NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 V 3.9469 8.0431 120.3916 63.8579 32.5609 174.7605 20 G 3.6111 8.7816 114.8153 46.1125 0.0000 172.2494 21 G 3.8253 8.7848 109.9458 44.4830 0.0000 172.4587 22 T 3.9253 8.3507 115.6464 64.3264 68.9135 174.6243 23 R 4.2188 8.1936 126.2174 55.7862 31.8589 176.0524 24 S 4.5628 8.5824 117.9022 57.9202 63.3604 174.9774 25 A 3.7009 8.7497 129.4268 54.3284 18.0787 178.8978 26 F 4.9821 7.7447 112.0096 56.9584 39.5670 175.6866 27 S 4.8318 7.1361 115.6490 56.0093 65.6809 173.8763 28 N 4.1458 8.4304 119.3191 54.1087 39.1525 174.3887 29 I 4.1678 8.2693 124.3297 59.3440 39.2492 175.1826 30 Q 4.5525 8.5914 126.9195 55.7113 29.1168 177.7297 31 A 4.4594 9.1934 127.8624 55.1249 18.6662 178.3959 32 E 4.4565 8.3480 111.9126 58.1620 30.1966 176.4156 33 D 4.7713 8.0862 120.6742 54.4509 41.2990 176.2949 34 Y 4.0851 7.4082 116.0968 56.8297 39.2648 174.7139 35 D 4.8161 8.7867 121.3079 56.0922 42.2654 176.5091 36 S 4.8965 7.7739 111.2857 57.7048 66.6084 173.0849 37 S 4.8183 8.1826 112.8466 57.7388 65.4646 173.5604 38 Y 4.3014 8.6580 122.5245 56.0514 41.1585 174.5326 39 G 3.0591 7.1136 115.8840 44.8832 0.0000 171.0870 40 P 4.1567 0.0000 0.0000 64.6562 31.6810 177.3224 41 N 4.8223 8.0076 112.7520 52.5302 39.3105 174.6236 42 L 4.5392 7.6611 122.0489 55.4860 42.7019 176.2114 43 Q 4.8844 9.3438 124.1528 54.2483 32.9423 174.2249 44 I 4.9724 8.4520 122.4786 60.1677 38.8463 175.0518 45 F 5.0971 8.2307 120.1564 55.3861 41.7154 173.7937 46 S 4.7928 8.8878 116.0400 58.5132 63.8670 173.8969 47 L 4.7597 8.7399 123.6725 52.6632 43.1573 176.2614 48 P 4.2810 0.0000 0.0000 65.6062 31.3725 177.7401 49 G 3.8145 7.8927 103.9316 44.9881 0.0000 173.0653 50 G 4.0283 8.4572 107.3108 45.0816 0.0000 176.2325 51 G 3.8690 8.8539 109.6893 44.6618 0.0000 172.2438 52 S 5.1477 8.2464 112.8194 56.9346 67.4655 173.0404 53 A 4.8957 8.2651 122.0026 50.2531 23.0519 175.0093 54 I 4.7385 8.2885 112.6631 60.3462 40.2327 175.8786 55 G 4.4330 9.1982 109.0366 48.2267 0.0000 172.3561 56 Y 3.7269 7.8945 113.8710 58.9815 35.2299 170.5506 57 I 4.0711 7.2560 118.4251 60.5027 38.8034 175.1690 58 E 4.3532 6.4309 121.1792 53.5822 33.3098 174.7054 59 N 4.5722 8.4684 118.5029 55.7699 39.0514 175.1430 60 G 4.1287 9.1136 114.3799 45.3263 0.0000 173.1915 61 Y 5.0820 8.2063 117.9323 58.6436 39.3582 175.0091 62 S 5.3579 9.2487 115.1308 57.6618 67.0596 173.0584 63 T 4.9140 8.9013 110.5899 60.2406 72.2168 172.6646 64 T 5.0549 8.6225 120.4862 62.0115 71.9718 172.7225 65 Y 5.0760 9.3118 123.6807 56.1580 40.5666 175.2624 66 K 4.5713 9.6690 124.8614 56.0628 32.7647 176.9768 67 N 4.1712 8.8871 118.2673 54.4306 36.4299 174.6681 68 I 4.3638 8.1700 119.5402 60.2661 38.6782 175.4798 69 D 4.9988 8.9584 126.2630 53.1933 40.6373 176.4706 70 F 4.1604 9.5748 126.2963 56.9035 40.6398 177.5087 71 G 3.7954 8.4294 111.5542 47.2876 0.0000 174.9061 72 D 4.7431 10.0531 124.6740 52.0562 39.5809 174.8030 73 G 4.4387 7.2696 103.8743 44.1117 0.0000 173.2628 74 A 5.1515 8.4991 123.9787 50.0260 23.0731 176.1603 75 T 4.7396 8.9111 108.1908 59.9968 71.0386 173.0541 76 S 5.3021 8.2101 115.7318 57.3185 66.3422 172.8555 77 V 4.8665 8.9793 123.9476 60.1949 34.8716 174.4099 78 T 5.1692 8.9620 118.7645 61.8196 72.2514 172.7681 79 A 5.0272 9.0245 127.0770 50.0546 22.8196 174.9206 80 R 4.4995 8.0418 122.3514 55.0072 31.0908 175.6468 81 V 5.2242 8.7581 118.9679 59.8417 36.8862 174.3893 82 A 4.6549 8.4501 122.7938 50.7974 22.5251 175.1562 83 T 3.7395 8.2647 114.2545 61.7245 71.2439 173.7469 84 Q 4.2264 7.5962 121.9165 55.8439 29.9171 175.6181 85 N 5.0577 7.4762 113.6641 50.9919 42.9089 174.3777 86 A 4.3131 8.6046 124.2352 53.3976 19.2160 176.4226 87 T 4.7220 8.9284 115.6094 61.4084 72.0704 171.9609 88 T 5.0164 8.3621 111.4517 59.7793 72.8231 173.0354 89 I 4.6225 8.3064 123.4651 59.5822 40.2280 174.8918 90 Q 4.4626 8.7242 127.3377 55.4784 30.3108 175.4570 91 V 4.6116 8.7145 123.8893 61.4585 33.3631 174.6920 92 R 5.1557 9.0211 126.8993 54.1884 34.5429 174.3614 93 L 4.5018 8.8003 124.1938 55.6270 42.8561 176.3587 94 G 4.2258 10.4729 120.4536 45.2687 0.0000 173.2044 95 S 4.7007 7.2943 112.4476 55.4341 66.0402 172.9938 96 P 4.2125 0.0000 0.0000 64.8472 31.0940 177.6334 97 S 4.5847 7.4793 110.3209 57.7899 63.0864 174.3837 98 G 4.2342 7.6823 109.2465 45.1890 0.0000 173.6857 99 T 3.9993 8.4483 115.6616 64.0891 69.4982 173.5816 100 L 4.3694 8.4456 128.3134 54.7558 42.1038 176.1836 101 L 4.2035 9.2244 128.3620 56.8962 43.1595 177.0639 102 G 4.3348 7.2067 103.9609 46.4225 0.0000 172.1858 103 T 4.9508 8.4127 115.5985 61.6525 71.7433 174.0191 104 I 4.1691 8.6766 128.4228 60.6553 38.7163 174.4922 105 Y 4.4958 8.6793 125.2836 56.9598 39.0266 175.4501 106 V 4.1735 8.8810 125.9581 60.8438 33.0027 175.3088 107 G 4.2250 8.4694 114.9915 45.1351 0.0000 171.0341 108 S 4.3851 8.5074 115.2052 58.5382 62.7133 173.8840 109 T 4.2490 8.5673 116.1215 61.1863 68.8627 175.2827 110 G 4.0009 9.8085 112.3391 46.0171 0.0000 174.0589 111 S 4.4070 7.0053 110.6836 57.0798 64.9226 175.5410 112 F 4.2094 8.7052 124.9074 59.6390 38.7125 175.6060 113 D 4.8591 8.1585 119.2064 54.2560 41.2936 175.9710 114 T 4.5537 7.5309 117.1834 62.2107 69.6222 173.4761 115 Y 4.7382 8.6903 124.4285 56.6053 39.8168 175.5433 116 R 4.7694 8.9019 121.1933 54.6861 35.3657 173.5883 117 D 5.1192 8.6004 120.7198 53.4650 42.1192 176.5014 118 V 4.6295 8.7088 116.0770 59.6911 35.6017 174.8662 119 S 5.3895 8.6217 117.7729 57.1765 66.9597 172.9610 120 A 4.7922 8.7802 121.6835 50.9751 22.8108 176.0353 121 T 4.6933 8.5853 116.7156 63.5334 69.1277 174.1629 122 I 4.9495 8.5284 117.6202 58.7397 41.3294 174.9718 123 S 4.2266 8.7515 119.8886 58.6939 63.2474 174.0255 124 N 4.5285 8.8960 121.6487 54.8561 39.8640 173.4014 125 T 4.7330 8.7271 122.1996 61.6296 71.7121 173.0397 126 A 4.8901 8.0471 126.4836 51.4267 23.1237 177.0302 127 G 3.7142 9.1468 107.5527 44.9113 0.0000 171.8728 128 V 4.8629 8.2761 119.7256 61.5385 32.5339 176.7107 129 K 4.8020 9.2224 126.9625 54.6638 36.7538 175.0784 130 D 5.2130 8.6709 122.6780 53.8318 42.6219 175.2869 131 I 5.0478 9.0230 124.2572 59.4915 40.4153 174.6393 132 V 4.9653 8.9484 126.5500 61.1240 34.5442 173.9709 133 L 4.7747 8.9674 128.1614 53.2539 43.5702 175.4804 134 V 4.5565 8.2437 124.2336 61.0003 34.0673 174.0829 135 F 5.1335 9.0680 127.5098 56.3811 40.4124 176.6649 136 S 4.4827 8.6005 116.9765 58.7285 64.0191 173.6064 137 G 3.9871 7.5854 105.7069 45.3126 0.0000 171.0212 138 P 4.6377 0.0000 0.0000 62.4034 31.5946 176.8109 139 V 4.6598 8.0526 121.0035 61.0464 33.7357 171.9835 140 N 5.3165 9.2345 120.5942 51.6925 41.5711 173.9050 141 V 4.6371 8.6504 122.2529 61.6910 34.2825 175.1351 142 D 4.4701 9.4036 128.9195 56.0142 42.0372 175.7559 143 W 5.8698 7.3072 113.1574 55.8443 31.7447 172.2466 144 F 5.8145 9.1396 114.7411 56.0024 41.2467 173.5793 145 V 4.4597 8.7394 117.7864 60.7622 34.8196 172.8510 146 F 5.4974 8.8817 121.0419 56.3081 42.5263 174.4062 147 S 5.0288 8.9295 113.8593 57.3421 66.8327 173.4970 148 K 4.6881 8.8226 120.5543 56.0898 32.6010 177.2947 149 S 4.0564 9.0657 122.7121 58.6294 63.3052 174.9048 *150 G 3.7020 8.6237 113.1437 45.7956 0.0000 172.0974 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 19 V 8.04 3.95 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 0.96 0.00 0.00 0.92 0.00 0.00 20 G 8.78 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.78 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.35 3.93 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 1.27 0.00 0.00 23 R 8.19 4.22 0.00 1.96 1.79 0.00 3.14 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 24 S 8.58 4.56 0.00 3.93 3.71 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 25 A 8.75 3.70 -0.15 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 0.00 0.00 26 F 7.74 4.98 0.00 3.02 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 27 S 7.14 4.83 0.00 3.75 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 28 N 8.43 4.15 0.00 2.14 2.24 0.00 0.00 6.85 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 I 8.27 4.17 0.56 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.60 0.56 0.00 0.00 30 Q 8.59 4.55 0.00 2.20 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.33 0.00 31 A 9.19 4.46 1.58 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 0.00 0.00 32 E 8.35 4.46 0.00 2.13 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 0.00 2.29 2.27 0.00 33 D 8.09 4.77 0.00 3.05 2.82 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 34 Y 7.41 4.09 0.00 2.75 2.37 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 0.00 35 D 8.79 4.82 0.00 2.55 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 36 S 7.77 4.90 0.00 3.87 3.95 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 37 S 8.18 4.82 0.00 3.60 3.18 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 38 Y 8.66 4.30 0.00 3.07 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 39 G 7.11 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 0.00 0.00 0.00 40 P 0.00 4.16 0.00 1.99 2.02 0.00 2.98 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.75 0.00 41 N 8.01 4.82 0.00 2.90 2.90 0.00 0.00 6.95 7.33 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 42 L 7.66 4.54 0.00 1.70 1.60 0.82 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 9.34 4.88 0.00 2.30 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.60 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 44 I 8.45 4.97 1.92 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 1.53 0.70 0.89 0.00 0.00 45 F 8.23 5.10 0.00 3.12 3.19 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 46 S 8.89 4.79 0.00 3.87 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 47 L 8.74 4.76 0.00 1.83 1.53 0.60 1.21 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 48 P 0.00 4.28 0.00 2.09 2.16 0.00 3.76 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 49 G 7.89 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.46 4.03 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 0.00 0.00 0.00 51 G 8.85 3.87 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 0.00 52 S 8.25 5.15 0.00 3.82 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.27 4.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 I 8.29 4.74 1.93 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.82 1.14 0.00 0.00 55 G 9.20 4.43 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 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 7.89 3.73 0.00 3.26 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 57 I 7.26 4.07 1.73 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.11 0.55 0.00 0.00 58 E 6.43 4.35 0.00 1.16 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.95 0.00 59 N 8.47 4.57 0.00 2.77 2.76 0.00 0.00 7.19 7.98 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 60 G 9.11 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 8.21 5.08 0.00 3.20 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.25 5.36 0.00 3.93 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 63 T 8.90 4.91 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 0.82 0.00 0.00 64 T 8.62 5.05 4.22 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 1.25 0.00 0.00 65 Y 9.31 5.08 0.00 3.19 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 66 K 9.67 4.57 0.00 1.74 1.79 0.00 1.88 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.52 1.46 7.81 67 N 8.89 4.17 0.00 2.95 2.89 0.00 0.00 7.06 6.84 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 68 I 8.17 4.36 2.11 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.18 0.49 0.00 0.00 69 D 8.96 5.00 0.00 2.64 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.57 4.16 0.00 3.22 3.16 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 0.00 0.00 0.00 0.00 71 G 8.43 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 10.05 4.74 0.00 2.83 2.80 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 0.00 0.00 0.00 0.00 73 G 7.27 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 0.00 0.00 0.00 0.00 74 A 8.50 5.15 1.44 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 75 T 8.91 4.74 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 1.27 0.00 0.00 76 S 8.21 5.30 0.00 3.97 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 77 V 8.98 4.87 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 0.76 0.00 0.00 0.54 0.00 0.00 78 T 8.96 5.17 4.39 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 1.33 0.00 0.00 79 A 9.02 5.03 1.15 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 0.00 0.00 80 R 8.04 4.50 0.00 0.67 0.66 0.00 2.92 0.00 0.00 2.85 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.38 0.00 81 V 8.76 5.22 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 0.66 0.00 0.00 0.90 0.00 0.00 82 A 8.45 4.65 0.33 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 83 T 8.26 3.74 4.11 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 0.00 0.00 0.00 1.11 0.00 0.00 84 Q 7.60 4.23 0.00 1.67 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.46 0.00 0.00 0.00 0.00 0.00 1.95 1.52 0.00 85 N 7.48 5.06 0.00 2.51 2.62 0.00 0.00 6.88 7.23 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 86 A 8.60 4.31 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 87 T 8.93 4.72 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 1.22 0.00 0.00 88 T 8.36 5.02 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 0.85 0.00 0.00 89 I 8.31 4.62 1.75 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.70 0.55 0.00 0.00 90 Q 8.72 4.46 0.00 1.88 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.18 0.00 91 V 8.71 4.61 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 1.22 0.00 0.00 0.90 0.00 0.00 92 R 9.02 5.16 0.00 1.71 1.74 0.00 3.16 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.47 0.00 93 L 8.80 4.50 0.00 1.69 1.50 0.88 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 94 G 10.47 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 0.00 0.00 0.00 0.00 95 S 7.29 4.70 0.00 3.95 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 96 P 0.00 4.21 0.00 2.04 2.15 0.00 3.64 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 97 S 7.48 4.58 0.00 4.05 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 98 G 7.68 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 0.00 0.00 0.00 0.00 99 T 8.45 4.00 4.21 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 1.18 0.00 0.00 100 L 8.45 4.37 0.00 1.62 1.58 0.97 1.00 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 0.00 101 L 9.22 4.20 0.00 1.74 1.67 0.80 0.43 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 0.00 102 G 7.21 4.33 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 0.00 103 T 8.41 4.95 4.16 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 0.00 0.00 0.00 0.52 0.00 0.00 104 I 8.68 4.17 1.77 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.59 0.89 0.00 0.00 105 Y 8.68 4.50 0.00 2.81 2.87 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 0.00 106 V 8.88 4.17 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 1.00 0.00 0.00 0.91 0.00 0.00 107 G 8.47 4.22 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 0.00 0.00 0.00 108 S 8.51 4.39 0.00 3.80 3.70 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 0.00 0.00 0.00 109 T 8.57 4.25 4.16 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 0.00 0.00 0.00 1.08 0.00 0.00 110 G 9.81 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 0.00 0.00 0.00 111 S 7.01 4.41 0.00 3.75 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 F 8.71 4.21 0.00 2.99 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 0.00 113 D 8.16 4.86 0.00 2.70 2.79 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 0.00 114 T 7.53 4.55 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 0.00 115 Y 8.69 4.74 0.00 2.82 2.82 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 0.00 116 R 8.90 4.77 0.00 1.60 1.72 0.00 3.27 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.70 0.00 117 D 8.60 5.12 0.00 2.58 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 0.00 118 V 8.71 4.63 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 0.74 0.00 0.00 0.95 0.00 0.00 119 S 8.62 5.39 0.00 3.73 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 0.00 120 A 8.78 4.79 1.27 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 0.00 0.00 0.00 121 T 8.59 4.69 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 1.30 0.00 0.00 122 I 8.53 4.95 1.94 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.06 1.07 0.00 0.00 123 S 8.75 4.23 0.00 3.73 3.83 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 0.00 0.00 0.00 124 N 8.90 4.53 0.00 2.86 2.71 0.00 0.00 6.89 7.22 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 0.00 125 T 8.73 4.73 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 126 A 8.05 4.89 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 0.00 127 G 9.15 3.71 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 0.00 0.00 0.00 128 V 8.28 4.86 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 0.98 0.00 0.00 129 K 9.22 4.80 0.00 1.66 1.57 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.71 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.27 7.81 130 D 8.67 5.21 0.00 2.64 2.65 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 0.00 0.00 0.00 0.00 131 I 9.02 5.05 2.25 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.31 1.23 0.00 0.00 132 V 8.95 4.97 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 1.11 0.00 0.00 0.95 0.00 0.00 133 L 8.97 4.77 0.00 1.41 0.91 0.35 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.24 4.56 1.95 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 1.03 0.00 0.00 0.89 0.00 0.00 135 F 9.07 5.13 0.00 3.08 2.92 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 0.00 136 S 8.60 4.48 0.00 3.91 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 0.00 137 G 7.59 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 0.00 0.00 0.00 138 P 0.00 4.64 0.00 2.14 1.99 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00 139 V 8.05 4.66 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 0.62 0.00 0.00 1.01 0.00 0.00 140 N 9.23 5.32 0.00 2.69 3.08 0.00 0.00 6.47 7.24 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 0.00 141 V 8.65 4.64 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 1.05 0.00 0.00 1.04 0.00 0.00 142 D 9.40 4.47 0.00 2.29 2.28 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 0.00 143 W 7.31 5.87 0.00 3.41 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 0.00 144 F 9.14 5.81 0.00 2.99 3.01 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 0.00 145 V 8.74 4.46 1.91 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 0.87 0.00 0.00 0.89 0.00 0.00 146 F 8.88 5.50 0.00 2.60 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 0.00 147 S 8.93 5.03 0.00 4.02 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 0.00 148 K 8.82 4.69 0.00 1.75 1.88 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.68 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.72 1.67 7.81 149 S 9.07 4.06 0.00 3.78 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 *150 G 8.62 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.