NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 S 4.5453 8.3349 119.0158 58.5385 64.2498 173.3549 16 Q 4.1181 8.5481 118.9458 54.4290 30.5252 172.7618 17 N 5.3795 8.6665 120.7758 52.0699 42.5133 173.0191 18 F 5.0359 8.9834 123.1338 55.3378 43.8807 174.1919 19 L 4.5496 8.7438 120.5455 54.9910 42.3854 176.4316 20 F 4.8618 9.2776 124.3018 56.6882 42.9247 173.6394 21 G 4.1834 7.0687 110.3345 45.4954 0.0000 171.2512 22 C 4.4819 8.2968 114.2501 56.8790 33.4368 172.2207 23 E 4.8873 8.4879 120.0806 54.3182 31.9588 174.6073 24 L 5.1331 8.8219 127.0125 52.9032 44.7406 175.6292 25 K 4.7633 9.1688 121.1582 55.1555 36.0175 176.8382 26 A 3.9292 8.3278 124.7089 55.5036 18.2009 178.7414 27 D 4.6052 7.9257 111.6025 54.3708 41.7787 176.5877 28 K 4.3743 7.8508 120.5964 54.7571 33.3769 176.0386 29 K 4.5279 8.5015 125.7098 57.3607 33.3697 176.4772 30 E 5.2619 8.0802 118.4565 54.5338 33.4706 174.3783 31 Y 4.6245 9.1975 124.0760 55.8087 42.1518 173.8771 32 S 4.6618 7.7351 121.3599 56.6127 63.9916 172.8398 33 F 4.8750 9.3680 131.8841 56.8449 40.2435 174.6291 34 K 4.7026 7.9363 124.1904 55.1706 36.1262 175.6410 35 V 4.2091 7.7075 118.7077 60.7084 34.4474 174.5929 36 E 4.0725 8.5941 126.2513 55.7421 29.8867 176.4840 37 D 4.3819 8.7004 123.4403 55.3350 41.1813 174.6820 38 D 4.5106 8.3487 120.9517 54.4402 41.5347 175.0238 *41 E 4.2237 7.7996 120.0829 55.4602 30.9938 173.4447 42 H 5.6568 9.0714 123.0893 54.2244 32.3649 173.0525 43 Q 4.8505 8.9516 119.8101 54.0838 33.3089 174.0493 44 L 4.4641 8.7698 124.8921 53.7170 43.6792 175.3230 45 S 4.9923 9.1266 123.4885 56.6695 63.4022 173.0473 46 L 4.0488 8.8429 128.8572 55.1007 42.4545 176.4308 47 R 4.6170 9.3276 119.7927 57.1716 32.6794 175.3680 48 T 5.1210 8.0301 107.1342 59.8515 72.9248 172.0571 49 V 5.0183 8.8689 123.4972 61.2895 34.1595 174.5599 50 S 5.2856 9.2629 121.6085 56.7718 66.8952 172.6124 51 L 5.0337 8.5804 121.3585 53.1791 43.2784 177.0178 52 G 4.1497 8.8459 110.2886 45.7004 0.0000 174.5695 53 A 4.2193 8.8011 122.6910 54.1619 18.5032 178.5989 54 S 4.5756 7.9156 107.8354 57.5487 63.8508 174.2516 55 A 4.7602 7.4201 123.6747 51.9409 18.5044 178.0428 56 K 4.1952 8.5244 121.7517 56.7175 32.8514 177.4463 57 D 4.8731 8.2885 122.5131 52.8082 39.3876 174.4303 58 E 4.7875 7.8015 120.0538 54.0686 34.1539 174.5513 59 L 4.6772 8.4646 122.6434 55.4060 42.9917 175.3457 60 H 5.6322 9.4222 123.8882 53.3883 31.3548 173.4895 61 V 4.8386 8.1281 122.1859 61.0646 34.0477 174.2462 62 V 5.0149 8.7298 127.9838 61.0733 34.0544 174.0943 63 E 5.2397 9.7879 124.7302 54.5033 33.3393 174.2719 64 A 5.2343 8.9861 122.3443 50.1943 22.7468 175.0041 65 E 5.0008 8.6424 120.7143 54.8529 32.9798 175.0193 66 G 4.3462 8.5558 112.7777 45.6784 0.0000 171.6877 67 I 4.6702 8.3757 121.4464 60.7662 37.7468 176.7722 68 N 4.7524 9.2342 125.5417 51.9531 38.3434 175.4175 69 Y 4.1942 8.6483 119.0450 60.0168 38.8769 176.0961 70 E 4.0854 8.4320 115.9546 55.8100 29.8367 176.4902 71 G 3.8582 8.3905 106.6018 46.1124 0.0000 173.6096 72 K 4.7513 8.1677 119.1539 54.3682 34.6252 175.9769 73 T 4.6940 8.4632 114.3723 61.6901 69.8028 173.5951 74 I 4.7403 9.2397 118.0365 59.0404 41.6945 174.0240 75 K 5.2068 8.6287 122.0049 54.6187 34.0874 175.8096 76 I 4.7335 8.8597 118.6125 58.6653 40.9053 174.6387 77 A 4.4836 8.7290 127.3836 52.3659 18.2909 177.0345 78 L 4.5297 9.0610 122.9795 56.7151 43.1279 176.9231 79 A 4.6475 7.5151 117.1632 51.1588 22.7164 175.5597 80 S 5.1257 8.6143 114.8315 56.9169 66.2192 173.7659 81 L 4.9457 9.3412 124.4436 52.8202 46.4058 175.5442 82 K 4.9188 8.3691 121.2923 54.2111 34.9980 175.1076 83 P 4.2895 0.0000 0.0000 65.8546 31.3570 177.5694 84 S 4.3707 8.3262 109.9648 59.3827 63.5532 174.5244 85 V 4.1873 7.4180 119.3199 64.3824 33.4302 175.8629 86 Q 4.7195 8.2320 119.2780 54.8367 30.9302 171.9536 87 P 4.5115 0.0000 0.0000 64.4953 33.0640 176.8287 88 T 5.1333 7.9123 115.4146 61.4642 71.6832 173.8006 89 V 4.3801 8.8173 124.9428 61.1607 34.5107 173.9884 90 S 5.0710 8.7308 122.9475 57.4231 61.4874 173.7126 91 L 4.1765 9.3885 127.3203 54.3435 42.7979 178.1949 92 G 3.8110 8.8672 106.2999 46.3888 0.0000 173.6713 93 G 3.6073 7.6126 102.2694 46.0998 0.0000 175.2126 94 F 4.6905 8.5003 121.2600 57.2075 40.6329 175.2486 95 E 4.8582 8.9405 126.5722 56.2152 30.3342 176.5807 96 I 4.7662 8.8352 124.4049 59.8113 41.6668 174.4526 97 T 4.7996 8.5294 122.5471 61.7296 69.3531 173.3204 98 P 4.6621 0.0000 0.0000 61.9408 32.1584 174.1426 99 P 4.7069 0.0000 0.0000 62.8748 32.1484 176.4382 100 V 4.7833 8.9471 116.0997 59.8207 36.2933 174.3054 101 I 4.8969 8.5955 125.2101 59.8481 39.4420 174.5468 102 L 5.1170 8.9536 126.9720 53.3758 43.8398 175.5806 103 R 5.0784 8.9516 123.3362 54.3942 33.6899 173.6517 104 L 4.4843 8.8838 129.2433 54.8224 41.8766 176.3435 105 K 4.5313 9.1134 126.9611 57.6636 33.3426 176.9212 106 S 4.4627 8.0698 112.7050 58.1701 65.9167 175.1947 107 G 4.1180 8.9033 107.1094 45.5793 0.0000 173.8471 108 S 4.1246 8.6693 112.8677 58.4785 63.9707 175.8895 109 G 4.1629 8.2398 110.7263 43.6759 0.0000 170.3571 110 P 4.7899 0.0000 0.0000 62.6560 32.8662 175.4097 111 V 4.7843 8.6786 122.0007 61.4285 34.1558 173.8692 112 Y 5.1886 9.1205 125.0713 56.3225 41.0359 174.7231 113 V 4.9868 8.7135 122.1783 61.1538 34.6858 174.5143 114 S 5.1389 8.8444 121.9909 56.9234 66.4470 173.6087 115 G 4.3682 8.4377 106.5391 46.9994 0.0000 171.8923 116 Q 5.3687 8.5937 120.6013 54.4264 32.7000 174.3351 117 H 5.1853 9.2808 122.6440 54.8289 31.8262 173.4188 118 L 5.3794 9.2471 126.3145 53.2054 44.6839 175.8635 119 V 4.7626 8.8126 121.5448 61.2353 34.8335 175.0683 120 A 4.4470 9.2954 129.4122 52.0654 18.7052 175.5676 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 15 S 8.33 4.55 0.00 3.41 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 16 Q 8.55 4.12 0.00 2.03 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 17 N 8.67 5.38 0.00 2.57 2.47 0.00 0.00 6.80 7.02 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 18 F 8.98 5.04 0.00 3.18 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 19 L 8.74 4.55 0.00 1.61 1.64 0.94 0.76 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 F 9.28 4.86 0.00 3.12 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 21 G 7.07 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 22 C 8.30 4.48 0.00 2.38 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 0.00 0.00 0.00 23 E 8.49 4.89 0.00 1.91 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 1.83 1.47 0.00 24 L 8.82 5.13 0.00 1.52 1.51 0.94 0.71 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 25 K 9.17 4.76 0.00 1.69 1.78 0.00 1.32 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.21 1.35 7.81 26 A 8.33 3.93 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 27 D 7.93 4.61 0.00 2.67 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 28 K 7.85 4.37 0.00 1.72 1.64 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.47 7.81 29 K 8.50 4.53 0.00 1.76 1.83 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.50 1.66 7.81 30 E 8.08 5.26 0.00 1.80 1.80 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 2.21 2.28 0.00 31 Y 9.20 4.62 0.00 3.14 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 32 S 7.74 4.66 0.00 3.77 3.53 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 33 F 9.37 4.88 0.00 3.31 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 34 K 7.94 4.70 0.00 1.55 1.56 0.00 1.47 0.00 0.00 1.54 0.00 0.00 2.78 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.15 1.23 7.81 35 V 7.71 4.21 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 0.46 0.00 0.00 0.55 0.00 0.00 36 E 8.59 4.07 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 2.27 2.34 0.00 37 D 8.70 4.38 0.00 2.65 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.35 4.51 0.00 2.73 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 *41 E 7.80 4.22 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 2.34 2.40 0.00 42 H 9.07 5.66 0.00 3.13 3.34 0.00 5.71 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 8.95 4.85 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.31 2.73 0.00 44 L 8.77 4.46 0.00 0.94 1.29 -0.71 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 45 S 9.13 4.99 0.00 3.90 3.74 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 46 L 8.84 4.05 0.00 1.51 1.49 0.58 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 47 R 9.33 4.62 0.00 1.84 1.89 0.00 3.24 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 48 T 8.03 5.12 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 49 V 8.87 5.02 2.11 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 1.15 0.00 0.00 0.95 0.00 0.00 50 S 9.26 5.29 0.00 3.91 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 51 L 8.58 5.03 0.00 1.54 1.58 0.85 0.53 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 52 G 8.85 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 0.00 0.00 0.00 0.00 53 A 8.80 4.22 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 54 S 7.92 4.58 0.00 3.99 3.99 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 55 A 7.42 4.76 1.22 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 56 K 8.52 4.20 0.00 1.96 1.78 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.40 7.81 57 D 8.29 4.87 0.00 2.70 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 58 E 7.80 4.79 0.00 2.01 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 2.48 2.20 0.00 59 L 8.46 4.68 0.00 1.69 1.62 0.93 1.02 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 60 H 9.42 5.63 0.00 3.16 3.20 0.00 5.63 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.13 4.84 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 0.97 0.00 0.00 0.94 0.00 0.00 62 V 8.73 5.01 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 0.92 0.00 0.00 0.95 0.00 0.00 63 E 9.79 5.24 0.00 2.16 1.99 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 2.33 2.23 0.00 64 A 8.99 5.23 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 65 E 8.64 5.00 0.00 2.03 1.76 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 2.19 2.36 0.00 66 G 8.56 4.35 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 67 I 8.38 4.67 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.86 0.89 0.00 0.00 68 N 9.23 4.75 0.00 3.00 3.02 0.00 0.00 6.20 7.11 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 69 Y 8.65 4.19 0.00 2.87 3.10 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 70 E 8.43 4.09 0.00 2.02 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 0.00 2.54 2.27 0.00 71 G 8.39 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 72 K 8.17 4.75 0.00 1.73 1.71 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.52 7.81 73 T 8.46 4.69 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 1.21 0.00 0.00 74 I 9.24 4.74 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.87 0.99 0.00 0.00 75 K 8.63 5.21 0.00 1.64 1.95 0.00 1.69 0.00 0.00 1.91 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.40 7.81 76 I 8.86 4.73 1.95 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.38 0.97 0.00 0.00 77 A 8.73 4.48 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 78 L 9.06 4.53 0.00 1.63 1.74 0.81 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 79 A 7.52 4.65 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 80 S 8.61 5.13 0.00 3.73 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 81 L 9.34 4.95 0.00 1.55 1.70 0.99 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.37 4.92 0.00 1.88 1.61 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.56 7.81 83 P 0.00 4.29 0.00 2.09 2.12 0.00 3.92 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 2.18 2.08 0.00 84 S 8.33 4.37 0.00 4.00 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 85 V 7.42 4.19 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 0.83 0.00 0.00 0.94 0.00 0.00 86 Q 8.23 4.72 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 87 P 0.00 4.51 0.00 2.16 2.29 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 88 T 7.91 5.13 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 1.27 0.00 0.00 89 V 8.82 4.38 2.11 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 1.05 0.00 0.00 0.95 0.00 0.00 90 S 8.73 5.07 0.00 3.93 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 91 L 9.39 4.18 0.00 1.87 1.89 0.95 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 92 G 8.87 3.81 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 0.00 93 G 7.61 3.61 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 0.00 0.00 0.00 94 F 8.50 4.69 0.00 3.15 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 95 E 8.94 4.86 0.00 1.98 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 2.34 2.39 0.00 96 I 8.84 4.77 1.72 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.65 0.88 0.00 0.00 97 T 8.53 4.80 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 98 P 0.00 4.66 0.00 2.13 2.12 0.00 3.95 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.20 0.00 99 P 0.00 4.71 0.00 1.95 1.98 0.00 3.62 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 100 V 8.95 4.78 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 0.79 0.00 0.00 0.99 0.00 0.00 101 I 8.60 4.90 1.88 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 1.20 0.62 0.96 0.00 0.00 102 L 8.95 5.12 0.00 1.75 1.63 1.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 103 R 8.95 5.08 0.00 1.83 1.72 0.00 3.29 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 104 L 8.88 4.48 0.00 1.69 1.58 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 105 K 9.11 4.53 0.00 1.75 1.84 0.00 1.82 0.00 0.00 1.94 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.53 7.81 106 S 8.07 4.46 0.00 3.81 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 0.00 107 G 8.90 4.12 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 0.00 108 S 8.67 4.12 0.00 4.03 4.13 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 0.00 109 G 8.24 4.16 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 0.00 110 P 0.00 4.79 0.00 1.52 2.14 0.00 3.72 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.95 0.00 111 V 8.68 4.78 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 1.00 0.00 0.00 0.89 0.00 0.00 112 Y 9.12 5.19 0.00 2.93 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 0.00 113 V 8.71 4.99 2.17 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 1.10 0.00 0.00 0.97 0.00 0.00 114 S 8.84 5.14 0.00 3.89 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 0.00 115 G 8.44 4.37 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 0.00 0.00 0.00 116 Q 8.59 5.37 0.00 2.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 117 H 9.28 5.19 0.00 3.41 3.41 0.00 5.55 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 9.25 5.38 0.00 1.65 1.59 0.95 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 119 V 8.81 4.76 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 0.87 0.00 0.00 0.99 0.00 0.00 120 A 9.30 4.45 1.20 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 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.