NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.1007 8.3149 120.1140 55.3236 33.5837 176.0927 5 P 3.8238 0.0000 0.0000 60.7908 33.0527 175.7499 6 I 3.5425 7.3708 118.4991 64.0295 38.2146 177.4368 7 W 4.0555 7.8847 117.1714 59.5963 27.8946 177.7323 8 E 3.9464 7.3934 119.6331 59.0187 29.2371 178.7098 9 Q 3.9144 7.7414 117.7277 58.8814 28.7576 178.7439 10 I 3.6731 7.8043 121.0483 64.0003 37.0799 178.4776 11 G 3.3535 7.9487 106.7511 47.9860 0.0000 175.6626 12 S 4.4530 7.7065 119.5951 60.5522 62.8639 177.1191 13 S 4.0831 7.8926 117.2037 61.5320 62.6123 176.1728 14 F 3.8999 8.1993 123.2324 61.5399 39.0348 176.9448 15 I 3.5546 8.4022 119.2479 64.5393 37.0198 177.8680 16 Q 4.0384 8.5523 120.3283 59.7506 28.8741 178.1409 17 H 3.9936 8.5101 119.3194 59.2452 29.8396 176.4136 18 Y 3.5182 7.8312 121.4318 60.9688 38.4713 177.9397 19 Y 4.2860 7.9789 119.8170 61.3151 37.9630 179.1034 20 Q 4.0023 8.2200 121.9774 60.0462 28.1850 181.6691 21 L 3.9481 7.6542 122.6852 57.8960 41.8623 178.5868 22 F 3.5819 8.0160 119.1945 61.5949 39.3374 176.6225 23 D 4.6383 8.5171 116.2786 56.1629 40.7442 177.4171 24 N 4.9649 7.6917 115.8202 53.8106 40.7521 174.7046 25 D 4.3761 7.9785 119.4151 53.7686 42.5420 175.2879 26 R 3.8915 8.0369 119.5692 56.4804 29.8212 177.8918 27 T 4.0719 7.3455 108.1657 63.0495 69.2243 175.1623 28 Q 4.5045 7.7340 120.9603 55.9242 28.6482 175.7914 29 L 4.4294 7.7141 118.8110 54.8789 42.8143 178.3204 30 G 3.5237 8.1004 107.3612 49.2934 0.0000 175.7139 31 A 4.0103 8.1525 122.1742 54.8929 18.6899 178.5922 32 I 3.9571 7.5293 108.8154 62.8431 38.1304 175.4723 33 Y 5.2583 7.9850 118.5208 56.2653 40.3393 175.4046 34 I 4.8126 8.6150 116.4378 59.8909 39.9248 175.3989 35 D 4.5163 8.7059 117.5764 56.1103 41.2147 177.0311 36 A 4.3696 7.9049 120.0713 52.7090 19.5663 177.5648 37 S 4.6389 8.0898 112.9315 59.4022 64.1464 173.0352 38 C 5.2096 9.1390 121.9250 57.9275 30.6999 172.4521 39 L 5.2483 9.0563 125.7624 53.5909 44.7755 175.0856 40 T 5.1317 9.2190 123.1944 61.9373 71.0412 173.1317 41 W 4.7940 9.4325 135.0000 55.3564 31.5782 175.4929 42 E 3.8606 9.3830 130.3494 57.2712 26.6947 176.0613 43 G 4.1819 8.0564 106.4700 46.0509 0.0000 172.9310 44 Q 4.2657 7.9658 119.4063 55.4678 29.3930 174.6252 45 Q 5.1665 8.4360 122.1482 54.8562 30.2791 175.1600 46 F 4.7959 9.6287 122.1850 55.6614 42.9409 173.9774 47 Q 4.8834 8.8776 121.2829 55.2620 31.5394 176.0614 48 G 4.0883 9.5323 110.3965 45.7991 0.0000 173.8118 49 K 3.9962 8.3830 120.5124 59.6260 33.1685 178.4555 50 A 3.9766 8.0859 119.8054 55.0325 18.4938 179.3675 51 A 3.9932 7.9421 118.8550 55.3168 18.5962 179.6828 52 I 3.3568 7.7028 118.3544 64.4861 37.1049 178.9065 53 V 3.4714 7.8628 119.1022 65.6372 31.4062 177.4030 54 E 3.7476 8.0137 119.1519 59.2178 28.9691 178.6601 55 K 3.4403 7.5215 119.0944 59.4938 31.8983 178.5785 56 L 3.4150 7.0381 117.5821 57.8780 41.5349 179.5927 57 S 4.0414 8.0179 114.6973 61.0496 62.8053 176.4459 58 S 4.1714 7.5684 116.0287 59.3343 63.0043 174.6702 59 L 3.5412 6.4378 121.6416 54.8096 41.7314 176.5176 60 P 4.4851 0.0000 0.0000 60.8641 30.0076 174.8617 61 F 5.2638 6.9399 117.4156 55.7873 41.2440 175.3799 62 Q 4.4318 9.3846 121.6769 57.1192 29.6274 176.2231 63 K 4.8417 7.9251 115.3312 55.5497 36.2229 175.1638 64 I 4.9427 7.9862 120.0334 60.2436 41.4818 173.5104 65 Q 4.7392 8.3601 127.4512 54.9553 32.3367 173.0946 66 H 5.4374 9.5379 123.5551 54.0135 31.9457 173.7818 67 S 4.7617 9.1009 115.1273 56.7364 66.3637 172.9972 68 I 4.3599 8.4054 123.1792 61.3817 37.8332 175.5264 69 T 4.3947 8.9521 123.0437 65.2531 70.0930 174.7195 70 A 4.8903 7.5473 121.2841 50.4292 22.7413 175.1491 71 Q 4.7571 8.6096 117.9611 54.8569 31.8890 173.3411 72 D 5.1640 9.0814 125.0712 52.6694 43.2056 175.2561 73 H 5.5715 8.8261 120.1803 54.2210 31.5097 173.3872 74 Q 4.4744 9.2369 121.3341 53.3444 33.4950 172.3245 75 P 4.8339 0.0000 0.0000 62.3968 32.7230 175.7426 76 T 4.4019 8.8240 113.6993 59.6361 70.9526 174.0544 77 P 4.2797 0.0000 0.0000 65.1845 31.4571 177.2091 78 D 4.7349 8.0596 116.4568 53.9419 40.7576 176.1080 79 S 3.8688 7.8764 113.4531 60.2227 60.5839 170.8844 80 C 5.0976 8.2224 116.6293 58.4438 31.3681 173.2841 81 I 4.6590 8.4063 121.6792 59.7936 39.0405 174.6047 82 I 4.6262 8.8934 128.7723 59.7176 39.5487 174.2157 83 S 5.4624 9.3374 126.5212 57.0275 65.6989 172.9843 84 M 5.1199 9.3097 123.9478 53.7742 35.2835 173.9205 85 V 4.9605 8.9968 126.7113 61.0420 34.3643 174.4883 86 V 4.4639 8.2707 127.3114 59.9970 33.9796 174.3984 87 G 4.0384 7.5005 111.5423 46.1060 0.0000 171.9473 88 Q 5.5229 8.8263 120.5802 54.4990 34.1199 174.3297 89 L 4.9691 8.9707 120.9513 54.8319 44.9289 174.9956 90 K 4.5483 8.4009 119.0480 55.9067 35.1378 174.4124 91 A 4.5159 8.6239 129.9870 50.6486 20.9392 176.6803 92 D 4.0756 8.7722 121.5869 56.0253 41.1434 175.2327 93 E 4.5735 8.8243 124.8136 57.1344 29.6228 175.4073 94 D 4.6854 7.9371 119.0266 52.8538 41.6996 174.7494 95 P 4.4379 0.0000 0.0000 62.5163 31.9225 176.6209 96 I 4.1949 8.1131 121.6361 61.9658 37.7168 175.4650 97 M 4.8792 8.9084 125.1131 53.1809 36.3456 175.5391 98 G 4.2453 8.6201 108.8042 46.6867 0.0000 171.9115 99 F 5.4598 8.6068 114.6782 55.9979 42.1268 172.6845 100 H 5.2442 9.1855 114.4501 54.0695 32.0676 172.1778 101 Q 5.1396 9.0888 122.5844 54.6185 32.5592 173.1704 102 M 5.0457 8.6941 123.9569 53.5235 34.1853 174.8077 103 F 5.3200 9.3766 119.9904 55.6065 43.4013 173.5865 104 L 5.0524 9.0424 125.2123 53.5016 44.0940 174.7937 105 L 5.1351 9.2799 127.4672 53.0898 43.9687 175.5414 106 K 4.9222 9.2074 124.7450 54.6841 35.5231 174.9593 107 N 3.9591 8.5014 126.1319 52.4492 38.2412 171.9757 108 I 4.2506 7.9861 123.9387 61.1820 37.9027 175.3812 109 N 4.3882 8.5617 122.4513 53.4899 35.1786 174.2146 110 D 4.3335 8.5069 113.5831 54.2677 38.1175 174.1497 111 A 4.4681 7.2858 120.8279 50.2949 22.0965 176.5820 112 W 4.4139 8.9964 123.1583 57.5056 29.7907 176.4619 113 V 4.5893 8.9120 117.7865 59.4860 35.1598 174.3225 114 C 4.7908 9.0513 124.9835 59.3825 31.5177 173.2192 115 T 4.4675 8.9118 117.3347 63.3658 70.4807 174.6671 116 N 5.5658 8.1635 118.8948 51.1212 42.5039 173.1403 117 D 5.2352 9.4465 122.7865 52.8614 45.2131 173.9774 118 M 5.3065 8.7602 124.3407 53.6961 36.2139 173.9525 119 F 5.2562 9.2292 125.5942 56.4984 43.2020 173.6768 120 R 4.3025 7.4835 123.5342 54.4925 33.6330 174.4241 121 L 4.3097 8.4715 126.1748 53.9488 42.4898 176.9826 122 A 4.2231 8.2467 123.8105 51.3994 16.9649 178.3740 123 L 4.3211 7.4128 120.9558 53.5691 43.2966 176.8680 124 H 4.7830 8.3060 120.9585 54.0739 31.5184 174.3654 125 N 4.2047 8.5156 116.5133 55.4302 38.6644 175.9853 126 F 4.9116 7.4141 114.2822 55.3614 42.2446 175.3684 127 G 3.7799 8.7833 111.7277 45.8827 0.0000 173.5551 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 4 K 8.31 4.10 0.00 1.66 1.70 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 1.41 7.81 5 P 0.00 3.82 0.00 0.49 0.49 0.00 3.34 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.78 0.00 6 I 7.37 3.54 1.83 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 1.77 1.23 1.07 0.00 0.00 7 W 7.88 4.06 0.00 3.46 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 E 7.39 3.95 0.00 1.77 1.82 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 2.44 2.49 0.00 9 Q 7.74 3.91 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 10 I 7.80 3.67 1.31 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.47 -0.27 0.00 0.00 11 G 7.95 3.35 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 0.00 12 S 7.71 4.45 0.00 3.92 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 7.89 4.08 0.00 3.90 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 14 F 8.20 3.90 0.00 3.04 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.40 3.55 2.21 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.37 1.22 0.00 0.00 16 Q 8.55 4.04 0.00 2.10 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 17 H 8.51 3.99 0.00 3.17 3.22 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 7.83 3.52 0.00 1.79 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 0.00 0.00 0.00 0.00 19 Y 7.98 4.29 0.00 3.17 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 20 Q 8.22 4.00 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 21 L 7.65 3.95 0.00 1.68 1.49 0.81 0.69 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 22 F 8.02 3.58 0.00 2.48 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 23 D 8.52 4.64 0.00 2.74 2.86 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 24 N 7.69 4.96 0.00 2.67 2.82 0.00 0.00 6.71 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 7.98 4.38 0.00 2.55 2.42 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 26 R 8.04 3.89 0.00 1.08 1.41 0.00 2.31 0.00 0.00 2.87 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.26 0.00 27 T 7.35 4.07 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 1.12 0.00 0.00 28 Q 7.73 4.50 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.22 0.00 29 L 7.71 4.43 0.00 1.86 1.75 0.66 1.09 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 30 G 8.10 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 A 8.15 4.01 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 32 I 7.53 3.96 1.97 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 -0.26 0.90 0.00 0.00 33 Y 7.98 5.26 0.00 3.05 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 34 I 8.61 4.81 1.93 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 1.40 0.95 0.96 0.00 0.00 35 D 8.71 4.52 0.00 2.72 2.79 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 36 A 7.90 4.37 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 8.09 4.64 0.00 4.00 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 38 C 9.14 5.21 0.00 2.92 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 39 L 9.06 5.25 0.00 1.73 1.58 1.38 0.86 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 40 T 9.22 5.13 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 1.29 0.00 0.00 41 W 9.43 4.79 0.00 3.63 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 42 E 9.38 3.86 0.00 2.19 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 2.07 2.41 0.00 43 G 8.06 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 0.00 0.00 0.00 0.00 44 Q 7.97 4.27 0.00 2.63 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.82 0.00 0.00 0.00 0.00 0.00 2.47 2.51 0.00 45 Q 8.44 5.17 0.00 1.88 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 46 F 9.63 4.80 0.00 2.90 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 47 Q 8.88 4.88 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.61 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 48 G 9.53 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 49 K 8.38 4.00 0.00 2.07 1.81 0.00 2.12 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.68 7.81 50 A 8.09 3.98 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 51 A 7.94 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.70 3.36 1.68 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.82 0.25 0.00 0.00 53 V 7.86 3.47 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 0.94 0.00 0.00 1.03 0.00 0.00 54 E 8.01 3.75 0.00 2.15 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 0.00 2.23 2.27 0.00 55 K 7.52 3.44 0.00 0.79 0.74 0.00 1.15 0.00 0.00 1.30 0.00 0.00 3.26 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 0.65 7.81 56 L 7.04 3.41 0.00 1.37 1.32 1.02 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 57 S 8.02 4.04 0.00 3.63 3.76 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 58 S 7.57 4.17 0.00 3.93 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 59 L 6.44 3.54 0.00 0.81 0.87 0.55 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.49 0.00 2.15 2.01 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 1.96 1.91 0.00 61 F 6.94 5.26 0.00 3.30 3.14 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 62 Q 9.38 4.43 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.69 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 63 K 7.93 4.84 0.00 1.77 1.86 0.00 1.51 0.00 0.00 1.75 0.00 0.00 2.77 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.41 7.81 64 I 7.99 4.94 0.96 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.51 1.07 0.00 0.00 65 Q 8.36 4.74 0.00 2.08 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 66 H 9.54 5.44 0.00 2.86 2.96 0.00 5.85 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 9.10 4.76 0.00 3.82 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 68 I 8.41 4.36 1.89 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.91 0.95 0.00 0.00 69 T 8.95 4.39 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 1.16 0.00 0.00 70 A 7.55 4.89 1.16 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 0.00 0.00 71 Q 8.61 4.76 0.00 2.14 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 72 D 9.08 5.16 0.00 2.57 2.60 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 73 H 8.83 5.57 0.00 3.22 3.35 0.00 5.64 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 74 Q 9.24 4.47 0.00 1.80 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.94 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 75 P 0.00 4.83 0.00 1.61 1.34 0.00 3.09 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.44 0.00 76 T 8.82 4.40 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 1.22 0.00 0.00 77 P 0.00 4.28 0.00 2.04 2.13 0.00 3.63 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 78 D 8.06 4.73 0.00 2.67 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 79 S 7.88 3.87 0.00 4.10 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 80 C 8.22 5.10 0.00 2.89 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 81 I 8.41 4.66 1.61 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.82 0.89 0.00 0.00 82 I 8.89 4.63 1.86 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 1.23 1.66 0.94 0.00 0.00 83 S 9.34 5.46 0.00 4.00 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 84 M 9.31 5.12 0.00 1.99 1.85 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 85 V 9.00 4.96 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.29 0.00 0.00 86 V 8.27 4.46 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 0.81 0.00 0.00 0.82 0.00 0.00 87 G 7.50 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 0.00 0.00 0.00 88 Q 8.83 5.52 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.47 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 89 L 8.97 4.97 0.00 1.42 1.38 0.87 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 90 K 8.40 4.55 0.00 1.82 1.61 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.30 1.54 7.81 91 A 8.62 4.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.77 4.08 0.00 2.84 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 0.00 0.00 0.00 93 E 8.82 4.57 0.00 1.94 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 2.22 2.24 0.00 94 D 7.94 4.69 0.00 2.78 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.44 0.00 2.04 1.99 0.00 3.69 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 2.04 2.12 0.00 96 I 8.11 4.19 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 1.34 0.46 0.92 0.00 0.00 97 M 8.91 4.88 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 98 G 8.62 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 0.00 0.00 0.00 0.00 99 F 8.61 5.46 0.00 3.06 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 0.00 100 H 9.19 5.24 0.00 3.13 3.16 0.00 5.21 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 0.00 101 Q 9.09 5.14 0.00 2.72 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 1.78 2.58 0.00 102 M 8.69 5.05 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 103 F 9.38 5.32 0.00 2.85 2.79 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 0.00 104 L 9.04 5.05 0.00 1.77 1.57 0.98 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 105 L 9.28 5.14 0.00 1.53 1.63 0.44 -0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 106 K 9.21 4.92 0.00 1.81 1.64 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.28 1.37 7.81 107 N 8.50 3.96 0.00 1.44 1.97 0.00 0.00 7.08 7.82 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 0.00 108 I 7.99 4.25 1.82 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 1.25 0.68 0.88 0.00 0.00 109 N 8.56 4.39 0.00 2.77 3.06 0.00 0.00 7.21 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 0.00 110 D 8.51 4.33 0.00 2.74 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 0.00 111 A 7.29 4.47 1.18 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 0.00 112 W 9.00 4.41 0.00 3.19 3.14 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 0.00 113 V 8.91 4.59 2.14 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 0.73 0.00 0.00 0.99 0.00 0.00 114 C 9.05 4.79 0.00 2.83 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 0.00 115 T 8.91 4.47 4.31 0.00 0.00 0.00 0.00 0.00 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 0.00 116 N 8.16 5.57 0.00 2.67 2.76 0.00 0.00 6.50 8.08 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 0.00 117 D 9.45 5.24 0.00 3.03 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 0.00 118 M 8.76 5.31 0.00 1.90 1.81 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 119 F 9.23 5.26 0.00 2.97 2.45 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 0.00 120 R 7.48 4.30 0.00 1.74 1.36 0.00 3.37 0.00 0.00 2.99 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.52 0.00 121 L 8.47 4.31 0.00 1.44 1.53 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.25 4.22 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 0.00 123 L 7.41 4.32 0.00 1.53 1.53 0.91 1.09 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 0.00 124 H 8.31 4.78 0.00 3.07 3.19 0.00 5.69 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 N 8.52 4.20 0.00 2.26 1.74 0.00 0.00 6.61 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 F 7.41 4.91 0.00 3.01 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 0.00 127 G 8.78 3.78 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 0.00 0.00 0.00