NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.2073 8.2493 123.5714 52.0709 19.7376 176.5223 1 D 4.6810 7.6309 127.6386 53.1110 40.6994 175.1421 2 A 4.1279 7.6925 121.7193 52.9405 20.4433 178.4874 3 V 4.3681 8.3255 119.6397 61.1591 33.9723 174.6245 4 V 4.6314 8.4175 127.4946 61.9197 33.3440 174.2255 5 T 4.8888 9.0376 125.0775 62.0594 71.0190 173.6042 6 Q 5.3018 8.4135 122.5426 52.5895 33.1446 174.9887 7 E 3.9507 8.6680 120.4657 57.0233 30.1064 177.5121 *9 S 4.6527 8.4386 119.2264 57.8617 64.7866 173.1460 10 A 5.2779 7.7587 119.5652 50.4308 22.7381 174.6042 11 L 4.5996 8.8115 118.4719 53.8514 46.5786 175.0494 12 T 5.0708 8.5273 120.1439 62.4804 70.9217 173.6322 13 T 4.6519 8.6316 118.8300 61.4030 71.5882 171.9882 14 S 4.9886 8.3508 115.5054 55.8696 67.5942 172.4183 15 P 4.4288 0.0000 0.0000 64.5589 31.4127 176.9861 16 G 3.9020 9.1978 112.4144 44.9594 0.0000 173.1872 17 E 4.4592 8.2661 119.9084 55.8037 31.8409 175.0980 18 T 5.1180 8.2553 117.1134 61.8241 70.9739 174.4565 19 V 4.5070 8.4507 125.0282 60.0905 35.1457 174.6618 20 T 4.8532 8.3229 118.3971 61.9099 71.4212 173.1378 21 L 4.7156 8.6585 127.5573 53.5406 43.5144 175.9771 22 T 5.4327 9.2876 112.4934 60.1323 72.7701 172.1944 23 C 5.1217 9.2721 121.8514 55.2731 45.1316 172.9390 24 R 4.8518 9.4366 126.2151 54.9936 32.0800 175.4807 25 S 5.2768 8.5082 116.5385 56.6472 64.3087 174.1173 26 S 4.4885 8.6903 120.7496 59.6721 63.6948 174.7679 27 T 4.2052 7.8731 110.8832 61.7920 68.8402 174.4158 *29 G 4.4052 7.9059 109.7456 45.2695 0.0000 172.0974 30 A 4.2812 8.3759 120.4028 52.5015 19.1695 177.4334 31 V 4.2771 7.8670 119.4703 61.9325 32.6962 176.2041 32 T 4.5519 8.2844 125.6321 62.7160 70.7351 175.4716 33 T 4.0699 8.3185 110.5541 63.2630 69.3176 176.1893 *38 S 4.6873 7.7563 115.1997 58.1573 64.6046 173.7720 39 N 5.0842 7.6901 116.2803 52.5152 38.9656 174.6641 40 Y 3.6858 7.9184 114.3798 58.1237 36.1868 170.8631 41 A 4.2239 7.9741 118.9147 52.7748 19.2379 177.7870 42 S 5.1391 9.1734 118.3255 56.4524 67.2556 173.2467 43 W 5.4075 9.5438 122.6372 55.1635 32.4084 174.9939 44 V 5.0793 9.2644 116.7290 59.7202 35.8036 174.1349 45 Q 4.5219 8.9774 125.0428 54.3527 31.2644 173.9683 46 E 4.4552 8.5264 127.5758 54.3135 31.2294 175.1351 47 K 4.2056 8.5658 127.3444 54.3922 34.1479 175.0807 48 P 4.2590 0.0000 0.0000 64.9634 31.6032 176.0016 49 D 4.6760 8.5635 120.2101 55.6595 39.5643 174.0600 50 H 3.8918 7.8576 109.3992 56.2622 26.4782 174.7054 51 L 4.7469 7.7785 120.9601 53.5404 44.1209 175.7191 52 F 5.3778 8.9971 124.4598 56.1577 41.8917 175.1152 53 T 4.6803 8.8172 117.9679 61.7473 72.6727 173.4517 54 G 3.9592 8.8792 113.5858 46.5311 0.0000 172.0903 55 L 4.7136 9.1499 123.5286 55.7925 44.0362 176.4127 56 I 5.3072 7.7986 118.1635 59.7499 41.8758 174.1663 57 G 4.3393 9.3000 111.6175 44.9965 0.0000 172.5581 58 G 4.0698 8.0933 108.8577 46.8725 0.0000 174.7601 *67 T 4.6411 7.8920 116.1753 62.6145 70.4948 176.8377 68 N 5.0778 7.8534 112.6090 53.0861 39.7339 173.1320 69 N 4.7129 8.3077 118.6070 52.8078 39.8310 174.2443 70 R 4.7324 8.6381 125.2981 55.2421 31.1797 175.8375 71 A 4.2361 8.7513 128.9387 51.5435 19.4826 175.1234 72 P 4.3143 0.0000 0.0000 64.4797 31.6411 176.9890 73 G 3.9350 8.9588 108.9686 45.3132 0.0000 173.3894 74 V 4.0702 7.1908 118.9386 60.8112 32.7874 174.0234 75 P 4.4426 0.0000 0.0000 62.9532 31.7369 177.0007 76 A 4.4194 8.4408 122.1784 53.6527 19.0483 178.9918 77 R 3.9957 7.8794 112.5362 58.0436 30.6221 176.4387 78 F 5.2391 7.4387 117.5096 56.3711 40.5891 175.5923 79 S 4.6324 8.3312 114.3740 57.5860 66.2707 174.4500 80 G 4.5961 8.3464 108.9149 44.9819 0.0000 171.6580 81 S 4.7552 8.7094 114.4333 58.0587 66.9578 173.9661 82 L 5.1021 8.5831 119.2949 53.5351 43.5485 177.6161 83 I 4.3570 8.8005 123.8563 59.5764 38.8440 176.3782 84 G 3.8832 8.5213 118.4817 45.1194 0.0000 172.4966 *87 D 4.9132 8.4720 123.9208 53.6445 43.4796 174.1465 88 K 4.9983 7.7803 117.5614 54.7250 37.3024 174.3577 89 A 5.2889 8.5690 121.9599 50.6936 21.5154 176.0806 90 A 5.2754 9.7808 122.6541 50.0945 23.0924 174.7616 91 L 4.3821 8.2618 124.1946 53.3234 44.1479 175.0934 92 T 4.8158 9.0902 123.9430 61.7961 71.3975 173.3827 93 I 4.2169 8.3406 127.8711 60.1375 38.7863 175.3184 94 T 3.9601 8.7985 126.4622 63.4901 68.5468 175.3721 95 G 3.5270 7.7569 113.9811 44.9490 0.0000 171.7065 96 A 4.0086 8.6257 124.1448 52.8732 19.7897 177.1169 97 Q 4.8406 8.3320 117.3186 53.8947 33.2376 176.7118 98 T 3.8576 8.7753 110.9278 65.1476 68.4593 175.6902 99 E 4.3020 8.1715 115.4321 56.9266 29.3292 176.5851 100 D 4.8112 8.0669 118.4758 54.6019 41.3592 175.9648 101 E 4.3248 8.0366 121.5304 56.8917 30.1738 175.6959 102 A 4.2576 8.2660 127.8696 52.0253 24.1283 173.8570 103 I 4.7175 7.2634 118.1816 60.0950 39.3991 175.0715 104 Y 5.0706 8.9047 124.6820 56.2693 40.7846 174.8609 105 F 5.7192 9.5891 121.3561 55.8660 43.4278 171.5834 106 C 5.2078 9.1624 114.9287 53.4382 44.2252 172.3861 107 A 5.0268 8.6958 122.5048 50.0573 22.0994 174.9528 108 L 5.2202 8.7036 120.8760 52.6513 45.6813 175.4895 109 W 4.2269 9.8468 135.0000 56.7479 31.4143 174.7442 110 Y 4.1754 7.2465 129.4203 57.0022 39.1606 175.6399 111 S 3.8620 8.4276 114.8348 62.2150 63.1780 175.8149 *135 N 4.8154 8.1872 114.6682 51.7473 38.9313 172.9145 136 H 4.8474 6.1933 113.5063 53.9590 32.5209 172.0825 137 W 5.1778 8.7928 118.6186 55.6822 31.1942 176.3630 138 V 4.4489 8.5638 121.8063 61.4970 34.0339 174.8969 139 F 4.8785 9.1090 126.7256 57.2370 40.2227 175.3589 140 G 4.1881 8.9557 109.0431 44.7754 0.0000 174.4831 141 G 3.8868 8.8637 108.0957 46.6898 0.0000 174.9093 142 G 3.4389 9.1064 107.0664 45.8649 0.0000 172.8082 143 T 4.9212 8.5301 118.2106 60.3468 71.5705 173.3158 144 K 4.3906 9.0266 129.2724 55.8870 33.3144 175.1776 145 L 5.0944 9.3823 131.3914 53.9799 43.9457 174.9669 146 T 4.7450 8.7383 123.7271 61.8801 70.8338 173.6843 147 V 4.5814 8.8375 127.4563 61.2020 32.8271 175.4794 148 L 4.3416 8.5136 127.5894 54.8860 41.2545 176.9911 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 0 A 8.25 4.21 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 1 D 7.63 4.68 0.00 2.77 2.62 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 2 A 7.69 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.33 4.37 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 0.95 0.00 0.00 0.92 0.00 0.00 4 V 8.42 4.63 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.18 0.00 0.00 5 T 9.04 4.89 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 1.26 0.00 0.00 6 Q 8.41 5.30 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.92 0.00 0.00 0.00 0.00 0.00 2.55 2.30 0.00 7 E 8.67 3.95 0.00 2.12 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 2.43 2.43 0.00 *9 S 8.44 4.65 0.00 3.82 3.93 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 10 A 7.76 5.28 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 11 L 8.81 4.60 0.00 1.61 1.50 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.53 5.07 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 1.21 0.00 0.00 13 T 8.63 4.65 4.20 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 0.00 0.00 0.00 1.18 0.00 0.00 14 S 8.35 4.99 0.00 3.73 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.43 0.00 2.02 1.99 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 16 G 9.20 3.90 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 0.00 0.00 0.00 17 E 8.27 4.46 0.00 1.99 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 2.33 2.40 0.00 18 T 8.26 5.12 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 1.13 0.00 0.00 19 V 8.45 4.51 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 0.62 0.00 0.00 0.83 0.00 0.00 20 T 8.32 4.85 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 1.14 0.00 0.00 21 L 8.66 4.72 0.00 1.15 1.58 0.74 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 22 T 9.29 5.43 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 1.26 0.00 0.00 23 C 9.27 5.12 0.00 3.01 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 24 R 9.44 4.85 0.00 1.82 1.87 0.00 3.17 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 25 S 8.51 5.28 0.00 3.92 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.69 4.49 0.00 3.91 3.99 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.87 4.21 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 1.28 0.00 0.00 *29 G 7.91 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.38 4.28 1.31 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 0.00 0.00 0.00 31 V 7.87 4.28 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 0.80 0.00 0.00 1.01 0.00 0.00 32 T 8.28 4.55 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 1.19 0.00 0.00 33 T 8.32 4.07 4.08 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 0.00 0.00 0.00 1.16 0.00 0.00 *38 S 7.76 4.69 0.00 4.11 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 39 N 7.69 5.08 0.00 3.00 2.80 0.00 0.00 7.34 7.36 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 40 Y 7.92 3.69 0.00 3.15 3.28 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 41 A 7.97 4.22 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 42 S 9.17 5.14 0.00 3.46 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 43 W 9.54 5.41 0.00 3.27 3.22 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 0.00 0.00 0.00 0.00 44 V 9.26 5.08 2.42 0.00 0.00 0.00 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 1.32 0.00 0.00 45 Q 8.98 4.52 0.00 1.73 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 1.95 1.59 0.00 46 E 8.53 4.46 0.00 1.20 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.47 0.00 47 K 8.57 4.21 0.00 1.61 1.62 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.49 7.81 48 P 0.00 4.26 0.00 2.00 1.99 0.00 3.60 0.00 0.00 3.49 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 49 D 8.56 4.68 0.00 2.71 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 50 H 7.86 3.89 0.00 3.28 3.43 0.00 5.92 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.78 4.75 0.00 1.82 1.45 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 52 F 9.00 5.38 0.00 2.82 2.91 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 53 T 8.82 4.68 4.19 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 0.00 0.00 0.00 1.18 0.00 0.00 54 G 8.88 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 9.15 4.71 0.00 1.87 1.62 0.89 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 56 I 7.80 5.31 2.27 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.09 1.18 0.00 0.00 57 G 9.30 4.34 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 0.00 0.00 0.00 58 G 8.09 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 T 7.89 4.64 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 68 N 7.85 5.08 0.00 2.73 2.96 0.00 0.00 6.02 8.04 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 69 N 8.31 4.71 0.00 2.96 2.84 0.00 0.00 6.65 8.94 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 70 R 8.64 4.73 0.00 1.88 1.88 0.00 3.31 0.00 0.00 3.61 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 71 A 8.75 4.24 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 72 P 0.00 4.31 0.00 2.20 2.10 0.00 3.80 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 2.00 1.99 0.00 73 G 8.96 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 74 V 7.19 4.07 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 0.82 0.00 0.00 0.98 0.00 0.00 75 P 0.00 4.44 0.00 2.59 2.09 0.00 3.82 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.21 0.00 76 A 8.44 4.42 1.29 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 77 R 7.88 4.00 0.00 1.85 2.02 0.00 2.49 0.00 0.00 3.01 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.85 0.00 78 F 7.44 5.24 0.00 3.02 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 79 S 8.33 4.63 0.00 3.82 3.90 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 80 G 8.35 4.60 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 0.00 0.00 0.00 81 S 8.71 4.76 0.00 3.85 3.97 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 0.00 0.00 0.00 82 L 8.58 5.10 0.00 1.56 1.64 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.80 4.36 1.90 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 1.17 0.56 0.92 0.00 0.00 84 G 8.52 3.88 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 0.00 0.00 0.00 *87 D 8.47 4.91 0.00 2.70 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 88 K 7.78 5.00 0.00 1.73 1.89 0.00 1.72 0.00 0.00 1.88 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.46 7.81 89 A 8.57 5.29 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.78 5.28 1.19 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 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.26 4.38 0.00 0.27 0.13 0.69 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 92 T 9.09 4.82 4.14 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 0.00 0.00 1.16 0.00 0.00 93 I 8.34 4.22 1.63 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.42 0.40 0.00 0.00 94 T 8.80 3.96 4.14 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 0.00 0.00 1.14 0.00 0.00 95 G 7.76 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.63 4.01 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 97 Q 8.33 4.84 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.67 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 98 T 8.78 3.86 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 1.21 0.00 0.00 99 E 8.17 4.30 0.00 2.13 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 0.00 2.34 2.32 0.00 100 D 8.07 4.81 0.00 2.93 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 0.00 101 E 8.04 4.32 0.00 2.01 1.89 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 2.33 2.60 0.00 102 A 8.27 4.26 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.26 4.72 1.59 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.64 0.35 0.00 0.00 104 Y 8.90 5.07 0.00 2.98 3.05 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 0.00 105 F 9.59 5.72 0.00 3.10 3.06 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 0.00 106 C 9.16 5.21 0.00 1.94 1.31 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 0.00 107 A 8.70 5.03 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.70 5.22 0.00 1.73 1.48 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 109 W 9.85 4.23 0.00 1.78 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 0.00 110 Y 7.25 4.18 0.00 2.32 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.43 3.86 0.00 3.89 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 *135 N 8.19 4.82 0.00 2.79 2.94 0.00 0.00 6.15 7.90 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 0.00 136 H 6.19 4.85 0.00 3.10 3.22 0.00 5.44 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 W 8.79 5.18 0.00 3.24 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 0.00 138 V 8.56 4.45 2.30 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 1.03 0.00 0.00 0.94 0.00 0.00 139 F 9.11 4.88 0.00 2.97 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 0.00 140 G 8.96 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.86 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 0.00 142 G 9.11 3.44 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 0.00 0.00 0.00 0.00 143 T 8.53 4.92 4.35 0.00 0.00 0.00 0.00 0.00 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 0.00 144 K 9.03 4.39 0.00 1.86 1.70 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.43 7.81 145 L 9.38 5.09 0.00 1.87 1.97 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 146 T 8.74 4.75 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 1.29 0.00 0.00 147 V 8.84 4.58 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 0.99 0.00 0.00 148 L 8.51 4.34 0.00 1.57 1.55 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.