NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 Q 4.3111 8.3449 118.8310 55.8845 30.7373 175.1801 6 Q 3.9329 8.1544 118.1887 55.3501 28.6200 173.5843 7 L 4.9246 8.2348 122.6011 52.0328 46.2994 175.4846 8 P 4.5982 0.0000 0.0000 60.9663 29.6636 174.7927 9 I 4.3344 7.2100 121.1675 60.5106 41.1934 173.6930 10 R 4.6985 8.3381 123.2443 54.0491 32.2093 174.6832 11 A 4.3913 8.5809 122.8645 51.7327 19.8053 177.2422 12 V 4.4391 8.0665 113.6072 59.6041 36.2235 177.5146 13 G 3.9170 8.1617 109.7924 47.0781 0.0000 174.6413 14 E 4.5015 8.6622 123.6000 56.3712 29.6102 175.1605 15 Y 4.8524 7.7882 118.1681 57.3062 40.5033 174.5778 16 V 4.9455 8.8497 119.5347 61.5726 35.5269 173.6905 17 I 5.0587 9.1160 128.5165 59.7375 39.6449 174.8264 18 L 5.2863 9.0798 126.0472 52.8256 46.1978 175.3122 19 V 4.4955 8.4993 119.5478 60.8890 34.0188 175.0645 20 S 4.6729 8.5850 124.6277 58.7441 63.3615 174.1627 21 E 4.1870 8.7220 123.5982 54.6976 30.2645 176.5418 22 P 4.1391 0.0000 0.0000 62.6162 31.3872 175.7110 *47 E 4.1097 8.1830 118.4810 56.0814 31.1757 174.1714 48 L 4.8838 8.3936 126.9102 54.5867 43.2190 175.6654 49 C 5.2996 9.2231 120.3640 58.1635 33.5880 172.8970 50 V 4.8570 8.5309 120.4706 60.7694 34.1721 175.0009 51 V 3.9523 9.0422 128.7099 63.8743 31.7507 175.4757 52 H 4.7779 9.3086 127.9727 57.4435 32.0528 174.4995 53 S 4.7107 7.9449 111.0495 56.9548 65.9480 173.0401 54 V 4.6688 8.3938 126.5420 60.6239 33.3890 175.3514 55 G 4.0711 9.1465 116.1942 45.7899 0.0000 172.5977 56 P 4.4530 0.0000 0.0000 64.6479 31.4473 176.6039 57 D 4.6263 8.1040 118.3706 54.0367 41.5833 176.3633 58 V 2.8974 7.3394 120.8568 61.1000 32.0048 173.8661 59 P 4.0984 0.0000 0.0000 62.7681 31.3716 175.2066 60 E 3.8166 8.6052 122.2363 57.9369 29.9010 176.7127 61 G 3.9085 8.8998 112.8766 46.2680 0.0000 174.4043 62 F 4.2071 8.0663 123.1796 60.4505 39.4164 174.7308 63 C 4.5381 7.4958 110.9360 57.4807 32.2142 172.1036 64 E 4.7498 9.0282 117.8972 54.0265 32.8767 175.8291 65 V 3.9607 8.2199 121.0505 64.7236 32.0241 176.0456 66 G 4.0667 9.0824 115.3927 45.2929 0.0000 173.7801 67 D 4.5238 8.0972 120.3431 54.3424 42.0113 175.3393 68 L 5.0386 8.5304 124.6216 54.5172 44.4265 175.0062 69 T 4.9954 9.0221 119.2217 61.2577 71.8014 171.6208 70 S 5.2926 8.6390 116.4475 56.5622 65.0950 173.0521 71 L 4.9772 8.9433 126.2362 52.2217 45.5239 174.9072 72 P 4.4183 0.0000 0.0000 62.1132 31.8513 177.5520 73 V 3.6485 8.7556 122.0066 66.2698 31.3544 178.1044 74 G 3.7770 8.0291 106.0632 47.2901 0.0000 173.8674 75 Q 4.3254 8.3287 118.5311 56.2717 29.5113 175.4346 76 I 4.8338 7.1754 109.9991 58.9868 40.5951 175.0620 77 R 4.7055 8.8663 123.1536 54.3060 33.0849 174.4174 78 N 4.9402 8.9666 123.4591 53.4937 39.4133 174.3797 79 V 4.4618 8.4692 122.7799 60.1435 34.0689 173.7358 80 P 4.3151 0.0000 0.0000 62.6407 31.9616 176.3042 81 H 3.9194 8.8086 122.0453 55.5720 31.3629 174.2810 82 P 4.0889 0.0000 0.0000 66.4903 30.6721 178.6692 83 F 4.4100 8.1962 116.8465 60.3732 38.9562 177.7127 84 V 3.8324 7.9322 117.3802 65.8667 31.2305 177.7541 85 A 4.0580 8.0726 119.7476 55.0490 18.2751 178.7333 86 L 4.4117 8.4572 115.3096 53.5856 42.7491 177.5276 87 G 4.0639 7.7732 106.3882 47.2446 0.0000 173.5741 88 L 4.4478 8.7946 117.7968 55.4432 43.9785 177.2606 89 K 4.7306 7.8767 114.1434 54.5721 35.7342 174.7444 90 Q 4.7074 8.1665 117.5068 53.6700 30.9764 175.0739 91 P 4.2629 0.0000 0.0000 65.8981 31.6046 178.7122 92 K 3.9129 8.2152 115.7757 59.3216 31.9854 177.2326 93 E 4.4959 8.0308 114.5040 56.0128 29.6429 175.4938 94 I 4.3636 7.7575 122.6841 60.7390 39.2426 176.1241 95 K 4.3025 8.5711 126.1534 56.3109 32.7476 174.6276 96 Q 4.0343 7.9294 118.2087 55.6406 29.2732 175.3667 97 K 4.6351 8.4640 123.4725 54.7206 34.7869 174.3918 98 F 5.0985 8.9693 125.9130 56.2600 41.3897 175.2490 99 V 5.0848 8.7292 114.6315 60.1754 36.5472 174.0677 100 T 5.3762 9.0451 116.0569 61.1743 71.4999 171.9674 101 C 5.1311 8.5445 117.3334 57.7436 33.4409 172.9313 102 H 4.2760 8.6153 119.9610 55.6766 30.3922 175.9234 103 Y 4.0182 8.1269 123.6149 59.8454 37.7902 178.3404 104 K 3.6852 7.0417 117.6306 57.7768 32.1225 177.1776 105 A 4.2230 7.8279 120.9856 52.5995 19.0964 177.2257 106 I 4.2780 7.6593 118.0900 59.6510 37.3895 173.9133 107 P 4.6035 0.0000 0.0000 64.0980 32.2023 174.9842 108 C 4.5957 7.4478 111.1455 56.9238 32.3611 172.6561 109 L 4.7444 7.6884 118.5786 53.3871 45.2793 177.3995 110 Y 4.3694 8.6684 122.9976 57.1132 36.7788 175.7942 111 K 4.1705 7.4706 124.1528 56.5217 32.6156 175.2847 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 4.33 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 0.72 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 7.94 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 1.78 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 4.33 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 4.32 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 8.22 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 8.54 5.13 0.00 3.21 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 2.95 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 0.00 104 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.