NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 Q 4.3112 8.3449 118.8310 55.8844 30.7373 175.1796 6 Q 3.9335 8.1541 118.1898 55.3473 28.6205 173.5835 7 L 4.9243 8.2346 122.6015 52.0324 46.2992 175.4841 8 P 4.5983 0.0000 0.0000 60.9685 29.6632 174.7968 9 I 4.3353 7.2097 121.1620 60.5085 41.1942 173.6939 10 R 4.6985 8.3378 123.2419 54.0494 32.2136 174.6816 11 A 4.3915 8.5798 122.8624 51.7318 19.8054 177.2420 12 V 4.4393 8.0662 113.6059 59.6007 36.2249 177.5079 13 G 3.9174 8.1625 109.7871 47.0783 0.0000 174.6405 14 E 4.5007 8.6619 123.6018 56.3733 29.6103 175.1637 15 Y 4.8505 7.7883 118.1740 57.3049 40.5038 174.5764 16 V 4.9455 8.8499 119.5314 61.5723 35.5260 173.6909 17 I 5.0587 9.1159 128.5166 59.7379 39.6442 174.8259 18 L 5.2868 9.0805 126.0471 52.8255 46.2004 175.3126 19 V 4.4956 8.4988 119.5485 60.8893 34.0193 175.0645 20 S 4.6736 8.5833 124.6255 58.7421 63.3622 174.1618 21 E 4.1865 8.7225 123.6017 54.6985 30.2629 176.5388 22 P 4.1380 0.0000 0.0000 62.6170 31.3919 175.7108 *47 E 4.1094 8.1835 118.4833 56.0803 31.1749 174.1730 48 L 4.8831 8.3939 126.9186 54.5914 43.2162 175.6688 49 C 5.2995 9.2238 120.3679 58.1638 33.5883 172.8977 50 V 4.8575 8.5322 120.4696 60.7684 34.1758 175.0005 51 V 3.9516 9.0420 128.7066 63.8779 31.7495 175.4749 52 H 4.7799 9.3089 127.9747 57.4432 32.0528 174.5004 53 S 4.7106 7.9451 111.0527 56.9545 65.9482 173.0391 54 V 4.6687 8.3940 126.5441 60.6239 33.3890 175.3511 55 G 4.0716 9.1466 116.1938 45.7900 0.0000 172.5977 56 P 4.4527 0.0000 0.0000 64.6503 31.4451 176.6031 57 D 4.6269 8.1036 118.3652 54.0359 41.5856 176.3644 58 V 2.8982 7.3381 120.8518 61.0997 32.0046 173.8668 59 P 4.0990 0.0000 0.0000 62.7654 31.3732 175.2072 60 E 3.8164 8.6052 122.2350 57.9388 29.9002 176.7143 61 G 3.9086 8.9002 112.8780 46.2659 0.0000 174.4019 62 F 4.2076 8.0660 123.1781 60.4517 39.4162 174.7301 63 C 4.5378 7.4954 110.9371 57.4831 32.2122 172.1023 64 E 4.7500 9.0289 117.9012 54.0256 32.8769 175.8296 65 V 3.9614 8.2198 121.0409 64.7251 32.0235 176.0427 66 G 4.0668 9.0848 115.3828 45.2935 0.0000 173.7811 67 D 4.5230 8.0958 120.3459 54.3440 42.0085 175.3414 68 L 5.0382 8.5314 124.6326 54.5178 44.4261 175.0065 69 T 4.9951 9.0237 119.2220 61.2574 71.8011 171.6197 70 S 5.2922 8.6396 116.4437 56.5626 65.0913 173.0539 71 L 4.9776 8.9449 126.2403 52.2214 45.5250 174.9072 72 P 4.4184 0.0000 0.0000 62.1137 31.8520 177.5537 73 V 3.6476 8.7552 122.0058 66.2690 31.3551 178.1077 74 G 3.7762 8.0287 106.0712 47.2954 0.0000 173.8710 75 Q 4.3244 8.3264 118.5336 56.2789 29.5073 175.4369 76 I 4.8342 7.1758 110.0026 58.9861 40.5943 175.0625 77 R 4.7056 8.8665 123.1597 54.3060 33.0849 174.4190 78 N 4.9400 8.9662 123.4575 53.4940 39.4131 174.3800 79 V 4.4619 8.4684 122.7773 60.1433 34.0709 173.7353 80 P 4.3148 0.0000 0.0000 62.6407 31.9608 176.3043 81 H 3.9184 8.8097 122.0474 55.5755 31.3625 174.2792 82 P 4.0889 0.0000 0.0000 66.4890 30.6717 178.6699 83 F 4.4135 8.1948 116.8478 60.3753 38.9570 177.7127 84 V 3.8324 7.9320 117.3783 65.8676 31.2303 177.7548 85 A 4.0581 8.0738 119.7505 55.0474 18.2750 178.7319 86 L 4.4117 8.4557 115.3058 53.5853 42.7472 177.5256 87 G 4.0639 7.7744 106.3899 47.2453 0.0000 173.5785 88 L 4.4480 8.7954 117.7960 55.4411 43.9795 177.2579 89 K 4.7310 7.8770 114.1492 54.5724 35.7341 174.7425 90 Q 4.7081 8.1666 117.5015 53.6695 30.9796 175.0733 91 P 4.2633 0.0000 0.0000 65.8979 31.6043 178.7148 92 K 3.9140 8.2137 115.7785 59.3193 31.9865 177.2332 93 E 4.4953 8.0309 114.5052 56.0116 29.6415 175.4943 94 I 4.3633 7.7580 122.6867 60.7369 39.2398 176.1233 95 K 4.3024 8.5711 126.1547 56.3115 32.7469 174.6277 96 Q 4.0344 7.9296 118.2081 55.6419 29.2744 175.3676 97 K 4.6355 8.4637 123.4714 54.7199 34.7878 174.3933 98 F 5.0994 8.9690 125.9072 56.2602 41.3930 175.2467 99 V 5.0851 8.7280 114.6231 60.1770 36.5479 174.0677 100 T 5.3763 9.0478 116.0582 61.1753 71.5001 171.9677 101 C 5.1307 8.5454 117.3396 57.7434 33.4418 172.9304 102 H 4.2769 8.6165 119.9568 55.6739 30.3931 175.9225 103 Y 4.0188 8.1256 123.6092 59.8456 37.7900 178.3379 104 K 3.6860 7.0430 117.6264 57.7734 32.1222 177.1758 105 A 4.2237 7.8274 120.9877 52.5960 19.0995 177.2262 106 I 4.2776 7.6594 118.0891 59.6516 37.3857 173.9137 107 P 4.6031 0.0000 0.0000 64.1009 32.2007 174.9873 108 C 4.5954 7.4477 111.1452 56.9245 32.3598 172.6562 109 L 4.7446 7.6886 118.5811 53.3866 45.2780 177.3987 110 Y 4.3675 8.6676 122.9952 57.1174 36.7819 175.7943 111 K 4.1704 7.4710 124.1555 56.5214 32.6143 175.2828 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 5 Q 8.34 4.31 0.00 2.22 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.94 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 6 Q 8.15 3.93 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 7 L 8.23 4.92 0.00 1.62 1.54 1.06 1.19 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 8 P 0.00 4.60 0.00 2.18 2.11 0.00 3.87 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 2.01 2.02 0.00 9 I 7.21 4.34 1.59 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.52 0.55 0.00 0.00 10 R 8.34 4.70 0.00 1.92 1.86 0.00 3.08 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 11 A 8.58 4.39 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 12 V 8.07 4.44 2.12 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 0.86 0.00 0.00 0.95 0.00 0.00 13 G 8.16 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 0.00 0.00 0.00 14 E 8.66 4.50 0.00 1.86 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.33 0.00 15 Y 7.79 4.85 0.00 3.16 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 16 V 8.85 4.95 2.20 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 1.09 0.00 0.00 1.03 0.00 0.00 17 I 9.12 5.06 2.00 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 1.30 0.71 1.12 0.00 0.00 18 L 9.08 5.29 0.00 1.52 1.66 1.02 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 19 V 8.50 4.50 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 0.72 0.00 0.00 0.15 0.00 0.00 20 S 8.58 4.67 0.00 3.74 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 21 E 8.72 4.19 0.00 1.88 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 2.38 2.40 0.00 22 P 0.00 4.14 0.00 2.01 2.07 0.00 3.67 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 *47 E 8.18 4.11 0.00 2.13 2.04 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 2.28 2.42 0.00 48 L 8.39 4.88 0.00 1.61 1.53 0.84 0.79 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 49 C 9.22 5.30 0.00 2.84 2.84 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 50 V 8.53 4.86 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 0.99 0.00 0.00 0.98 0.00 0.00 51 V 9.04 3.95 2.26 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 0.92 0.00 0.00 1.06 0.00 0.00 52 H 9.31 4.78 0.00 3.15 3.52 0.00 6.02 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 53 S 7.95 4.71 0.00 4.06 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 54 V 8.39 4.67 2.12 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 0.88 0.00 0.00 1.01 0.00 0.00 55 G 9.15 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 56 P 0.00 4.45 0.00 2.18 2.20 0.00 3.84 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 2.00 2.00 0.00 57 D 8.10 4.63 0.00 2.80 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 58 V 7.34 2.90 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 0.15 0.00 0.00 0.84 0.00 0.00 59 P 0.00 4.10 0.00 2.22 2.09 0.00 2.20 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.77 0.00 60 E 8.61 3.82 0.00 1.93 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 61 G 8.90 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 0.00 0.00 0.00 62 F 8.07 4.21 0.00 3.02 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 63 C 7.50 4.54 0.00 3.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.03 4.75 0.00 2.11 1.81 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 2.21 2.19 0.00 65 V 8.22 3.96 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 0.82 0.00 0.00 0.99 0.00 0.00 66 G 9.08 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 67 D 8.10 4.52 0.00 2.75 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 68 L 8.53 5.04 0.00 1.81 1.62 0.93 0.52 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 69 T 9.02 5.00 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 1.35 0.00 0.00 70 S 8.64 5.29 0.00 4.15 3.82 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 71 L 8.94 4.98 0.00 1.53 1.53 0.99 1.20 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 72 P 0.00 4.42 0.00 2.19 1.98 0.00 3.65 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 73 V 8.76 3.65 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 0.98 0.00 0.00 0.94 0.00 0.00 74 G 8.03 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 75 Q 8.33 4.32 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.66 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 76 I 7.18 4.83 1.92 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 1.30 0.67 0.96 0.00 0.00 77 R 8.87 4.71 0.00 1.87 1.79 0.00 3.09 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 78 N 8.97 4.94 0.00 2.67 2.76 0.00 0.00 6.75 7.68 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 79 V 8.47 4.46 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 0.93 0.00 0.00 80 P 0.00 4.31 0.00 2.05 1.97 0.00 3.70 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 2.01 2.07 0.00 81 H 8.81 3.92 0.00 3.27 3.16 0.00 5.90 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 P 0.00 4.09 0.00 2.28 2.25 0.00 2.62 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 83 F 8.19 4.41 0.00 3.03 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 84 V 7.93 3.83 2.23 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 1.08 0.00 0.00 0.98 0.00 0.00 85 A 8.07 4.06 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 86 L 8.46 4.41 0.00 1.68 1.69 0.98 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 87 G 7.77 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 88 L 8.80 4.45 0.00 1.45 1.51 0.71 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 89 K 7.88 4.73 0.00 1.89 1.89 0.00 2.17 0.00 0.00 1.98 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.47 7.81 90 Q 8.17 4.71 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 91 P 0.00 4.26 0.00 2.18 2.14 0.00 3.63 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.16 0.00 92 K 8.21 3.91 0.00 1.75 1.90 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.45 7.81 93 E 8.03 4.50 0.00 2.13 2.04 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 2.48 2.34 0.00 94 I 7.76 4.36 1.95 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 1.45 0.89 0.66 0.00 0.00 95 K 8.57 4.30 0.00 1.77 1.70 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.29 1.01 7.81 96 Q 7.93 4.03 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 97 K 8.46 4.64 0.00 1.80 1.59 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.83 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.45 7.81 98 F 8.97 5.10 0.00 3.01 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 99 V 8.73 5.09 2.19 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 0.81 0.00 0.00 0.96 0.00 0.00 100 T 9.05 5.38 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 1.21 0.00 0.00 101 C 8.55 5.13 0.00 3.21 3.04 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 0.00 102 H 8.62 4.28 0.00 3.01 3.05 0.00 5.87 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 8.13 4.02 0.00 2.43 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 0.00 104 K 7.04 3.69 0.00 1.42 1.63 0.00 1.39 0.00 0.00 1.46 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.83 0.21 7.81 105 A 7.83 4.22 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 0.00 106 I 7.66 4.28 2.45 0.00 0.00 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 1.48 0.74 1.03 0.00 0.00 107 P 0.00 4.60 0.00 2.16 2.18 0.00 3.80 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 108 C 7.45 4.60 0.00 2.76 2.76 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 0.00 109 L 7.69 4.74 0.00 1.46 1.47 0.74 0.75 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 0.00 110 Y 8.67 4.37 0.00 2.99 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 0.00 111 K 7.47 4.17 0.00 1.65 1.57 0.00 2.14 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.28 1.37 7.81 * Residues marked with a * may have inaccurate shift predictions.