NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 R 4.2133 8.2549 117.2809 55.9337 30.6327 174.8558 7 T 3.8638 8.4875 119.8702 62.1719 68.2227 171.7361 8 P 4.3800 0.0000 0.0000 63.5415 32.5388 178.1209 9 S 5.8789 8.5544 122.8625 59.5158 60.7833 176.5488 10 D 4.8247 8.0830 118.5833 54.0670 39.5475 175.5535 11 K 4.1924 7.7962 118.8229 55.0085 32.8359 174.9423 12 P 4.7237 0.0000 0.0000 63.2437 32.4313 175.5450 13 V 5.0439 8.3584 120.8700 61.0514 35.4446 172.8239 14 A 4.6664 8.6262 120.1180 51.5925 23.2856 175.3109 15 H 4.8381 9.2181 122.0420 54.8001 32.2979 172.4372 16 V 4.8825 8.7236 119.5638 59.6501 34.3010 175.4444 17 V 5.3931 8.7395 121.6054 59.6496 35.1250 174.6459 18 A 4.4639 8.6490 123.3305 51.9374 18.7972 176.8988 19 N 4.4123 8.8920 121.5458 52.4631 39.3263 174.3704 20 P 2.9700 0.0000 0.0000 64.2385 31.7485 177.0076 21 Q 4.0673 7.7061 116.8590 56.3416 29.6092 175.4903 22 A 4.7429 7.1207 118.6490 50.3616 18.6799 175.9437 23 E 4.2971 7.9183 119.6557 57.5212 30.3290 179.0346 24 G 3.9672 9.2281 108.2677 45.7059 0.0000 172.7074 25 Q 4.4657 7.7131 115.5912 54.4687 31.8061 174.7292 26 L 4.2486 8.1316 119.9451 52.9865 41.9815 173.6387 27 Q 4.5901 7.8905 125.8650 53.6522 31.3621 173.8894 28 W 5.3712 8.9986 126.9533 56.2010 30.3444 175.7793 29 L 5.1765 9.5542 123.4543 53.1020 45.5359 176.7609 30 N 5.0309 8.9288 115.7699 52.5314 38.7442 174.4893 31 R 4.3881 7.7978 116.0923 56.6178 29.7641 175.1087 32 R 4.6710 7.3196 114.9515 55.1602 34.5188 175.5300 33 A 3.1674 7.5542 115.7302 54.3889 19.5861 178.2320 34 N 4.8382 8.3419 115.6856 51.2748 38.8110 173.2228 35 A 5.1033 7.4548 119.4031 50.3294 23.0817 176.8277 36 L 4.6370 8.7590 117.6775 53.8774 46.6422 175.9615 37 L 4.5302 8.1208 119.6902 54.5630 43.4936 172.7917 38 A 4.6983 8.6792 125.8089 49.1292 23.9353 174.9270 39 N 4.4045 9.9712 112.8354 55.0229 36.2259 174.9663 40 G 4.2285 8.6112 107.2437 45.8347 0.0000 175.6583 41 V 4.3062 7.5080 118.1616 61.2001 32.1999 175.7795 42 E 4.7250 8.7446 121.9339 54.5052 33.4342 174.8292 43 L 4.9860 8.4992 124.3263 53.5889 43.2641 175.2392 44 R 4.5525 8.8886 127.1836 55.6211 32.4328 175.2020 45 D 4.4820 9.7601 124.1570 55.5040 38.5642 173.1889 46 N 4.5506 8.6461 111.9789 54.5631 37.4163 173.0514 47 Q 4.9584 8.1345 113.7732 53.5527 33.4757 174.3649 48 L 4.7382 8.5867 122.1398 54.1059 43.6453 175.9330 49 V 4.7245 8.5931 123.4080 60.7705 34.1144 174.8474 50 V 3.9594 8.3516 129.2897 62.4445 32.0640 174.7507 51 P 4.6225 0.0000 0.0000 63.2955 32.1287 175.4176 52 S 4.6499 7.3637 112.2166 57.1362 65.9292 174.5696 53 E 4.2780 8.8090 121.2083 56.2664 29.9536 176.9979 54 G 4.6028 7.6293 110.2923 44.6311 0.0000 171.1465 55 L 5.0498 7.6864 119.7814 54.0507 43.1989 175.9238 56 Y 5.2165 9.4348 121.0749 56.0921 42.5124 174.1027 57 L 5.0502 9.0506 125.5669 54.1229 43.8553 175.1741 58 I 5.2286 9.0084 127.5461 59.9102 40.3887 174.2469 59 Y 5.2803 8.2665 122.6833 56.6125 41.8459 173.2504 60 S 4.9333 8.4190 112.5040 57.7666 66.7250 173.7207 61 Q 5.3762 8.4619 125.7309 53.6799 32.5674 173.9991 62 V 4.6153 8.2564 117.7874 59.2583 36.2951 174.1285 63 L 4.8000 8.0009 124.3164 53.4547 44.7078 175.0837 64 F 5.2806 9.2257 125.8336 56.3900 41.1935 175.0488 65 K 4.1790 8.9395 123.0803 54.6566 35.3664 175.6118 66 G 3.3970 6.3506 112.5299 44.2450 0.0000 171.3234 67 Q 4.3831 8.6614 122.4477 55.6253 29.6904 177.4701 68 G 3.9650 8.3040 114.0828 45.8691 0.0000 171.0863 69 C 5.2144 8.4591 114.3245 54.4906 43.2926 174.1724 70 P 4.4722 0.0000 0.0000 62.7256 31.4110 174.8890 71 S 4.5748 8.2604 117.6377 58.2849 66.1067 178.1578 72 T 3.1240 8.9330 117.6952 64.0997 68.4377 173.7135 73 H 4.8241 9.0026 124.0628 55.2560 33.7057 171.2726 74 V 4.3314 7.8933 125.2098 60.8290 33.6066 174.2902 75 L 4.6599 8.3055 126.1628 52.8325 44.1549 175.5247 76 L 4.6916 8.5537 123.5314 52.9537 44.3853 175.5921 77 T 5.1882 9.6598 113.9013 60.1028 72.3505 172.3279 78 H 5.5282 8.9821 123.3257 54.9301 33.5046 171.9589 79 T 4.9346 8.8067 118.3955 61.0686 71.4729 171.9119 80 I 4.8020 8.8054 129.6603 59.9650 39.2404 174.9823 81 S 5.1690 8.9178 123.3603 56.6746 66.3577 173.0056 82 R 4.9427 8.7714 122.5880 54.4572 33.1021 174.4620 83 I 4.9870 8.8210 119.3939 57.8938 39.5025 174.9841 84 A 4.7117 8.4295 130.8002 51.7110 19.1559 178.5319 85 V 3.6132 8.6159 120.7472 65.7916 31.6846 177.3743 86 S 4.6571 7.8114 113.5197 58.4396 63.0450 174.3674 87 Y 4.9119 7.4936 117.8178 56.8301 40.8548 173.8020 88 Q 4.2737 7.7895 124.6099 55.4815 27.5794 176.1602 89 T 4.5012 6.9999 114.6510 61.6391 73.7530 173.9245 90 K 4.4030 8.6805 125.6427 56.8935 32.7868 176.7207 91 V 4.5175 8.5606 118.0524 59.2914 35.3025 174.8766 92 N 4.5811 8.9209 123.0755 53.6921 38.5419 174.5911 93 L 4.4213 8.7664 123.8613 55.9666 43.3801 177.2257 94 L 4.9319 7.3826 116.9520 53.2489 46.0645 175.5454 95 S 5.1212 8.5107 114.8263 57.5774 65.3915 173.2793 96 A 4.8899 9.0098 126.3702 50.6773 22.9635 174.9740 97 I 5.1131 8.2550 118.7103 59.5742 41.2886 175.1044 98 K 4.5742 9.1366 126.0648 54.9962 36.0172 175.1563 99 S 4.4401 8.5197 122.5749 56.0483 62.8380 172.0054 100 P 3.6010 0.0000 0.0000 65.1919 31.4060 177.3654 101 C 4.3519 6.9083 124.2554 55.4467 38.8049 174.4500 102 Q 4.1494 8.5060 128.7731 56.1159 28.0424 178.1741 103 R 4.4023 8.1700 115.5023 56.4325 29.5257 175.9320 104 E 3.9009 7.7876 114.0587 59.8758 29.2805 176.6890 105 T 3.0977 8.0713 108.6845 60.5820 68.6164 169.0516 106 P 4.1311 0.0000 0.0000 62.5006 31.3834 175.2216 107 E 4.0065 9.0190 125.2048 57.8440 29.4020 178.1117 108 G 4.4713 7.1378 116.2079 45.9097 0.0000 171.9780 109 A 4.5875 7.2201 123.6095 52.4746 22.3385 174.3856 110 E 4.1418 8.4721 120.8486 54.3899 25.8813 177.0205 111 A 3.6264 8.7105 125.5405 53.1323 14.7441 178.0188 112 K 4.4816 7.8792 121.4950 55.2243 34.0727 174.2676 113 P 5.0784 0.0000 0.0000 62.2076 32.8389 175.4364 114 W 5.3025 8.4318 117.6522 54.9944 31.5527 173.6155 115 Y 5.3036 9.1078 118.8373 56.4259 40.8223 175.0202 116 E 4.7776 9.8146 124.8982 54.5344 32.6084 172.3422 117 P 5.4103 0.0000 0.0000 61.9691 34.0055 175.2534 118 I 4.7957 8.5692 120.9963 60.1153 41.3647 173.5124 119 Y 5.1823 8.9279 127.7038 55.8785 41.3413 174.6252 120 L 4.8363 7.6418 124.3315 53.0472 46.1998 175.7381 121 G 4.8452 8.3611 106.1904 45.8534 0.0000 172.4875 122 G 4.2253 8.1697 108.8267 45.8835 0.0000 171.7210 123 V 5.0237 8.1034 119.8098 61.2899 33.1989 174.9000 124 F 4.9392 9.3452 125.1661 55.7912 43.9016 173.3256 125 Q 4.8774 8.9072 123.1285 55.6836 29.7748 174.8743 126 L 5.0813 9.3986 126.3218 53.0730 45.9450 175.5288 127 E 5.6587 9.7649 121.4504 53.8767 32.0564 175.8117 128 K 4.1538 8.7242 123.8624 58.0527 32.5560 177.0600 129 G 4.0577 8.9858 115.3128 45.0739 0.0000 173.5594 130 D 4.6637 8.0935 120.0916 54.6111 42.3170 175.4876 131 R 5.0555 8.6776 120.5749 54.4695 32.9927 174.8377 132 L 5.1845 8.9568 124.1961 53.0979 44.5216 175.6714 133 S 5.0116 9.0292 118.5658 56.6352 66.6450 173.1698 134 A 4.5668 8.4258 124.9182 50.1347 20.1128 174.8266 135 E 4.9664 8.9811 120.2400 55.2787 33.6456 175.1780 136 I 5.6291 8.3849 113.3820 58.4139 40.5813 174.6568 137 N 4.6079 8.3680 121.1576 53.3621 38.5179 175.8654 138 R 4.6983 7.6170 118.1735 53.5220 30.2333 174.3606 139 P 4.3111 0.0000 0.0000 64.8293 31.8334 178.6671 140 D 4.3535 7.9096 117.4258 55.2439 39.8773 176.1147 141 Y 4.7792 8.1621 117.5475 57.5770 39.4770 174.9274 142 L 3.9052 7.4859 122.9700 55.1790 42.5342 176.5676 143 L 4.2949 8.6134 130.9800 52.9120 42.0267 176.2217 144 F 5.0421 7.8366 125.0605 56.2078 38.6260 177.3371 145 A 4.2279 8.4056 125.8426 56.2446 18.3104 178.8244 146 E 3.9991 7.8316 116.1478 56.0516 29.2642 176.9667 147 S 4.6017 7.0994 123.9725 58.7048 66.4548 177.1687 148 G 4.2098 8.9565 111.8307 46.2504 0.0000 174.4556 149 Q 4.4451 8.3163 119.8805 56.4002 30.0687 176.2997 150 V 4.8174 7.8998 117.6165 61.4050 34.5898 173.7438 151 Y 5.6856 8.7087 125.2347 56.2356 42.3823 173.6486 152 F 5.0573 8.9202 121.6344 57.0730 43.1162 173.2405 153 G 3.9548 8.2798 112.3370 45.4458 0.0000 171.3952 154 I 5.7347 8.4125 112.4465 59.6995 41.3800 173.7643 155 I 4.9471 8.3839 122.9003 59.3079 41.7232 173.5547 156 A 3.8251 8.5418 131.5951 51.2522 18.8939 177.3945 157 L 4.1924 8.1255 122.1816 55.0724 41.4727 177.0449 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 6 R 8.25 4.21 0.00 1.93 2.02 0.00 3.16 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 7 T 8.49 3.86 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 1.24 0.00 0.00 8 P 0.00 4.38 0.00 2.03 2.14 0.00 3.84 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 9 S 8.55 5.88 0.00 4.08 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 10 D 8.08 4.82 0.00 2.71 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 11 K 7.80 4.19 0.00 1.79 1.69 0.00 1.74 0.00 0.00 1.87 0.00 0.00 2.97 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.43 1.35 7.81 12 P 0.00 4.72 0.00 2.27 2.39 0.00 3.66 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 2.06 2.04 0.00 13 V 8.36 5.04 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 0.71 0.00 0.00 1.00 0.00 0.00 14 A 8.63 4.67 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 15 H 9.22 4.84 0.00 3.26 3.19 0.00 5.77 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.72 4.88 2.33 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 0.58 0.00 0.00 0.60 0.00 0.00 17 V 8.74 5.39 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 1.04 0.00 0.00 1.19 0.00 0.00 18 A 8.65 4.46 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 19 N 8.89 4.41 0.00 2.73 2.57 0.00 0.00 7.08 8.06 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 20 P 0.00 2.97 0.00 1.82 1.86 0.00 3.52 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.84 0.00 21 Q 7.71 4.07 0.00 1.89 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.39 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 22 A 7.12 4.74 1.23 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 0.00 0.00 0.00 23 E 7.92 4.30 0.00 2.15 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 2.30 2.36 0.00 24 G 9.23 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 0.00 0.00 0.00 25 Q 7.71 4.47 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.88 0.00 0.00 0.00 0.00 0.00 2.51 2.29 0.00 26 L 8.13 4.25 0.00 1.34 1.37 0.06 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 7.89 4.59 0.00 2.06 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 28 W 9.00 5.37 0.00 3.29 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 29 L 9.55 5.18 0.00 1.60 1.54 1.07 0.44 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 30 N 8.93 5.03 0.00 2.77 2.89 0.00 0.00 6.07 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 31 R 7.80 4.39 0.00 1.95 2.06 0.00 2.98 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 1.58 1.65 0.00 32 R 7.32 4.67 0.00 1.81 1.88 0.00 3.42 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 33 A 7.55 3.17 1.23 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 0.00 0.00 0.00 34 N 8.34 4.84 0.00 2.71 2.77 0.00 0.00 6.61 7.35 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 35 A 7.45 5.10 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 36 L 8.76 4.64 0.00 1.65 1.51 0.94 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.12 4.53 0.00 1.56 1.61 0.91 0.99 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 38 A 8.68 4.70 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 9.97 4.40 0.00 2.96 2.98 0.00 0.00 7.11 7.65 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 40 G 8.61 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 0.00 0.00 0.00 0.00 41 V 7.51 4.31 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 1.22 0.00 0.00 0.84 0.00 0.00 42 E 8.74 4.73 0.00 1.89 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 2.27 2.41 0.00 43 L 8.50 4.99 0.00 1.60 1.60 1.07 0.99 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 44 R 8.89 4.55 0.00 1.81 1.72 0.00 3.29 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 45 D 9.76 4.48 0.00 2.84 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 46 N 8.65 4.55 0.00 2.91 3.02 0.00 0.00 6.99 7.08 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 47 Q 8.13 4.96 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.94 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.58 0.00 48 L 8.59 4.74 0.00 1.38 1.32 -0.43 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.59 4.72 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 0.96 0.00 0.00 0.91 0.00 0.00 50 V 8.35 3.96 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 0.77 0.00 0.00 0.29 0.00 0.00 51 P 0.00 4.62 0.00 2.25 2.26 0.00 3.95 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.06 0.00 52 S 7.36 4.65 0.00 4.09 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.81 4.28 0.00 2.07 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 2.44 2.30 0.00 54 G 7.63 4.60 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 0.00 0.00 0.00 55 L 7.69 5.05 0.00 1.64 1.58 0.96 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 9.43 5.22 0.00 2.91 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 57 L 9.05 5.05 0.00 1.86 1.68 1.16 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 58 I 9.01 5.23 2.05 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.86 0.96 0.00 0.00 59 Y 8.27 5.28 0.00 3.07 3.13 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 0.00 0.00 0.00 0.00 60 S 8.42 4.93 0.00 3.74 3.49 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 61 Q 8.46 5.38 0.00 1.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.49 0.00 0.00 0.00 0.00 0.00 2.20 2.44 0.00 62 V 8.26 4.62 1.46 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 0.29 0.00 0.00 0.47 0.00 0.00 63 L 8.00 4.80 0.00 1.88 1.62 1.07 1.12 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 64 F 9.23 5.28 0.00 3.44 3.07 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 0.00 0.00 0.00 0.00 65 K 8.94 4.18 0.00 1.15 1.22 0.00 1.32 0.00 0.00 1.41 0.00 0.00 2.68 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.67 0.21 7.81 66 G 6.35 3.40 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 0.00 67 Q 8.66 4.38 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.99 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 68 G 8.30 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 0.00 0.00 0.00 69 C 8.46 5.21 0.00 2.97 2.98 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 0.00 0.00 0.00 70 P 0.00 4.47 0.00 2.11 2.05 0.00 3.68 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 2.23 2.32 0.00 71 S 8.26 4.57 0.00 3.83 3.79 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 0.00 0.00 0.00 0.00 72 T 8.93 3.12 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 1.22 0.00 0.00 73 H 9.00 4.82 0.00 2.96 3.09 0.00 5.87 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 7.89 4.33 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 0.90 0.00 0.00 0.95 0.00 0.00 75 L 8.31 4.66 0.00 1.48 1.46 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.55 4.69 0.00 1.25 0.43 0.45 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 77 T 9.66 5.19 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 78 H 8.98 5.53 0.00 3.36 3.20 0.00 5.63 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 79 T 8.81 4.93 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 1.22 0.00 0.00 80 I 8.81 4.80 1.71 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 0.86 0.39 0.79 0.00 0.00 81 S 8.92 5.17 0.00 3.68 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 82 R 8.77 4.94 0.00 1.70 1.64 0.00 3.16 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 83 I 8.82 4.99 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.98 0.91 0.00 0.00 84 A 8.43 4.71 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 85 V 8.62 3.61 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 0.80 0.00 0.00 1.07 0.00 0.00 86 S 7.81 4.66 0.00 3.92 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 87 Y 7.49 4.91 0.00 2.85 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 88 Q 7.79 4.27 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.41 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 89 T 7.00 4.50 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 1.09 0.00 0.00 90 K 8.68 4.40 0.00 1.60 1.74 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.44 7.81 91 V 8.56 4.52 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 0.94 0.00 0.00 1.02 0.00 0.00 92 N 8.92 4.58 0.00 2.60 2.74 0.00 0.00 7.02 7.85 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 93 L 8.77 4.42 0.00 1.15 0.60 0.12 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 94 L 7.38 4.93 0.00 1.48 1.51 1.03 1.09 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 95 S 8.51 5.12 0.00 3.83 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 96 A 9.01 4.89 1.26 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 0.00 0.00 97 I 8.25 5.11 1.87 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 1.23 0.72 0.93 0.00 0.00 98 K 9.14 4.57 0.00 1.77 1.50 0.00 1.67 0.00 0.00 1.79 0.00 0.00 3.17 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.28 1.37 7.81 99 S 8.52 4.44 0.00 3.80 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 0.00 100 P 0.00 3.60 0.00 0.49 0.74 0.00 3.57 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.11 0.00 101 C 6.91 4.35 0.00 2.71 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 0.00 102 Q 8.51 4.15 0.00 2.29 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 5.76 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 103 R 8.17 4.40 0.00 1.99 2.05 0.00 3.19 0.00 0.00 2.25 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.61 0.00 104 E 7.79 3.90 0.00 2.15 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 0.00 2.26 2.39 0.00 105 T 8.07 3.10 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 1.37 0.00 0.00 106 P 0.00 4.13 0.00 2.08 2.14 0.00 3.79 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 107 E 9.02 4.01 0.00 1.93 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 2.31 2.30 0.00 108 G 7.14 4.47 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 0.00 0.00 0.00 109 A 7.22 4.59 1.23 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 0.00 0.00 0.00 110 E 8.47 4.14 0.00 2.04 1.51 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 0.00 2.17 2.19 0.00 111 A 8.71 3.63 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 0.00 0.00 112 K 7.88 4.48 0.00 1.84 1.84 0.00 1.58 0.00 0.00 1.91 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.58 1.54 7.81 113 P 0.00 5.08 0.00 1.90 2.14 0.00 3.77 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 2.12 2.03 0.00 114 W 8.43 5.30 0.00 3.36 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 0.00 115 Y 9.11 5.30 0.00 2.84 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 0.00 116 E 9.81 4.78 0.00 2.37 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 2.18 2.39 0.00 117 P 0.00 5.41 0.00 2.23 2.14 0.00 3.91 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 118 I 8.57 4.80 2.04 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.45 1.07 0.00 0.00 119 Y 8.93 5.18 0.00 3.02 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 0.00 120 L 7.64 4.84 0.00 1.54 1.32 0.94 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.36 4.85 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 0.00 0.00 0.00 122 G 8.17 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 0.00 0.00 0.00 0.00 123 V 8.10 5.02 1.96 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 0.83 0.00 0.00 0.94 0.00 0.00 124 F 9.35 4.94 0.00 3.07 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 0.00 125 Q 8.91 4.88 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 126 L 9.40 5.08 0.00 1.60 1.36 0.97 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 127 E 9.76 5.66 0.00 2.18 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 2.29 2.11 0.00 128 K 8.72 4.15 0.00 1.74 1.75 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.52 7.81 129 G 8.99 4.06 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 0.00 130 D 8.09 4.66 0.00 2.53 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 0.00 131 R 8.68 5.06 0.00 1.73 1.80 0.00 3.07 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 132 L 8.96 5.18 0.00 1.60 1.67 0.75 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 133 S 9.03 5.01 0.00 3.68 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 0.00 134 A 8.43 4.57 -0.14 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 0.00 135 E 8.98 4.97 0.00 1.92 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 2.23 2.22 0.00 136 I 8.38 5.63 2.19 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.86 0.92 0.00 0.00 137 N 8.37 4.61 0.00 2.80 3.00 0.00 0.00 6.73 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 R 7.62 4.70 0.00 1.98 2.11 0.00 3.33 0.00 0.00 3.43 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 139 P 0.00 4.31 0.00 2.37 2.28 0.00 3.80 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.94 0.00 140 D 7.91 4.35 0.00 2.47 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 0.00 141 Y 8.16 4.78 0.00 3.34 3.02 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 0.00 142 L 7.49 3.91 0.00 1.57 0.82 0.72 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 143 L 8.61 4.29 0.00 1.47 1.67 1.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 144 F 7.84 5.04 0.00 3.01 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 0.00 145 A 8.41 4.23 1.39 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 0.00 146 E 7.83 4.00 0.00 2.05 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 2.37 2.44 0.00 147 S 7.10 4.60 0.00 3.89 3.73 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 0.00 0.00 0.00 0.00 148 G 8.96 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Q 8.32 4.45 0.00 2.18 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.42 2.68 0.00 150 V 7.90 4.82 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 1.14 0.00 0.00 0.93 0.00 0.00 151 Y 8.71 5.69 0.00 3.04 3.13 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 0.00 0.00 0.00 0.00 152 F 8.92 5.06 0.00 1.55 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 0.00 153 G 8.28 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 I 8.41 5.73 1.93 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.95 0.60 0.00 0.00 155 I 8.38 4.95 1.98 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 1.31 1.59 1.04 0.00 0.00 156 A 8.54 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 8.13 4.19 0.00 1.51 1.55 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00