NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3635 0.0000 0.0000 62.6975 32.6593 174.7835 2 Q 4.3514 8.4545 119.3669 53.6956 30.6453 172.9005 3 I 4.3767 8.0936 126.3507 59.5716 39.7570 175.2768 4 T 4.2536 8.3537 115.8820 61.2717 69.8179 174.0941 5 L 4.7366 7.6571 118.0196 54.2425 42.5334 178.0866 6 W 4.4855 8.3114 121.7591 58.8075 29.0775 175.9056 7 K 4.7767 7.7235 114.6232 54.0515 35.1726 175.6582 8 R 3.9724 8.4845 118.1773 56.4561 30.7349 176.2743 9 P 4.6643 0.0000 0.0000 61.8890 29.8927 174.0891 10 L 4.8461 7.6743 123.5349 55.1108 43.1136 177.1198 11 V 4.6227 8.8460 116.1838 59.6563 36.7188 174.5550 12 T 4.8104 8.4605 118.8676 63.2980 69.0993 174.5190 13 I 4.8530 9.1540 119.3520 58.9884 41.7069 174.0876 14 R 5.0919 8.8325 123.0081 54.5716 32.8964 174.2181 15 I 4.6246 8.6696 126.3772 60.1315 41.6805 175.1012 16 G 3.6505 9.7209 116.9853 46.4932 0.0000 174.4934 17 G 3.9513 8.5702 108.2336 44.5112 0.0000 173.8657 18 Q 4.6482 7.7276 119.1352 54.2176 31.0771 174.8637 19 L 4.8662 8.3833 122.9772 54.3346 43.0021 176.1154 20 K 4.7094 9.1324 121.6766 54.8889 37.3995 174.3859 21 E 5.0589 8.6796 122.0073 55.0398 30.8406 174.8319 22 A 4.8894 9.0035 127.4510 50.2736 23.6518 174.2829 23 L 4.7652 8.9477 122.4393 54.0192 43.7721 175.7666 24 L 4.5155 8.6460 127.3311 54.4993 42.4488 176.3232 25 D 4.8601 9.0438 125.6747 52.3503 42.4547 176.5046 26 T 4.0158 8.6913 116.5409 63.6279 69.1936 175.6846 27 G 3.7886 8.4566 110.0682 45.5912 0.0000 172.8169 28 A 4.6467 7.6876 122.8388 50.0639 20.8949 177.9367 29 D 4.4258 8.9217 122.9530 56.6881 42.2212 175.9420 30 D 5.3194 8.0073 116.0923 52.6803 45.6965 174.8372 31 T 4.7064 7.9203 117.0465 62.1734 70.7408 174.1968 32 V 4.8603 8.7368 126.2150 61.1894 34.5188 174.2212 33 I 4.8650 9.0253 128.5633 59.5883 41.1158 174.7350 34 E 4.7462 9.8167 128.6357 54.9566 28.5012 174.7019 35 E 4.6032 8.0000 124.6607 54.0944 33.2922 174.5266 *37 N 4.6247 8.3961 116.6116 52.8726 40.0033 175.2860 38 L 4.0844 7.7662 117.2260 53.9381 42.3561 175.5924 39 P 4.5879 0.0000 0.0000 62.1389 32.4796 175.5625 40 G 4.2165 8.7388 105.0023 44.6201 0.0000 173.7192 41 K 4.2125 8.3305 118.9468 55.8238 32.8453 176.3939 42 W 5.3426 7.5064 117.8890 54.9460 31.5522 173.7276 43 K 4.7735 8.8778 119.0338 54.1395 35.5126 174.0188 44 P 5.0671 0.0000 0.0000 63.3660 32.1351 175.9011 45 K 4.2984 8.6657 123.8951 55.7081 36.4803 174.8546 *47 I 4.2782 8.4698 110.7797 60.7379 38.6563 174.6899 48 G 3.3272 7.4765 109.2028 43.5519 0.0000 172.7120 49 G 3.8392 7.7862 105.5658 45.5062 0.0000 174.1783 50 I 3.6359 8.7091 119.5472 63.4399 37.9994 177.7899 51 G 3.8586 7.8102 106.7584 44.9086 0.0000 172.4706 52 G 3.9544 7.4985 105.4596 44.2627 0.0000 173.0665 53 F 5.1501 8.8452 119.2705 55.7585 41.4006 174.6585 54 I 4.8449 8.3306 116.0046 59.0009 40.7253 174.9392 55 K 4.5993 8.6184 122.6178 56.3928 33.0139 176.6532 56 V 4.6586 8.9631 116.7680 59.8693 36.9620 174.2141 57 R 4.8306 8.7421 121.3576 54.7755 32.0989 175.3932 58 Q 4.7747 9.3410 126.4004 55.1891 30.6096 173.6234 59 Y 5.1143 9.1904 124.9020 56.4647 40.4645 174.7900 60 D 5.1492 8.8919 123.0602 52.6952 43.7740 175.7336 61 Q 3.4271 8.3991 116.6847 57.1703 26.4916 174.1839 62 I 4.3735 7.9567 118.6190 59.3413 39.0706 175.0715 63 P 4.8652 0.0000 0.0000 62.7008 32.3065 176.2766 64 V 4.4703 8.9616 123.7473 61.4568 34.7945 173.2453 65 E 4.9384 9.1634 130.0699 54.4546 31.4972 176.3764 66 I 4.5988 8.8847 128.3490 61.2921 38.0937 177.3454 *68 G 3.8433 8.1542 108.3735 45.1386 0.0000 172.9634 69 H 4.7417 8.3249 118.9286 53.9582 30.0089 174.2893 70 K 4.6455 8.5259 124.0798 56.1605 32.9877 176.0189 71 A 4.9152 8.7547 124.5939 50.7111 23.5238 174.7085 72 I 4.7023 8.8184 119.0536 60.1440 41.2432 174.9234 73 G 4.0242 8.1718 116.5682 46.4348 0.0000 171.2251 74 T 4.7847 8.6141 117.7104 63.2423 69.6174 174.6511 75 V 4.4698 8.9839 125.8365 61.0783 34.8558 173.9358 76 L 5.1766 9.0005 128.0272 53.2247 44.0907 175.4326 77 V 5.2508 7.8959 123.6592 60.6312 33.9535 174.8201 78 G 4.2455 8.1248 113.4481 45.0725 0.0000 170.7747 79 P 4.6140 0.0000 0.0000 62.9322 31.7457 175.8070 80 T 4.5073 8.6627 115.6556 60.2327 70.5498 171.8005 81 P 4.3570 0.0000 0.0000 64.7975 31.7625 176.6432 82 V 4.3271 7.4068 117.8348 60.5503 34.1386 174.4673 83 N 4.6934 8.7600 124.9314 53.5881 39.8969 173.9619 84 I 4.9295 9.0947 123.8634 59.6179 41.0537 174.4097 85 I 4.4112 9.0397 129.2269 60.2378 38.5985 175.9144 86 G 4.5638 8.4281 115.8242 43.8443 0.0000 174.0593 87 R 4.0876 8.9579 118.4788 58.7798 30.2020 179.2180 88 N 4.3876 7.6811 114.2687 55.1114 37.6642 176.3675 89 L 4.4647 7.7504 117.5525 55.9173 42.7659 178.4816 90 L 4.0304 8.1012 119.5781 57.9858 41.5976 179.5754 91 T 3.9197 8.0286 109.7394 64.9284 68.3971 176.5572 92 Q 4.1435 7.8923 119.7458 57.5715 28.7578 177.3989 93 I 4.3732 7.4692 111.7986 59.8775 38.1346 175.4711 94 G 3.7996 7.9332 110.0495 47.6647 0.0000 174.5822 95 C 4.4351 7.9118 116.5509 57.0884 28.6592 175.8881 96 T 4.8056 8.0066 112.2817 59.1521 71.6060 173.1997 97 L 4.5628 8.2960 122.3891 53.9772 42.9519 176.2491 98 N 5.0644 8.4057 119.0466 51.7572 42.5902 174.4924 99 F 4.4504 8.2365 116.0178 57.5035 37.3925 173.8158 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 P 0.00 4.36 0.00 2.20 2.16 0.00 3.66 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.98 0.00 2 Q 8.45 4.35 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.74 0.00 0.00 0.00 0.00 0.00 2.24 2.45 0.00 3 I 8.09 4.38 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 1.48 0.78 0.91 0.00 0.00 4 T 8.35 4.25 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 1.26 0.00 0.00 5 L 7.66 4.74 0.00 1.38 1.54 0.81 0.85 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 6 W 8.31 4.49 0.00 3.26 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 7 K 7.72 4.78 0.00 1.85 1.83 0.00 1.62 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.46 7.81 8 R 8.48 3.97 0.00 1.83 1.93 0.00 3.20 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 9 P 0.00 4.66 0.00 2.10 2.20 0.00 3.68 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.97 0.00 10 L 7.67 4.85 0.00 1.56 1.64 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.85 4.62 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 0.77 0.00 0.00 0.93 0.00 0.00 12 T 8.46 4.81 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 1.26 0.00 0.00 13 I 9.15 4.85 1.92 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 1.21 1.31 0.91 0.00 0.00 14 R 8.83 5.09 0.00 1.85 1.77 0.00 3.06 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 15 I 8.67 4.62 1.84 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 1.08 1.12 0.87 0.00 0.00 16 G 9.72 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 G 8.57 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 18 Q 7.73 4.65 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 19 L 8.38 4.87 0.00 1.52 1.58 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 20 K 9.13 4.71 0.00 1.60 1.62 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.73 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.34 7.81 21 E 8.68 5.06 0.00 1.96 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 2.21 2.30 0.00 22 A 9.00 4.89 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 23 L 8.95 4.77 0.00 1.72 1.66 0.93 0.75 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 24 L 8.65 4.52 0.00 1.56 1.60 0.91 0.88 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 25 D 9.04 4.86 0.00 2.73 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 26 T 8.69 4.02 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 27 G 8.46 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 0.00 0.00 0.00 28 A 7.69 4.65 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.92 4.43 0.00 2.62 2.73 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 30 D 8.01 5.32 0.00 2.55 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 31 T 7.92 4.71 4.41 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 32 V 8.74 4.86 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 0.81 0.00 0.00 0.92 0.00 0.00 33 I 9.03 4.86 1.82 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 1.09 0.51 0.91 0.00 0.00 34 E 9.82 4.75 0.00 1.99 1.86 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 2.25 2.21 0.00 35 E 8.00 4.60 0.00 1.80 1.62 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 2.09 2.24 0.00 *37 N 8.40 4.62 0.00 2.88 2.87 0.00 0.00 6.97 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 38 L 7.77 4.08 0.00 1.24 1.41 0.18 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.59 0.00 2.24 2.12 0.00 3.72 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 2.02 1.98 0.00 40 G 8.74 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 41 K 8.33 4.21 0.00 1.76 1.65 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.42 7.81 42 W 7.51 5.34 0.00 2.84 1.74 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.88 4.77 0.00 1.81 1.83 0.00 1.31 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.39 7.81 44 P 0.00 5.07 0.00 2.20 2.33 0.00 3.75 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 45 K 8.67 4.30 0.00 1.89 1.62 0.00 1.94 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.45 7.81 *47 I 8.47 4.28 1.85 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 1.37 0.79 1.01 0.00 0.00 48 G 7.48 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 G 7.79 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 0.00 0.00 0.00 50 I 8.71 3.64 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 1.32 0.71 0.88 0.00 0.00 51 G 7.81 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 52 G 7.50 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 53 F 8.85 5.15 0.00 2.97 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 54 I 8.33 4.84 1.89 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 1.22 0.68 0.92 0.00 0.00 55 K 8.62 4.60 0.00 1.68 1.81 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.51 7.81 56 V 8.96 4.66 2.15 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 0.71 0.00 0.00 1.02 0.00 0.00 57 R 8.74 4.83 0.00 1.47 0.97 0.00 2.56 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.90 0.00 58 Q 9.34 4.77 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 59 Y 9.19 5.11 0.00 3.10 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 D 8.89 5.15 0.00 2.59 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 61 Q 8.40 3.43 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 62 I 7.96 4.37 1.88 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.98 0.87 0.00 0.00 63 P 0.00 4.87 0.00 1.93 1.99 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 64 V 8.96 4.47 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 0.93 0.00 0.00 0.98 0.00 0.00 65 E 9.16 4.94 0.00 2.08 1.79 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 2.25 2.28 0.00 66 I 8.88 4.60 1.88 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 0.71 0.91 0.00 0.00 *68 G 8.15 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 0.00 0.00 0.00 69 H 8.32 4.74 0.00 3.31 3.24 0.00 5.61 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 70 K 8.53 4.65 0.00 1.65 1.74 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.44 7.81 71 A 8.75 4.92 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 72 I 8.82 4.70 1.88 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 1.18 0.78 0.92 0.00 0.00 73 G 8.17 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 74 T 8.61 4.78 4.28 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 1.33 0.00 0.00 75 V 8.98 4.47 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 1.04 0.00 0.00 0.93 0.00 0.00 76 L 9.00 5.18 0.00 1.71 1.58 0.95 0.59 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 77 V 7.90 5.25 2.15 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 0.83 0.00 0.00 0.82 0.00 0.00 78 G 8.12 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 0.00 0.00 0.00 0.00 79 P 0.00 4.61 0.00 2.18 2.06 0.00 3.79 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 1.97 1.94 0.00 80 T 8.66 4.51 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 1.26 0.00 0.00 81 P 0.00 4.36 0.00 2.21 2.16 0.00 3.74 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 82 V 7.41 4.33 2.07 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 0.81 0.00 0.00 0.92 0.00 0.00 83 N 8.76 4.69 0.00 2.86 2.71 0.00 0.00 6.88 7.69 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 84 I 9.09 4.93 1.85 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 1.21 0.93 0.93 0.00 0.00 85 I 9.04 4.41 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 1.15 0.97 0.91 0.00 0.00 86 G 8.43 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 R 8.96 4.09 0.00 1.86 2.00 0.00 3.14 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 88 N 7.68 4.39 0.00 2.96 2.97 0.00 0.00 6.89 7.67 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 89 L 7.75 4.46 0.00 1.70 1.74 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.10 4.03 0.00 1.68 1.71 0.95 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.03 3.92 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 1.23 0.00 0.00 92 Q 7.89 4.14 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.00 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 93 I 7.47 4.37 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 1.70 0.56 0.93 0.00 0.00 94 G 7.93 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 0.00 0.00 0.00 95 C 7.91 4.44 0.00 2.77 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 96 T 8.01 4.81 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 1.20 0.00 0.00 97 L 8.30 4.56 0.00 1.72 1.77 0.96 0.95 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 98 N 8.41 5.06 0.00 2.66 2.65 0.00 0.00 6.82 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 99 F 8.24 4.45 0.00 3.05 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 * Residues marked with a * may have inaccurate shift predictions.