NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 Q 4.0394 8.3444 119.6860 56.3639 30.0648 172.0020 32 V 2.9627 8.3466 124.7553 62.5290 30.1437 168.1824 33 E 4.7998 8.7611 127.0341 54.4033 32.9012 175.5437 34 G 4.1050 8.2993 109.7252 45.2349 0.0000 174.3449 35 E 4.9972 8.7665 121.0102 56.8331 31.2735 176.3718 36 V 4.8996 7.7773 118.6654 61.1053 33.6559 174.9597 37 Q 4.6426 9.3996 126.8867 54.3350 31.4547 174.9598 38 I 4.3844 8.2691 124.1296 60.3849 37.8127 175.5275 39 V 4.2167 7.8852 120.6222 59.9639 34.0684 175.3918 40 S 4.9538 8.1517 116.4330 57.3666 65.5195 173.3380 41 T 4.7260 8.3601 116.7158 59.6668 71.1923 173.7775 42 A 4.1166 8.5725 123.2235 55.1305 18.4676 178.1742 43 T 3.9634 7.0534 106.0013 62.1256 69.0603 177.0406 44 Q 4.5147 8.0717 119.2612 54.2042 31.6241 174.7543 45 T 5.1767 8.2531 111.1240 60.5102 70.6203 171.8613 46 F 5.4212 8.6229 124.3310 54.8322 41.4027 173.0746 47 L 5.3626 9.1915 116.9875 53.5561 46.2478 175.5750 48 A 5.0032 8.9969 121.1997 51.0607 22.8967 175.2787 49 T 5.0157 9.1700 119.2144 61.9224 71.9508 173.1928 50 C 5.0428 8.9764 124.4991 58.9332 29.1766 173.0581 51 I 4.9701 8.4879 124.3996 59.4616 40.2969 175.6071 52 N 4.1009 9.9270 123.6659 54.5928 36.0106 174.9040 53 G 4.0041 8.6754 103.3976 45.7520 0.0000 172.5543 54 V 4.6480 7.3880 118.3193 59.6598 34.9961 174.2307 55 C 4.5150 8.9564 125.5789 58.7830 32.3332 172.1412 56 W 5.4261 9.1452 126.9878 55.9279 32.0026 175.2616 57 T 5.0753 8.4125 115.9776 61.5834 71.2610 172.6420 58 V 4.4376 8.3895 116.0632 60.6567 32.6383 177.2617 59 Y 3.9819 8.5685 125.2393 60.7639 38.7860 177.3328 60 H 4.4718 8.0096 112.6065 56.7802 28.8795 175.7514 61 G 2.8236 7.4153 108.0509 46.5315 0.0000 174.5632 62 A 4.5095 7.7729 122.5149 52.9459 20.9454 178.2001 63 G 3.1779 7.0514 103.4621 46.5682 0.0000 174.3038 64 T 4.4500 8.2703 113.7216 60.8974 68.7098 174.3532 65 R 4.2206 7.4716 120.9426 57.0975 30.6553 175.5706 66 T 5.0773 8.2042 109.1576 60.1745 71.5061 173.5952 67 I 4.0055 7.4817 115.3023 59.2086 39.9590 174.5858 68 A 4.6105 8.1118 126.1358 51.5702 19.5258 176.9644 69 S 4.5614 8.2272 114.5823 55.9437 66.2294 173.5284 70 P 4.3636 0.0000 0.0000 64.5168 31.1078 177.3190 71 K 4.2420 7.7041 115.9627 55.4131 32.6059 174.8575 72 G 3.8596 7.5374 105.4929 42.5213 0.0000 171.3304 73 P 4.6202 0.0000 0.0000 62.3810 32.1611 176.4757 74 V 4.3415 8.4257 124.3773 60.9176 33.4406 175.2502 75 I 4.2493 8.3995 128.5497 61.1432 37.9182 176.0883 76 Q 4.3444 8.7021 124.0681 56.5893 29.2803 176.4872 77 M 4.0618 8.7542 122.1301 57.4668 32.9751 176.5234 78 Y 4.9098 7.4236 114.2498 56.6627 42.8766 175.3892 79 T 4.7405 8.6778 119.3328 62.8391 71.8906 173.0292 80 N 4.8879 9.2684 127.6691 51.1998 39.6303 175.2488 81 V 2.9540 8.1884 125.7662 63.9932 31.9225 177.9573 82 D 4.3410 7.9352 119.7271 57.0465 40.8220 176.9358 83 Q 4.2401 7.9136 114.6265 55.0556 29.1287 174.7505 84 D 4.3680 7.8100 116.6422 55.4087 39.7554 172.0775 85 L 5.3335 7.9075 118.3650 53.0793 45.1968 175.1226 86 V 4.8833 8.6709 123.7574 61.5086 35.7101 174.1102 87 G 4.0084 8.6487 112.4659 44.6749 0.0000 171.8292 88 W 5.4626 8.5896 123.3836 53.5074 33.6590 173.0655 89 P 4.6274 0.0000 0.0000 62.4149 31.6706 176.0575 90 A 4.1113 8.2179 124.0541 52.1633 18.7763 176.2684 91 P 4.4758 0.0000 0.0000 61.8924 32.8914 175.6663 92 Q 4.1187 8.2625 117.1033 56.9836 29.5144 176.3383 93 G 3.8848 9.0274 108.9211 46.0274 0.0000 172.6834 94 S 5.4544 7.7998 112.1011 56.2291 66.6050 173.1348 95 R 4.7682 8.6100 116.1955 54.8753 32.9278 174.2584 96 S 5.0917 8.6542 116.8904 57.9143 64.0782 173.5950 97 L 4.4853 8.9292 123.6826 54.2367 43.4518 175.7874 98 T 4.5320 8.2779 117.9551 60.3131 68.8670 172.1747 99 P 4.8089 0.0000 0.0000 62.7695 32.2267 175.5723 100 C 4.5026 8.7906 123.2823 59.9388 31.9029 173.3605 101 T 4.6228 8.6207 113.2324 61.2604 68.5458 173.9742 102 C 4.2774 8.1357 117.0479 57.9977 30.5227 174.4250 103 G 3.8270 8.1555 107.7320 46.4597 0.0000 173.7664 104 S 4.3123 7.3621 110.4231 58.1920 62.9894 173.9583 105 S 4.5724 8.4851 119.2972 58.6788 64.4067 173.5231 106 D 4.7761 7.7679 121.2411 53.0648 39.8832 176.0862 107 L 4.6449 8.4841 123.8359 53.5283 44.6833 175.2157 108 Y 5.0690 8.7009 117.8542 56.4582 41.9479 174.2835 109 L 4.7451 9.0225 127.6998 54.1094 43.8767 175.2193 110 V 4.8503 7.9901 126.6512 61.5193 33.2787 175.8186 111 T 4.3821 8.4907 118.9853 60.1239 70.4482 175.5010 112 R 4.0293 8.0412 116.8523 58.4884 29.4978 177.0075 113 H 4.5274 7.8731 113.7604 55.2953 29.2828 174.9190 114 A 3.7298 7.6469 120.9687 52.9608 16.4986 177.7164 115 D 4.7194 7.8312 118.3745 55.0320 42.0474 175.6381 116 V 4.8601 8.2428 121.7357 61.3257 33.5193 174.6147 117 I 4.6100 8.7536 129.1953 58.8545 39.6972 173.2764 118 P 4.5829 0.0000 0.0000 62.3913 32.5634 175.4954 119 V 4.5757 8.6107 124.2577 60.9858 35.1112 173.8296 120 R 4.8225 9.1895 128.2550 54.4528 32.1561 174.9072 121 R 4.5050 8.7553 127.8893 55.8967 30.6214 176.6495 122 R 4.6375 10.1113 128.4007 53.5047 31.0201 176.6852 123 G 3.9103 7.7445 105.5748 45.0507 0.0000 172.3013 124 D 4.4633 8.2624 118.8973 56.8799 41.5243 177.5592 125 S 3.5659 7.5792 111.1809 57.3539 64.9728 173.4702 126 R 5.0428 7.6757 118.1954 55.1193 33.9941 174.5544 127 G 4.7036 9.1144 108.9427 44.9077 0.0000 171.5497 128 S 5.2503 9.3757 117.8563 56.1362 65.8565 173.4088 129 L 4.6585 8.5389 122.6846 54.8070 41.7077 177.3573 130 L 4.2209 8.2872 122.5038 56.5749 42.5257 177.3951 131 S 4.3302 7.8360 113.5338 55.5361 64.9418 171.5622 132 P 4.5186 0.0000 0.0000 62.7664 31.4393 176.1131 133 R 4.6926 8.4538 123.6702 53.2795 33.0482 174.1948 134 P 4.7392 0.0000 0.0000 62.6774 32.5357 177.0414 135 I 3.7522 8.9614 121.9565 64.4622 37.7917 178.2908 136 S 4.2051 8.2441 114.6058 61.8758 62.4276 175.6927 137 Y 4.1880 7.7575 121.8641 60.0002 38.9068 177.3718 138 L 4.6185 8.0757 118.0142 53.8719 42.2516 176.5674 139 K 4.2194 7.4367 119.6976 58.0634 32.1497 177.1952 140 G 4.0678 9.2970 111.8091 46.2621 0.0000 173.9005 141 S 4.8967 8.0805 113.8688 58.0990 63.4135 174.0019 142 S 4.3457 7.9161 118.3439 59.7410 63.0991 175.1378 143 G 4.2416 8.9081 113.3156 46.0851 0.0000 173.6430 144 G 4.1853 7.9043 106.9199 45.1626 0.0000 171.2934 145 P 5.3433 0.0000 0.0000 61.5654 34.2193 174.8673 146 L 4.9120 8.6531 120.4602 53.2320 44.2074 175.9463 147 L 5.1589 8.9888 125.0641 53.5848 44.3573 176.3314 148 C 4.9111 8.4812 116.7983 56.1866 31.9818 172.7494 149 P 4.2532 0.0000 0.0000 64.9467 30.8545 177.4214 150 A 4.1291 7.9455 119.3021 52.3971 19.0219 178.1552 151 G 3.9793 8.3557 104.3908 45.3812 0.0000 173.6354 152 H 4.5812 7.8206 116.7051 54.8335 29.8292 174.2534 153 A 4.3470 8.5174 125.3411 52.4686 18.7119 178.1983 154 V 3.7582 8.8409 123.6839 64.6041 33.6541 175.5959 155 G 4.2240 7.1629 105.1024 46.0751 0.0000 171.7365 156 L 5.3086 8.3923 120.1372 52.3935 44.2873 176.3878 157 F 4.5747 9.3179 127.2243 59.3983 39.7965 174.3521 158 R 4.2403 9.0886 126.7800 57.3861 30.4844 175.6513 159 A 4.5139 7.4223 118.4317 50.3554 23.0313 173.7679 160 A 5.0282 8.4834 121.1252 50.5277 21.3803 177.3624 161 V 3.9863 8.6863 121.8776 62.3626 32.3610 174.6881 162 C 5.1297 8.6695 126.1858 58.0197 30.2408 173.8777 163 T 4.3846 8.1672 113.6133 61.0026 70.2188 174.8195 164 R 3.9667 9.3320 124.1713 56.1422 27.9561 177.1055 165 G 4.0877 8.1964 106.1810 45.1001 0.0000 173.6404 166 V 4.6754 7.6537 114.1289 59.6726 33.1538 174.5384 167 T 5.1837 9.0085 114.9443 59.9169 69.9941 175.2842 168 K 4.4980 8.8879 124.3589 56.8428 34.9291 175.5237 169 A 5.2698 7.8215 119.8082 50.4747 23.4541 174.9565 170 V 5.0461 9.3923 111.3161 59.8080 36.5117 174.5790 171 D 5.4937 9.4295 122.1294 52.5764 43.9962 174.6892 172 F 5.6209 8.4706 119.5634 55.4320 42.0346 173.9510 173 I 4.4643 8.7787 120.5288 58.8182 38.5237 174.3678 174 P 5.0311 0.0000 0.0000 62.3421 32.2422 177.9003 175 V 3.5626 8.4461 113.8701 64.3682 31.3278 178.5275 176 E 4.2854 7.9871 117.6521 58.0773 29.4290 178.4955 177 N 4.4186 8.0426 118.1684 55.8806 38.8684 177.3171 178 L 3.2809 7.3051 119.9985 57.5349 41.6639 179.1832 179 E 4.0690 8.1927 118.6061 59.0046 29.1750 179.2752 180 T 4.1148 7.4134 108.6371 64.6183 69.0941 177.1211 181 T 3.9211 7.3804 117.3756 65.9905 68.4950 175.8892 182 M 4.0318 7.4429 119.9354 57.7803 32.1475 178.4241 183 R 4.0051 7.6024 116.2484 58.0513 30.2622 176.7046 184 S 4.3106 7.5028 117.9119 58.4374 62.4069 173.3887 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 31 Q 8.34 4.04 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.25 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 32 V 8.35 2.96 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 0.72 0.00 0.00 0.93 0.00 0.00 33 E 8.76 4.80 0.00 1.97 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 0.00 2.21 2.26 0.00 34 G 8.30 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 35 E 8.77 5.00 0.00 2.01 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 2.39 2.36 0.00 36 V 7.78 4.90 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 0.85 0.00 0.00 0.96 0.00 0.00 37 Q 9.40 4.64 0.00 2.16 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.59 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 38 I 8.27 4.38 1.82 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 1.32 0.50 0.87 0.00 0.00 39 V 7.89 4.22 1.69 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 0.51 0.00 0.00 -0.06 0.00 0.00 40 S 8.15 4.95 0.00 3.77 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 41 T 8.36 4.73 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 1.50 0.00 0.00 42 A 8.57 4.12 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 43 T 7.05 3.96 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 1.22 0.00 0.00 44 Q 8.07 4.51 0.00 2.34 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.30 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 45 T 8.25 5.18 4.30 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 1.27 0.00 0.00 46 F 8.62 5.42 0.00 3.48 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 47 L 9.19 5.36 0.00 1.89 1.66 0.96 0.94 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 48 A 9.00 5.00 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 49 T 9.17 5.02 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 1.30 0.00 0.00 50 C 8.98 5.04 0.00 3.09 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 51 I 8.49 4.97 2.17 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.70 0.99 0.00 0.00 52 N 9.93 4.10 0.00 3.00 2.94 0.00 0.00 7.13 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 53 G 8.68 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 54 V 7.39 4.65 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 0.77 0.00 0.00 -0.10 0.00 0.00 55 C 8.96 4.52 0.00 3.12 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 56 W 9.15 5.43 0.00 3.32 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 57 T 8.41 5.08 4.51 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 0.00 0.00 1.32 0.00 0.00 58 V 8.39 4.44 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 0.87 0.00 0.00 0.67 0.00 0.00 59 Y 8.57 3.98 0.00 3.04 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 60 H 8.01 4.47 0.00 3.25 3.42 0.00 5.57 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 7.42 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 0.00 0.00 0.00 62 A 7.77 4.51 1.63 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 63 G 7.05 3.18 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 0.00 0.00 0.00 0.00 64 T 8.27 4.45 4.29 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 1.33 0.00 0.00 65 R 7.47 4.22 0.00 2.20 2.09 0.00 3.21 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 66 T 8.20 5.08 4.29 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 1.26 0.00 0.00 67 I 7.48 4.01 1.30 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 0.33 -0.58 0.00 0.00 68 A 8.11 4.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.23 4.56 0.00 4.00 3.80 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 70 P 0.00 4.36 0.00 2.03 2.12 0.00 3.61 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 1.99 2.06 0.00 71 K 7.70 4.24 0.00 1.83 1.80 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.33 7.81 72 G 7.54 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 73 P 0.00 4.62 0.00 1.93 1.96 0.00 3.62 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 2.00 2.04 0.00 74 V 8.43 4.34 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 0.96 0.00 0.00 0.90 0.00 0.00 75 I 8.40 4.25 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.93 0.93 0.00 0.00 76 Q 8.70 4.34 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.05 0.00 0.00 0.00 0.00 0.00 2.43 2.55 0.00 77 M 8.75 4.06 0.00 0.81 1.78 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.17 0.00 78 Y 7.42 4.91 0.00 3.04 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.68 4.74 4.32 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 1.43 0.00 0.00 80 N 9.27 4.89 0.00 2.80 2.68 0.00 0.00 6.67 8.07 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 81 V 8.19 2.95 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.28 0.00 0.00 82 D 7.94 4.34 0.00 2.62 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 83 Q 7.91 4.24 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.94 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 84 D 7.81 4.37 0.00 2.90 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.91 5.33 0.00 1.76 1.50 0.79 0.34 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 86 V 8.67 4.88 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 0.08 0.00 0.00 1.05 0.00 0.00 87 G 8.65 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 88 W 8.59 5.46 0.00 3.22 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 89 P 0.00 4.63 0.00 2.06 2.03 0.00 3.88 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 90 A 8.22 4.11 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 P 0.00 4.48 0.00 2.12 2.00 0.00 3.77 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 92 Q 8.26 4.12 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.41 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 93 G 9.03 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 0.00 0.00 0.00 94 S 7.80 5.45 0.00 3.84 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 95 R 8.61 4.77 0.00 1.88 2.18 0.00 2.76 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 96 S 8.65 5.09 0.00 3.81 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 97 L 8.93 4.49 0.00 1.78 1.60 0.96 0.57 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 98 T 8.28 4.53 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 0.96 0.00 0.00 99 P 0.00 4.81 0.00 2.11 2.03 0.00 3.82 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 1.99 1.97 0.00 100 C 8.79 4.50 0.00 3.10 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 0.00 101 T 8.62 4.62 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 1.23 0.00 0.00 102 C 8.14 4.28 0.00 3.12 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 0.00 103 G 8.16 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 0.00 104 S 7.36 4.31 0.00 3.83 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 0.00 105 S 8.49 4.57 0.00 3.78 3.84 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 0.00 0.00 0.00 106 D 7.77 4.78 0.00 2.44 2.46 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 0.00 107 L 8.48 4.64 0.00 1.37 1.36 0.63 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 0.00 108 Y 8.70 5.07 0.00 2.87 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 0.00 109 L 9.02 4.75 0.00 1.57 1.41 0.09 0.38 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 0.00 110 V 7.99 4.85 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 0.85 0.00 0.00 0.94 0.00 0.00 111 T 8.49 4.38 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 1.01 0.00 0.00 112 R 8.04 4.03 0.00 1.91 2.18 0.00 3.08 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.11 0.00 113 H 7.87 4.53 0.00 3.20 3.31 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.65 3.73 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 0.00 115 D 7.83 4.72 0.00 2.66 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.24 4.86 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.92 0.00 0.00 117 I 8.75 4.61 1.87 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.81 0.93 0.00 0.00 118 P 0.00 4.58 0.00 2.07 1.98 0.00 3.58 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.29 0.00 119 V 8.61 4.58 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 1.07 0.00 0.00 0.84 0.00 0.00 120 R 9.19 4.82 0.00 1.80 1.73 0.00 3.29 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.66 0.00 121 R 8.76 4.50 0.00 1.89 1.87 0.00 3.34 0.00 0.00 3.30 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.89 0.00 122 R 10.11 4.64 0.00 1.81 1.89 0.00 3.48 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 123 G 7.74 3.91 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 0.00 0.00 0.00 124 D 8.26 4.46 0.00 2.57 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 0.00 125 S 7.58 3.57 0.00 3.69 3.66 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 0.00 0.00 0.00 0.00 126 R 7.68 5.04 0.00 1.61 1.78 0.00 3.27 0.00 0.00 3.54 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.48 0.00 127 G 9.11 4.70 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 0.00 0.00 0.00 128 S 9.38 5.25 0.00 3.85 3.98 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 0.00 129 L 8.54 4.66 0.00 1.55 1.62 1.04 1.13 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 0.00 130 L 8.29 4.22 0.00 1.44 1.71 0.87 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 131 S 7.84 4.33 0.00 3.76 3.71 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 0.00 132 P 0.00 4.52 0.00 2.06 2.09 0.00 3.32 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.83 0.00 133 R 8.45 4.69 0.00 1.78 1.76 0.00 3.24 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 1.31 0.00 134 P 0.00 4.74 0.00 2.15 2.18 0.00 3.55 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.94 0.00 135 I 8.96 3.75 2.03 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.40 0.99 0.00 0.00 136 S 8.24 4.21 0.00 4.17 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 0.00 137 Y 7.76 4.19 0.00 2.95 3.22 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 0.00 138 L 8.08 4.62 0.00 2.07 1.99 0.73 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 139 K 7.44 4.22 0.00 2.04 1.84 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.69 1.60 7.81 140 G 9.30 4.07 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 0.00 0.00 0.00 141 S 8.08 4.90 0.00 4.35 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 0.00 142 S 7.92 4.35 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 0.00 143 G 8.91 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 0.00 0.00 0.00 0.00 144 G 7.90 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 0.00 0.00 0.00 145 P 0.00 5.34 0.00 2.15 2.22 0.00 3.69 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 2.04 2.02 0.00 146 L 8.65 4.91 0.00 1.53 1.26 0.88 0.16 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 0.00 147 L 8.99 5.16 0.00 1.66 1.62 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 148 C 8.48 4.91 0.00 3.03 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 0.00 149 P 0.00 4.25 0.00 2.10 2.24 0.00 3.72 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.37 0.00 150 A 7.95 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 G 8.36 3.98 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 0.00 0.00 0.00 152 H 7.82 4.58 0.00 3.20 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 8.52 4.35 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 0.00 154 V 8.84 3.76 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 0.82 0.00 0.00 0.88 0.00 0.00 155 G 7.16 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 0.00 156 L 8.39 5.31 0.00 1.65 1.66 0.86 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 157 F 9.32 4.57 0.00 3.10 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 0.00 158 R 9.09 4.24 0.00 1.88 2.07 0.00 3.28 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 159 A 7.42 4.51 1.12 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 0.00 0.00 160 A 8.48 5.03 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 V 8.69 3.99 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.98 0.00 0.00 162 C 8.67 5.13 0.00 3.00 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 0.00 163 T 8.17 4.38 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 0.00 164 R 9.33 3.97 0.00 2.01 2.14 0.00 3.18 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 165 G 8.20 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 0.00 166 V 7.65 4.68 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 0.89 0.00 0.00 1.00 0.00 0.00 167 T 9.01 5.18 4.32 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 1.30 0.00 0.00 168 K 8.89 4.50 0.00 1.73 1.88 0.00 1.62 0.00 0.00 1.83 0.00 0.00 2.83 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.43 7.81 169 A 7.82 5.27 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 V 9.39 5.05 2.39 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 0.60 0.00 0.00 1.09 0.00 0.00 171 D 9.43 5.49 0.00 2.71 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 F 8.47 5.62 0.00 3.23 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 0.00 173 I 8.78 4.46 1.87 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 1.34 0.78 0.82 0.00 0.00 174 P 0.00 5.03 0.00 2.48 2.50 0.00 3.67 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 2.19 1.95 0.00 175 V 8.45 3.56 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 0.83 0.00 0.00 0.99 0.00 0.00 176 E 7.99 4.29 0.00 2.12 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 2.34 2.19 0.00 177 N 8.04 4.42 0.00 2.89 2.75 0.00 0.00 6.85 6.80 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 0.00 178 L 7.31 3.28 0.00 1.40 0.87 0.41 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 179 E 8.19 4.07 0.00 1.96 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 0.00 2.31 2.39 0.00 180 T 7.41 4.11 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 1.26 0.00 0.00 181 T 7.38 3.92 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 1.25 0.00 0.00 182 M 7.44 4.03 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.28 0.00 183 R 7.60 4.01 0.00 1.89 2.00 0.00 3.15 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 184 S 7.50 4.31 0.00 3.99 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