NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 Q 4.3113 8.3449 118.8310 55.8837 30.7374 175.1794 6 Q 3.9338 8.1540 118.1932 55.3462 28.6217 173.5833 7 L 4.9245 8.2349 122.6004 52.0328 46.3001 175.4834 8 P 4.5983 0.0000 0.0000 60.9681 29.6636 174.7962 9 I 4.3352 7.2098 121.1629 60.5088 41.1936 173.6940 10 R 4.6986 8.3377 123.2418 54.0494 32.2140 174.6816 11 A 4.3914 8.5807 122.8623 51.7322 19.8059 177.2422 12 V 4.4394 8.0662 113.6055 59.6023 36.2245 177.5120 13 G 3.9169 8.1620 109.7897 47.0782 0.0000 174.6416 14 E 4.5010 8.6620 123.6050 56.3721 29.6104 175.1623 15 Y 4.8521 7.7880 118.1699 57.3070 40.5018 174.5768 16 V 4.9458 8.8504 119.5342 61.5719 35.5272 173.6917 17 I 5.0585 9.1158 128.5143 59.7378 39.6446 174.8261 18 L 5.2867 9.0803 126.0472 52.8255 46.1998 175.3124 19 V 4.4954 8.4993 119.5466 60.8887 34.0191 175.0641 20 S 4.6728 8.5834 124.6263 58.7448 63.3614 174.1633 21 E 4.1868 8.7226 123.6020 54.6980 30.2637 176.5430 22 P 4.1390 0.0000 0.0000 62.6143 31.3876 175.7117 *47 E 4.1096 8.1833 118.4812 56.0810 31.1753 174.1719 48 L 4.8835 8.3937 126.9132 54.5886 43.2190 175.6666 49 C 5.2990 9.2229 120.3631 58.1651 33.5888 172.8972 50 V 4.8575 8.5314 120.4729 60.7689 34.1737 175.0009 51 V 3.9520 9.0421 128.7090 63.8759 31.7500 175.4755 52 H 4.7794 9.3088 127.9742 57.4431 32.0531 174.5004 53 S 4.7106 7.9450 111.0521 56.9550 65.9478 173.0397 54 V 4.6689 8.3938 126.5445 60.6239 33.3888 175.3521 55 G 4.0713 9.1469 116.1942 45.7884 0.0000 172.5987 56 P 4.4528 0.0000 0.0000 64.6490 31.4461 176.6035 57 D 4.6266 8.1039 118.3685 54.0363 41.5844 176.3641 58 V 2.8976 7.3389 120.8542 61.1001 32.0046 173.8665 59 P 4.0987 0.0000 0.0000 62.7666 31.3725 175.2071 60 E 3.8164 8.6051 122.2366 57.9381 29.9007 176.7148 61 G 3.9087 8.9003 112.8763 46.2638 0.0000 174.4007 62 F 4.2074 8.0660 123.1772 60.4520 39.4162 174.7304 63 C 4.5379 7.4957 110.9369 57.4819 32.2131 172.1025 64 E 4.7500 9.0284 117.9008 54.0254 32.8756 175.8304 65 V 3.9611 8.2195 121.0442 64.7238 32.0238 176.0470 66 G 4.0666 9.0841 115.3922 45.2923 0.0000 173.7795 67 D 4.5235 8.0965 120.3459 54.3429 42.0109 175.3393 68 L 5.0386 8.5308 124.6264 54.5172 44.4266 175.0065 69 T 4.9951 9.0239 119.2237 61.2575 71.8014 171.6201 70 S 5.2926 8.6393 116.4461 56.5623 65.0926 173.0529 71 L 4.9774 8.9438 126.2399 52.2206 45.5239 174.9077 72 P 4.4180 0.0000 0.0000 62.1144 31.8506 177.5523 73 V 3.6484 8.7558 122.0089 66.2698 31.3543 178.1033 74 G 3.7772 8.0288 106.0612 47.2891 0.0000 173.8683 75 Q 4.3249 8.3288 118.5339 56.2750 29.5100 175.4360 76 I 4.8337 7.1753 109.9975 58.9868 40.5944 175.0623 77 R 4.7056 8.8664 123.1547 54.3065 33.0851 174.4181 78 N 4.9403 8.9660 123.4568 53.4926 39.4140 174.3802 79 V 4.4618 8.4695 122.7775 60.1433 34.0700 173.7356 80 P 4.3146 0.0000 0.0000 62.6425 31.9610 176.3038 81 H 3.9186 8.8095 122.0441 55.5752 31.3619 174.2797 82 P 4.0889 0.0000 0.0000 66.4898 30.6718 178.6695 83 F 4.4115 8.1956 116.8468 60.3747 38.9567 177.7125 84 V 3.8325 7.9322 117.3789 65.8667 31.2301 177.7545 85 A 4.0579 8.0726 119.7486 55.0489 18.2754 178.7337 86 L 4.4114 8.4566 115.3052 53.5852 42.7476 177.5273 87 G 4.0639 7.7737 106.3923 47.2445 0.0000 173.5735 88 L 4.4478 8.7951 117.7965 55.4436 43.9784 177.2599 89 K 4.7307 7.8768 114.1445 54.5723 35.7340 174.7440 90 Q 4.7076 8.1665 117.5046 53.6701 30.9774 175.0735 91 P 4.2632 0.0000 0.0000 65.8980 31.6044 178.7135 92 K 3.9135 8.2145 115.7764 59.3209 31.9859 177.2330 93 E 4.4955 8.0307 114.5038 56.0129 29.6420 175.4942 94 I 4.3631 7.7577 122.6872 60.7385 39.2396 176.1240 95 K 4.3021 8.5716 126.1585 56.3133 32.7452 174.6248 96 Q 4.0343 7.9294 118.2081 55.6412 29.2744 175.3678 97 K 4.6353 8.4637 123.4713 54.7201 34.7879 174.3921 98 F 5.0998 8.9690 125.9103 56.2602 41.3905 175.2480 99 V 5.0848 8.7289 114.6301 60.1758 36.5474 174.0679 100 T 5.3763 9.0467 116.0570 61.1751 71.5000 171.9673 101 C 5.1308 8.5452 117.3397 57.7439 33.4425 172.9295 102 H 4.2770 8.6162 119.9571 55.6734 30.3928 175.9215 103 Y 4.0189 8.1272 123.6150 59.8463 37.7891 178.3432 104 K 3.6848 7.0423 117.6321 57.7786 32.1227 177.1785 105 A 4.2227 7.8270 120.9820 52.6018 19.0963 177.2262 106 I 4.2777 7.6594 118.0880 59.6524 37.3873 173.9136 107 P 4.6034 0.0000 0.0000 64.0989 32.2017 174.9857 108 C 4.5954 7.4476 111.1457 56.9249 32.3595 172.6563 109 L 4.7446 7.6887 118.5816 53.3866 45.2778 177.4002 110 Y 4.3684 8.6684 122.9972 57.1127 36.7787 175.7944 111 K 4.1705 7.4704 124.1523 56.5214 32.6153 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 0.86 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 1.21 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 4.32 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 8.20 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 8.80 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 5.08 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 3.68 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.