NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 Q 4.2351 8.3401 121.7093 55.7321 30.2901 174.9059 5 A 3.9847 8.5740 128.7887 53.7883 18.9016 177.6837 6 T 4.3692 8.4919 106.1227 62.1347 69.5191 174.8867 *8 K 4.3513 8.1283 123.7379 57.4492 34.4603 177.9512 9 N 4.3153 8.1115 116.4847 56.6143 38.7937 176.9897 10 A 4.0336 7.9383 121.4701 54.8618 18.4062 179.5649 11 A 3.9356 7.8907 119.1466 55.2750 18.6819 179.4621 12 L 3.9400 7.6897 118.8892 57.9082 42.0171 179.2378 13 K 3.9153 8.0301 119.7712 59.5764 32.2603 178.7077 14 Q 3.9437 8.3923 120.2035 58.9990 28.8328 177.9920 15 L 4.0217 7.9736 121.8479 58.1814 42.0891 179.0233 16 T 3.9079 7.9204 109.7915 64.3657 68.8171 176.5357 17 K 3.8536 8.2570 122.6666 59.5131 32.0931 178.3827 18 D 4.3326 8.1861 118.6895 57.3321 40.6680 178.6061 19 A 4.0162 8.2098 121.3123 55.3340 18.2914 179.2656 20 D 4.3266 8.6902 117.7078 57.7645 40.4988 179.0121 21 E 3.9898 8.2078 118.8915 59.5132 29.4206 179.5831 22 I 3.8383 7.6374 120.0157 64.1418 37.1871 178.1543 23 L 3.9855 8.2583 121.5557 58.3742 41.9054 178.4895 24 H 4.1000 8.6227 118.6279 59.0664 29.8865 177.0243 25 L 4.0179 7.6811 121.6867 58.1763 41.8768 179.0568 26 I 3.7426 7.8213 119.7701 64.4395 37.0002 178.6559 27 K 3.9227 8.2324 119.4316 59.2997 31.5812 179.6385 28 V 3.5100 7.4657 117.8684 65.8541 31.7153 177.8761 29 Q 4.0267 7.9050 117.4040 58.9903 28.3898 178.6667 30 L 3.9039 7.7287 118.6128 57.8819 41.7991 178.8033 31 D 4.4066 8.1552 115.8055 53.3175 41.3331 173.2670 32 N 3.8993 7.3411 122.6820 53.0215 39.2963 173.5295 *38 C 4.5914 8.4680 120.7741 59.0486 33.2461 174.0953 39 P 4.1809 0.0000 0.0000 64.8761 31.5586 178.4117 40 L 3.8264 8.0123 120.4002 58.2023 42.5037 177.2111 41 Y 4.4912 7.3184 119.0812 56.7855 38.5029 174.5643 42 E 4.9452 7.8242 119.0029 56.8202 35.9235 176.4762 43 E 4.0057 8.0296 118.2828 59.1447 29.3880 179.2115 44 V 3.4880 7.7392 118.3782 66.1917 31.2594 178.1877 45 L 4.0370 7.7764 116.7113 57.7778 41.6272 178.6255 46 D 4.5896 7.9939 118.0352 57.7702 41.0213 178.7224 47 T 4.1051 8.4517 116.5015 66.5225 68.4222 176.8480 48 Q 4.1843 7.9956 117.5235 57.2226 28.8739 177.4959 *50 F 4.5848 8.0463 122.1771 57.8328 41.5108 177.2323 51 G 3.6325 8.4999 107.2753 47.6946 0.0000 175.4340 52 L 3.9468 8.0374 122.9062 57.8887 42.1547 178.6404 53 Q 3.9056 8.0426 119.0072 59.2360 28.8651 178.5123 54 K 3.8324 7.7750 119.3276 59.4004 32.0195 179.1801 55 E 3.9967 7.9961 118.4700 59.3004 29.2825 179.4436 56 V 3.5791 7.9130 118.2089 66.1852 31.6422 177.5627 57 D 4.3457 8.1421 118.4287 57.4144 40.5952 178.4914 58 F 4.0785 8.2440 120.6934 61.6655 39.3802 177.1996 59 A 3.8650 8.3189 120.0873 54.8896 18.1074 179.8684 60 V 3.9621 7.9741 118.4981 65.6753 31.4352 178.3380 61 K 3.8929 8.1623 117.4068 59.3490 31.9990 178.4861 62 L 4.1957 7.3428 116.1909 54.3872 41.7377 177.6681 63 G 3.8924 7.5645 106.9563 46.1510 0.0000 174.9588 64 L 4.1596 7.7185 121.6424 56.1358 42.1365 177.7497 65 V 4.4572 7.3023 116.8047 60.1468 34.7277 174.2156 66 D 4.6810 8.4116 125.8364 53.8668 42.8846 177.6375 67 R 3.8959 8.5540 122.4949 59.7719 30.2091 178.6377 68 E 4.1543 8.0895 117.2816 58.6793 29.7614 178.6294 69 D 4.4769 8.0255 119.2642 57.1691 40.7340 178.6891 70 G 3.6186 7.9212 105.4964 47.7543 0.0000 175.7291 71 K 4.1685 7.8528 119.8824 59.1556 32.3013 179.2262 72 Q 4.2096 8.1000 118.4053 58.6374 28.7632 178.4457 73 I 3.5385 7.3956 116.2673 62.5761 36.7396 177.2904 *75 L 4.5053 7.6993 122.9898 55.2332 43.8738 178.5066 76 R 3.8879 7.9568 118.1694 59.7967 29.8199 178.4487 77 L 4.1397 7.5760 117.1475 57.7311 41.2265 179.2259 78 E 4.0418 8.1605 118.1523 59.1001 29.5084 179.1386 79 K 3.9494 8.3255 120.0062 59.5364 32.3004 178.5511 80 E 3.8967 7.7772 118.1666 59.1821 29.5021 178.4771 81 L 3.8735 8.3537 120.8649 58.0678 41.9968 179.1357 82 S 4.1402 8.2458 115.2726 61.3991 62.7191 176.4367 83 K 3.7943 7.8118 120.9135 59.5977 31.8552 178.9715 84 L 3.5881 7.6756 120.0605 58.2960 41.9236 178.5683 85 H 4.3515 8.2141 116.4787 58.9630 28.4576 177.2905 86 E 3.9307 8.2636 119.7437 59.2860 29.7700 178.2985 87 A 4.1102 8.2479 121.1036 55.2225 18.3902 179.3788 88 F 4.5369 8.4029 116.6178 61.4828 38.8356 178.0761 89 T 4.0644 7.7994 113.3461 66.1528 68.2282 175.7021 90 L 4.4567 7.6319 119.6322 55.7247 42.4739 176.8901 91 V 3.8528 7.3771 121.0678 61.8271 31.5512 175.7978 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 4 Q 8.34 4.24 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.02 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 5 A 8.57 3.98 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 6 T 8.49 4.37 4.24 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 0.00 0.00 0.00 1.21 0.00 0.00 *8 K 8.13 4.35 0.00 1.86 1.93 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.61 7.81 9 N 8.11 4.32 0.00 2.85 2.80 0.00 0.00 7.01 9.28 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 10 A 7.94 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.89 3.94 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 12 L 7.69 3.94 0.00 1.88 1.68 0.92 0.29 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 13 K 8.03 3.92 0.00 2.13 1.89 0.00 1.69 0.00 0.00 1.57 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.44 7.81 14 Q 8.39 3.94 0.00 2.29 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 15 L 7.97 4.02 0.00 2.10 1.65 0.95 0.77 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 16 T 7.92 3.91 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 1.31 0.00 0.00 17 K 8.26 3.85 0.00 1.95 2.01 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.49 7.81 18 D 8.19 4.33 0.00 2.90 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 19 A 8.21 4.02 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 20 D 8.69 4.33 0.00 2.89 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 8.21 3.99 0.00 2.21 2.02 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 0.00 2.33 2.56 0.00 22 I 7.64 3.84 1.89 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 1.43 0.70 0.94 0.00 0.00 23 L 8.26 3.99 0.00 1.86 1.86 0.92 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.62 4.10 0.00 3.39 3.49 0.00 5.84 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 7.68 4.02 0.00 1.95 1.84 1.03 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 26 I 7.82 3.74 1.99 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 1.54 0.63 0.86 0.00 0.00 27 K 8.23 3.92 0.00 1.73 1.81 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.65 7.81 28 V 7.47 3.51 2.16 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 0.78 0.00 0.00 0.86 0.00 0.00 29 Q 7.91 4.03 0.00 2.30 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.56 0.00 0.00 0.00 0.00 0.00 2.45 2.64 0.00 30 L 7.73 3.90 0.00 1.68 1.67 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.16 4.41 0.00 2.62 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 32 N 7.34 3.90 0.00 2.83 2.78 0.00 0.00 6.84 6.95 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 *38 C 8.47 4.59 0.00 2.94 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.18 0.00 2.17 2.02 0.00 3.61 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.99 0.00 40 L 8.01 3.83 0.00 1.67 1.68 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 41 Y 7.32 4.49 0.00 2.98 2.89 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 42 E 7.82 4.95 0.00 1.93 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 2.53 2.64 0.00 43 E 8.03 4.01 0.00 2.26 1.94 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 2.31 2.29 0.00 44 V 7.74 3.49 1.68 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 0.69 0.00 0.00 0.77 0.00 0.00 45 L 7.78 4.04 0.00 1.91 1.80 1.19 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 46 D 7.99 4.59 0.00 2.86 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 8.45 4.11 4.36 0.00 0.00 0.00 0.00 0.00 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 48 Q 8.00 4.18 0.00 2.43 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.39 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 *50 F 8.05 4.58 0.00 3.27 3.25 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 0.00 51 G 8.50 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.04 3.95 0.00 1.79 1.67 0.92 0.55 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 53 Q 8.04 3.91 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.55 0.00 54 K 7.77 3.83 0.00 1.83 1.70 0.00 1.48 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.92 1.30 7.81 55 E 8.00 4.00 0.00 2.21 2.03 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 2.28 2.49 0.00 56 V 7.91 3.58 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.96 0.00 0.00 57 D 8.14 4.35 0.00 2.74 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.24 4.08 0.00 3.11 3.30 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 0.00 59 A 8.32 3.86 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 60 V 7.97 3.96 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 1.36 0.00 0.00 0.99 0.00 0.00 61 K 8.16 3.89 0.00 1.80 1.78 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.61 7.81 62 L 7.34 4.20 0.00 1.30 1.51 0.05 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 63 G 7.56 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 0.00 0.00 0.00 64 L 7.72 4.16 0.00 1.77 1.71 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 65 V 7.30 4.46 2.07 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 1.04 0.00 0.00 0.93 0.00 0.00 66 D 8.41 4.68 0.00 2.72 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 67 R 8.55 3.90 0.00 1.86 1.92 0.00 3.16 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 68 E 8.09 4.15 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 69 D 8.03 4.48 0.00 2.91 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 70 G 7.92 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.85 4.17 0.00 1.77 1.88 0.00 1.89 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.60 7.81 72 Q 8.10 4.21 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.99 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 73 I 7.40 3.54 2.05 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.92 0.91 0.00 0.00 *75 L 7.70 4.51 0.00 1.97 1.70 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.96 3.89 0.00 2.04 2.07 0.00 3.14 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 77 L 7.58 4.14 0.00 1.86 1.70 1.05 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.16 4.04 0.00 2.15 2.02 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 0.00 2.42 2.39 0.00 79 K 8.33 3.95 0.00 1.96 1.90 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.44 7.81 80 E 7.78 3.90 0.00 2.15 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 2.28 2.31 0.00 81 L 8.35 3.87 0.00 1.86 1.63 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 82 S 8.25 4.14 0.00 4.07 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 83 K 7.81 3.79 0.00 2.03 1.80 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.44 7.81 84 L 7.68 3.59 0.00 1.53 1.55 0.31 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 85 H 8.21 4.35 0.00 3.36 3.38 0.00 5.68 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.26 3.93 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 87 A 8.25 4.11 1.24 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 0.00 0.00 0.00 0.00 0.00 0.00 88 F 8.40 4.54 0.00 3.32 3.02 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 0.00 0.00 0.00 0.00 89 T 7.80 4.06 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 90 L 7.63 4.46 0.00 1.75 1.73 0.93 0.97 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 91 V 7.38 3.85 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 0.81 0.00 0.00 0.97 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.