00 3.46 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 92 G 8.43 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 0.00 0.00 0.00 0.00 93 R 8.41 4.27 0.00 1.87 1.92 0.00 3.33 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 1.67 1.73 0.00 94 A 8.82 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 95 R 8.19 3.96 0.00 1.95 2.07 0.00 3.23 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 96 R 7.81 4.62 0.00 1.77 1.91 0.00 3.25 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.60 0.00 97 A 7.95 4.25 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.11 4.19 0.00 1.87 1.89 0.00 1.65 0.00 0.00 1.80 0.00 0.00 3.19 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.57 1.50 7.81 99 L 8.02 4.95 0.00 1.51 2.17 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 7.81 4.21 0.00 3.13 3.03 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 0.00 101 F 8.63 4.38 0.00 3.22 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 6.18 3.57 1.62 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.24 -0.08 0.00 0.00 103 R 7.77 4.03 0.00 2.01 2.11 0.00 3.51 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.68 0.00 104 N 7.49 4.32 0.00 2.81 2.69 0.00 0.00 7.06 7.73 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 0.00 105 L 8.21 4.35 0.00 1.67 1.67 0.96 0.91 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 0.00 106 S 8.01 4.86 0.00 3.92 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 0.00 107 D 8.25 4.57 0.00 2.82 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 0.00 0.00 0.00 0.00 108 R 8.49 4.30 0.00 1.86 1.95 0.00 3.17 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 109 E 8.24 4.20 0.00 2.38 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 2.40 2.47 0.00 110 I 7.80 3.69 1.94 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.50 0.94 0.00 0.00 111 R 8.07 3.87 0.00 2.00 1.95 0.00 3.30 0.00 0.00 3.15 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 112 R 7.65 4.05 0.00 1.86 2.19 0.00 3.45 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 113 K 8.26 4.45 0.00 2.06 2.07 0.00 1.64 0.00 0.00 1.77 0.00 0.00 3.14 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.75 1.68 7.81 114 L 7.80 4.62 0.00 1.70 1.58 0.87 1.23 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 0.00 115 R 7.94 4.26 0.00 1.96 2.10 0.00 3.13 0.00 0.00 3.36 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 116 A 8.24 4.58 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 0.00 117 D 8.30 4.66 0.00 2.66 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 0.00 118 R 7.81 3.98 0.00 1.91 1.96 0.00 3.17 0.00 0.00 3.26 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 119 K 8.78 4.06 0.00 1.74 1.99 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.40 7.81 120 R 8.05 4.12 0.00 1.85 1.95 0.00 3.25 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 121 I 7.65 4.14 1.94 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 1.52 0.77 0.91 0.00 0.00 122 D 7.79 4.70 0.00 2.60 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.06 4.16 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.58 0.00 124 D 8.67 4.53 0.00 2.89 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 0.00 125 R 7.67 4.32 0.00 1.77 1.95 0.00 3.30 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 126 A 8.90 4.47 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 0.00 127 A 8.50 4.29 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.00 4.49 0.00 2.09 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 2.38 0.00 129 R 7.51 4.06 0.00 1.87 1.91 0.00 3.13 0.00 0.00 3.34 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 130 A 8.44 4.13 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 A 7.65 4.33 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 0.00 132 K 7.95 3.84 0.00 1.75 1.91 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.45 7.81 133 E 8.04 4.29 0.00 2.06 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 2.39 2.28 0.00 134 E 8.30 4.08 0.00 1.99 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 2.27 2.29 0.00 135 A 8.23 3.71 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 0.00 136 Q 7.28 4.64 0.00 2.11 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.40 6.85 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 137 K 7.86 4.19 0.00 1.77 1.69 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.36 7.81