NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 I 3.9165 8.0249 121.4185 61.0986 37.8158 174.9796 6 K 4.1534 8.2948 126.2866 53.0595 32.6483 173.9131 7 P 4.1994 0.0000 0.0000 62.8173 32.8531 176.5866 8 L 4.1838 8.9176 122.6868 54.5575 42.5108 176.4137 9 E 3.6685 7.7594 117.4455 57.1905 29.2382 175.4198 10 D 4.8979 9.1196 123.3363 53.6572 41.2754 174.5067 11 K 4.8423 7.7424 117.7077 55.8587 33.8288 176.1989 12 I 4.8154 8.7064 115.1424 59.1477 41.7798 173.8740 13 L 4.8816 8.7025 126.3937 53.7588 43.5502 175.2648 14 V 4.6720 8.7026 127.1914 61.3504 34.4915 174.1016 15 Q 5.1166 8.9864 127.6478 54.2945 30.4917 175.0883 16 A 4.5380 8.4676 128.7392 52.2023 19.4125 176.6868 *22 T 4.2224 8.1830 114.7717 63.8053 69.8670 173.9542 23 T 4.5716 8.1289 120.2500 61.3976 70.9257 175.4841 24 A 4.0632 8.6386 127.4340 54.1625 18.5801 178.3167 25 S 4.2886 7.7515 109.7441 59.2284 62.9447 174.5134 26 G 4.2898 8.2548 109.4883 45.4367 0.0000 173.1379 27 L 4.7373 8.0115 118.3180 52.3483 44.7432 175.5816 28 V 4.4436 8.2604 121.4164 61.2486 32.6535 175.3896 29 I 4.2735 8.0004 128.4895 58.8192 37.1301 173.8398 30 P 4.0925 0.0000 0.0000 63.6518 31.2949 175.0117 *37 P 4.1225 0.0000 0.0000 62.4230 31.8480 175.4540 38 Q 4.4043 7.7799 124.0059 53.9444 31.5208 173.4516 39 E 4.8236 7.8208 121.2873 54.3905 32.8459 174.5246 40 G 4.1760 8.2106 108.7032 46.8096 0.0000 171.5656 41 T 5.1650 7.7316 115.7834 61.3748 71.2397 174.4491 42 V 3.9101 9.2372 127.1972 63.4096 31.6250 176.2644 43 V 3.5395 8.4267 128.9382 64.5427 32.4645 175.8368 44 A 4.7384 7.5786 119.9767 50.5597 22.5756 175.2975 45 V 4.5163 8.1501 118.8553 61.2634 35.0969 175.2712 46 G 3.9364 8.2432 113.7571 44.4561 0.0000 172.0631 47 P 4.2460 0.0000 0.0000 65.7262 31.3594 176.6715 48 G 4.0138 7.8906 101.1941 44.2607 0.0000 173.2982 49 R 4.0674 8.3548 118.3906 55.2729 30.5923 177.1242 50 W 4.1938 8.7620 125.0704 57.0052 30.0522 176.3414 51 D 4.7135 9.5762 120.6678 53.1723 39.8710 178.5770 52 E 4.1235 8.8742 120.5969 60.9760 29.5723 179.3318 53 D 4.4058 8.1185 116.2306 54.0807 40.1404 180.7818 54 G 4.0154 8.2126 104.7592 45.9487 0.0000 174.4331 55 E 4.2050 8.4015 117.8871 58.6996 29.6666 176.7196 56 K 4.8102 7.9619 117.1053 55.0993 36.6639 174.1133 57 R 4.6058 7.7101 118.3559 54.2350 32.5064 176.2796 58 I 4.0454 8.0915 123.4724 60.0587 38.1064 174.3083 59 P 4.3904 0.0000 0.0000 62.1359 32.0649 176.1035 60 L 4.4221 8.0678 120.6024 54.4951 42.7041 176.2477 61 D 4.8552 8.4565 119.8611 54.2832 41.0354 176.6391 62 V 4.5164 7.5008 110.9027 59.6904 35.4652 174.2341 63 A 4.6851 9.5599 123.6342 50.2406 22.3999 175.6233 64 E 4.3245 8.5656 118.6997 58.3780 29.8432 178.3408 65 G 4.0747 9.4995 111.4848 45.6121 0.0000 173.9481 66 D 4.4573 7.9542 120.6541 54.8368 42.1371 175.4305 67 T 4.7511 8.5676 118.2315 61.2958 68.7776 173.7180 68 V 5.0867 9.4560 122.3406 59.6644 36.2561 174.4422 69 I 4.8503 8.6229 123.8635 59.9061 39.3867 174.6398 70 Y 5.5378 8.0729 124.4152 55.7789 42.0975 173.8063 71 S 5.0579 8.6474 113.8324 56.8302 65.3896 174.5840 72 K 4.4860 8.4650 119.1590 56.4834 32.4697 176.4162 73 Y 4.3760 7.9141 117.2928 59.7977 38.0456 177.1801 74 G 3.9778 9.2019 111.1029 45.6606 0.0000 173.9432 75 G 3.8354 7.8875 106.7707 46.8312 0.0000 174.3016 76 T 4.6350 8.2039 116.4400 61.3073 71.3335 172.5522 77 E 4.9134 8.7286 127.7312 55.8471 30.8271 175.7813 78 I 4.7564 8.8488 119.3137 59.5657 41.2351 173.9412 79 K 5.0922 8.6782 124.4269 55.2965 34.7777 175.7509 80 Y 4.4954 9.3212 123.9903 57.8296 41.3848 174.6143 81 N 4.0035 9.4566 127.1369 54.2865 35.9998 175.3087 82 G 3.9825 8.2841 105.9254 45.2603 0.0000 173.5935 83 E 4.2476 7.5761 119.1618 54.8857 31.1050 174.3894 84 E 4.7203 8.1422 122.9274 54.8994 31.6401 174.3255 85 Y 5.4136 9.0095 124.7496 56.3845 41.8651 174.7746 86 L 5.1607 8.9028 119.9359 53.3364 46.3925 175.8462 87 I 4.7635 8.6526 125.2632 59.7724 38.3891 174.5850 88 L 5.0501 8.3750 127.4637 53.3448 43.9419 176.4086 89 S 4.4346 8.6343 114.3432 57.8286 63.3227 174.8470 90 A 3.9783 8.4028 128.6448 55.4408 18.2242 180.2259 91 R 3.9817 7.9728 113.9691 58.9694 30.4616 177.5988 92 D 4.5438 8.3424 117.9638 55.9357 41.3461 176.4223 93 V 4.1631 7.7886 119.6765 62.6761 31.4920 175.2141 94 L 4.5345 8.7348 127.9314 56.8020 42.8236 176.5493 95 A 4.5974 7.6354 117.7176 51.3039 22.6347 175.4219 96 V 4.7929 8.3708 111.7148 59.6579 34.9493 176.8660 97 V 3.9908 8.2941 115.8230 61.6095 31.7559 175.8207 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 I 8.02 3.92 1.63 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.84 0.79 0.00 0.00 6 K 8.29 4.15 0.00 1.75 1.71 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.46 7.81 7 P 0.00 4.20 0.00 2.03 1.94 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 8 L 8.92 4.18 0.00 1.75 1.58 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 9 E 7.76 3.67 0.00 2.21 2.01 0.00 0.00 0.00 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 2.38 0.00 10 D 9.12 4.90 0.00 2.86 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 11 K 7.74 4.84 0.00 1.71 1.67 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.62 1.51 7.81 12 I 8.71 4.82 1.93 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.77 0.87 0.00 0.00 13 L 8.70 4.88 0.00 1.66 1.46 0.79 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 14 V 8.70 4.67 1.80 0.00 0.00 0.00 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 0.67 0.00 0.00 15 Q 8.99 5.12 0.00 2.54 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.66 0.00 0.00 0.00 0.00 0.00 2.24 2.00 0.00 16 A 8.47 4.54 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *22 T 8.18 4.22 4.23 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 0.00 0.00 0.00 1.25 0.00 0.00 23 T 8.13 4.57 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 24 A 8.64 4.06 1.28 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 0.00 0.00 0.00 25 S 7.75 4.29 0.00 4.20 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 26 G 8.25 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.01 4.74 0.00 1.65 1.51 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.26 4.44 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 0.81 0.00 0.00 0.92 0.00 0.00 29 I 8.00 4.27 1.82 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 1.37 0.73 0.93 0.00 0.00 30 P 0.00 4.09 0.00 2.03 2.10 0.00 3.69 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 *37 P 0.00 4.12 0.00 1.99 2.00 0.00 3.57 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.07 0.00 38 Q 7.78 4.40 0.00 1.81 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.65 0.00 0.00 0.00 0.00 0.00 2.15 2.17 0.00 39 E 7.82 4.82 0.00 1.91 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.40 0.00 40 G 8.21 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.73 5.16 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 42 V 9.24 3.91 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.96 0.00 0.00 43 V 8.43 3.54 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 1.11 0.00 0.00 44 A 7.58 4.74 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 V 8.15 4.52 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 0.79 0.00 0.00 0.95 0.00 0.00 46 G 8.24 3.94 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 0.00 0.00 0.00 47 P 0.00 4.25 0.00 1.94 2.01 0.00 3.71 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.03 0.00 48 G 7.89 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 R 8.35 4.07 0.00 1.87 1.90 0.00 3.14 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.62 0.00 50 W 8.76 4.19 0.00 3.44 3.34 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.58 4.71 0.00 2.56 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.87 4.12 0.00 1.98 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 0.00 2.35 2.28 0.00 53 D 8.12 4.41 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.21 4.02 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 0.00 0.00 0.00 55 E 8.40 4.20 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 56 K 7.96 4.81 0.00 1.72 1.96 0.00 1.45 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.46 7.81 57 R 7.71 4.61 0.00 1.20 1.35 0.00 2.63 0.00 0.00 2.73 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 58 I 8.09 4.05 1.80 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.01 0.87 0.00 0.00 59 P 0.00 4.39 0.00 1.99 1.91 0.00 3.61 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 60 L 8.07 4.42 0.00 1.60 1.56 0.88 0.99 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 61 D 8.46 4.86 0.00 2.65 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.50 4.52 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 0.74 0.00 0.00 0.92 0.00 0.00 63 A 9.56 4.69 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.57 4.32 0.00 1.96 1.92 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 2.30 2.32 0.00 65 G 9.50 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 66 D 7.95 4.46 0.00 2.80 2.63 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 67 T 8.57 4.75 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 68 V 9.46 5.09 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.14 0.00 0.00 69 I 8.62 4.85 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.70 0.85 0.00 0.00 70 Y 8.07 5.54 0.00 3.20 3.07 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 71 S 8.65 5.06 0.00 4.13 4.05 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 0.00 0.00 0.00 0.00 72 K 8.47 4.49 0.00 1.77 1.92 0.00 1.65 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.64 1.44 7.81 73 Y 7.91 4.38 0.00 2.98 2.90 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 0.00 0.00 0.00 74 G 9.20 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.89 3.84 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 0.00 0.00 0.00 76 T 8.20 4.64 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 1.23 0.00 0.00 77 E 8.73 4.91 0.00 2.01 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 78 I 8.85 4.76 1.93 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 1.36 1.13 0.99 0.00 0.00 79 K 8.68 5.09 0.00 1.69 1.77 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.66 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.43 7.81 80 Y 9.32 4.50 0.00 3.09 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 N 9.46 4.00 0.00 2.30 2.58 0.00 0.00 7.32 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.28 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.58 4.25 0.00 1.97 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 0.00 0.00 0.00 2.23 2.47 0.00 84 E 8.14 4.72 0.00 1.94 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 85 Y 9.01 5.41 0.00 3.19 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 86 L 8.90 5.16 0.00 1.52 1.44 1.02 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.65 4.76 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.93 0.88 0.00 0.00 88 L 8.38 5.05 0.00 1.87 1.68 0.61 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.63 4.43 0.00 3.88 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 90 A 8.40 3.98 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.97 3.98 0.00 1.83 2.03 0.00 3.16 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 92 D 8.34 4.54 0.00 2.89 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 7.79 4.16 2.11 0.00 0.00 0.00 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 0.93 0.00 0.00 94 L 8.73 4.53 0.00 1.65 1.73 0.95 0.83 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 95 A 7.64 4.60 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.37 4.79 2.10 0.00 0.00 0.00 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 0.94 0.00 0.00 97 V 8.29 3.99 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 0.66 0.00 0.00 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.