NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 Q 4.3112 8.3449 118.8310 55.8841 30.7373 175.1797 6 Q 3.9334 8.1541 118.1908 55.3482 28.6207 173.5830 7 L 4.9249 8.2346 122.5981 52.0323 46.3041 175.4833 8 P 4.5983 0.0000 0.0000 60.9684 29.6635 174.8011 9 I 4.3352 7.2093 121.1524 60.5084 41.1934 173.6935 10 R 4.6987 8.3378 123.2420 54.0493 32.2151 174.6825 11 A 4.3916 8.5814 122.8589 51.7321 19.8066 177.2421 12 V 4.4396 8.0660 113.6005 59.6013 36.2253 177.5142 13 G 3.9170 8.1620 109.7924 47.0780 0.0000 174.6406 14 E 4.5007 8.6622 123.6059 56.3720 29.6099 175.1617 15 Y 4.8522 7.7876 118.1702 57.3050 40.5040 174.5773 16 V 4.9455 8.8495 119.5350 61.5726 35.5262 173.6909 17 I 5.0582 9.1158 128.5181 59.7386 39.6425 174.8259 18 L 5.2869 9.0809 126.0451 52.8257 46.2012 175.3124 19 V 4.4950 8.4994 119.5479 60.8887 34.0195 175.0639 20 S 4.6727 8.5836 124.6269 58.7436 63.3615 174.1630 21 E 4.1863 8.7221 123.6038 54.6991 30.2626 176.5435 22 P 4.1388 0.0000 0.0000 62.6144 31.3886 175.7112 *47 E 4.1096 8.1833 118.4811 56.0809 31.1759 174.1721 48 L 4.8833 8.3937 126.9140 54.5892 43.2186 175.6671 49 C 5.2996 9.2228 120.3636 58.1643 33.5882 172.8975 50 V 4.8578 8.5313 120.4686 60.7693 34.1770 175.0002 51 V 3.9523 9.0417 128.7077 63.8744 31.7500 175.4755 52 H 4.7803 9.3094 127.9750 57.4423 32.0542 174.4989 53 S 4.7107 7.9452 111.0524 56.9543 65.9480 173.0391 54 V 4.6689 8.3937 126.5426 60.6237 33.3899 175.3519 55 G 4.0717 9.1468 116.1933 45.7887 0.0000 172.5987 56 P 4.4531 0.0000 0.0000 64.6481 31.4468 176.6039 57 D 4.6265 8.1040 118.3699 54.0369 41.5844 176.3646 58 V 2.8979 7.3386 120.8538 61.1003 32.0060 173.8661 59 P 4.0984 0.0000 0.0000 62.7680 31.3717 175.2070 60 E 3.8166 8.6051 122.2408 57.9362 29.9015 176.7132 61 G 3.9088 8.8999 112.8748 46.2652 0.0000 174.4018 62 F 4.2077 8.0666 123.1844 60.4526 39.4161 174.7297 63 C 4.5380 7.4960 110.9378 57.4827 32.2125 172.1027 64 E 4.7499 9.0281 117.8998 54.0257 32.8760 175.8300 65 V 3.9610 8.2198 121.0453 64.7245 32.0237 176.0447 66 G 4.0667 9.0850 115.3883 45.2930 0.0000 173.7802 67 D 4.5236 8.0963 120.3440 54.3427 42.0116 175.3396 68 L 5.0388 8.5307 124.6263 54.5164 44.4262 175.0055 69 T 4.9959 9.0246 119.2262 61.2570 71.8029 171.6210 70 S 5.2930 8.6393 116.4552 56.5610 65.0920 173.0503 71 L 4.9775 8.9441 126.2394 52.2209 45.5244 174.9076 72 P 4.4181 0.0000 0.0000 62.1139 31.8505 177.5522 73 V 3.6486 8.7560 122.0076 66.2702 31.3541 178.1047 74 G 3.7772 8.0291 106.0627 47.2905 0.0000 173.8679 75 Q 4.3253 8.3293 118.5323 56.2735 29.5114 175.4360 76 I 4.8336 7.1752 109.9943 58.9867 40.5942 175.0622 77 R 4.7056 8.8663 123.1568 54.3063 33.0834 174.4194 78 N 4.9403 8.9660 123.4574 53.4928 39.4138 174.3804 79 V 4.4619 8.4684 122.7745 60.1432 34.0713 173.7354 80 P 4.3146 0.0000 0.0000 62.6423 31.9609 176.3040 81 H 3.9183 8.8104 122.0444 55.5773 31.3609 174.2783 82 P 4.0890 0.0000 0.0000 66.4907 30.6720 178.6692 83 F 4.4100 8.1960 116.8459 60.3740 38.9572 177.7129 84 V 3.8328 7.9326 117.3787 65.8665 31.2300 177.7542 85 A 4.0579 8.0719 119.7464 55.0491 18.2754 178.7339 86 L 4.4120 8.4571 115.3114 53.5864 42.7493 177.5275 87 G 4.0639 7.7741 106.3846 47.2449 0.0000 173.5773 88 L 4.4478 8.7936 117.7972 55.4421 43.9786 177.2608 89 K 4.7304 7.8767 114.1460 54.5721 35.7327 174.7442 90 Q 4.7074 8.1663 117.5074 53.6698 30.9763 175.0744 91 P 4.2631 0.0000 0.0000 65.8978 31.6042 178.7146 92 K 3.9139 8.2140 115.7773 59.3189 31.9862 177.2318 93 E 4.4959 8.0309 114.5107 56.0127 29.6430 175.4931 94 I 4.3630 7.7577 122.6878 60.7398 39.2390 176.1241 95 K 4.3021 8.5717 126.1604 56.3132 32.7451 174.6220 96 Q 4.0341 7.9295 118.2075 55.6419 29.2740 175.3683 97 K 4.6353 8.4637 123.4714 54.7200 34.7871 174.3918 98 F 5.0995 8.9690 125.9088 56.2577 41.3931 175.2472 99 V 5.0851 8.7292 114.6302 60.1750 36.5469 174.0686 100 T 5.3765 9.0476 116.0549 61.1758 71.4996 171.9673 101 C 5.1306 8.5463 117.3429 57.7421 33.4430 172.9304 102 H 4.2768 8.6173 119.9575 55.6748 30.3927 175.9228 103 Y 4.0194 8.1273 123.6126 59.8447 37.7903 178.3411 104 K 3.6851 7.0425 117.6350 57.7793 32.1228 177.1785 105 A 4.2227 7.8264 120.9801 52.6011 19.0960 177.2260 106 I 4.2777 7.6593 118.0881 59.6516 37.3865 173.9139 107 P 4.6032 0.0000 0.0000 64.0999 32.2010 174.9877 108 C 4.5952 7.4476 111.1455 56.9247 32.3589 172.6567 109 L 4.7450 7.6891 118.5846 53.3861 45.2764 177.4006 110 Y 4.3687 8.6695 122.9962 57.1130 36.7789 175.7946 111 K 4.1705 7.4705 124.1527 56.5215 32.6154 175.2845 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 0.87 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 9.09 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 1.21 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 4.33 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 8.20 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 1.05 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 8.79 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 1.62 0.00 0.00 0.00 0.00 0.00 0.00 110 Y 8.67 4.37 0.00 2.98 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.