NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *28 F 4.7444 8.1827 119.0164 56.7622 40.8478 176.8298 29 E 3.7244 8.0080 121.4973 58.2491 29.4064 177.0952 30 K 4.0068 8.2217 118.5295 59.3845 32.6011 178.5589 31 G 3.7474 8.1974 105.3624 48.2624 0.0000 175.0044 32 Y 4.0281 8.1835 119.3249 60.8224 37.9589 178.4966 33 Q 3.9456 8.8036 120.8203 59.2910 28.9103 178.3498 34 S 4.1765 8.8779 117.0641 62.0092 62.3787 176.7135 35 Q 4.0877 8.1388 123.3247 59.5896 27.8427 180.3170 36 L 4.1067 8.2270 120.9205 58.4782 42.0403 178.3960 37 Y 3.8466 8.0096 119.6191 60.8884 38.6441 178.1767 38 T 3.9422 7.8352 116.6275 66.4792 68.7095 176.0471 39 E 3.9150 8.3106 121.3945 59.9591 29.6003 178.9990 40 M 3.9823 8.0959 117.9644 57.4759 31.9646 178.7801 41 V 3.4907 7.8038 119.4827 66.0488 31.5604 177.6916 42 G 3.8963 8.1938 105.3461 48.4297 0.0000 175.2196 43 I 3.6420 7.4971 122.1555 63.8031 37.2283 177.9219 44 N 4.4409 8.3376 117.7688 56.8900 38.4497 176.6142 45 N 4.4909 8.1377 117.5722 56.6127 38.7885 177.5566 46 I 3.9878 7.7782 120.5177 64.0087 37.0344 178.6897 47 S 4.2031 8.2080 116.5729 61.1906 62.7823 176.4077 48 K 4.1046 8.5272 121.4771 59.7443 31.8461 179.2264 49 Q 3.9589 7.8086 116.6099 59.0069 28.4963 178.3897 50 F 4.1749 7.7307 119.5988 61.5349 39.6104 176.9747 51 I 3.4068 7.5267 118.8510 64.3231 36.7427 178.3858 52 L 3.9743 7.5375 118.4197 57.5820 41.5783 179.3793 53 K 4.1852 8.3290 116.9849 58.2637 34.2100 176.6502 54 N 4.9473 7.6413 117.5360 51.5106 38.8617 173.3622 55 P 4.4419 0.0000 0.0000 63.9771 32.5163 177.4691 56 L 4.5295 7.5840 117.7105 54.5375 42.1237 175.9617 57 D 4.5272 7.6310 119.9601 53.7595 41.5200 176.7710 58 D 4.6296 8.4441 123.3484 52.5816 41.8358 177.0195 59 N 4.1336 8.6876 117.1612 57.1452 38.4119 177.5981 60 Q 3.9244 8.0472 118.3188 59.0779 28.9115 178.5244 61 T 3.8674 8.0212 116.4882 66.8132 68.4464 176.6459 62 I 3.9015 7.7621 121.5020 64.1446 37.0908 178.2715 63 K 3.3425 7.6776 120.3186 59.5612 31.8815 178.6838 64 S 4.2844 8.1518 115.4596 61.7481 62.6891 177.1586 65 K 3.9088 8.1969 120.7272 59.4196 31.7674 179.3128 66 L 4.0255 8.1669 119.2875 57.9234 41.5115 179.1794 67 E 4.0927 8.6133 118.8149 59.7377 29.5299 179.6344 68 R 3.8623 8.2265 118.4270 59.4558 29.9303 177.8826 69 F 4.1241 8.6685 120.0897 61.6739 39.3787 176.9678 70 V 3.3409 8.8554 118.4207 65.8602 31.0532 177.7319 71 S 4.2559 8.1948 112.8130 61.0640 62.2582 175.6026 72 G 3.9767 7.6440 106.2303 44.0330 0.0000 173.0054 73 Y 3.7613 6.8551 121.1689 56.8969 39.2625 175.8468 74 K 4.4212 7.3686 124.1515 54.7057 33.3021 176.1209 75 M 4.6557 8.5641 123.7759 53.9575 33.1882 175.9689 76 N 4.2102 8.5762 116.5518 53.5755 38.8764 174.6733 77 P 4.4667 0.0000 0.0000 65.4664 30.9845 178.5333 *78 K 4.2555 7.8491 122.2434 58.4018 32.8592 183.4544 79 I 4.5169 7.7067 118.5774 64.5262 37.1209 178.0316 80 A 4.1078 8.2519 121.0620 54.9831 18.2744 179.0106 81 E 3.9722 7.9098 116.7049 58.4332 29.8077 177.5607 82 K 4.0324 8.0858 117.4028 56.6318 34.1585 175.6606 83 Y 5.3661 7.5751 113.7724 56.1731 42.0348 173.7910 84 N 5.0196 9.0612 120.4889 51.7213 40.9708 173.9131 85 V 4.9517 8.4548 123.7199 61.2112 33.3714 174.7872 86 S 4.9657 9.1932 122.1462 56.4548 66.5913 173.1556 87 V 4.9254 8.1104 119.6991 60.6737 34.0526 174.4779 88 H 4.8934 8.5002 117.5724 55.0124 33.6196 173.2732 89 F 5.1613 8.8278 119.9518 54.9126 42.6521 174.8975 *94 K 4.1557 8.1716 115.2246 57.4611 32.9407 174.5845 95 P 4.7850 0.0000 0.0000 64.1492 31.7861 178.1776 96 R 4.2328 8.0282 117.1514 57.4037 30.7535 176.0634 97 A 4.7490 8.0105 122.0450 50.5715 21.0513 175.1818 98 Y 5.1508 7.9712 119.0233 55.7406 42.0354 173.7729 99 S 5.4014 9.3261 114.7675 56.6591 67.1355 172.4807 100 L 5.2878 9.1608 120.6350 53.0100 44.3693 175.7079 101 V 4.8529 8.8783 123.5316 61.0095 34.4627 174.3749 102 G 4.4445 9.3468 114.6062 44.5882 0.0000 172.0491 103 V 5.0775 8.6528 117.0254 58.8315 36.5695 173.2157 104 P 4.9333 0.0000 0.0000 62.7136 32.2352 176.6682 105 K 4.2642 9.1648 123.1939 56.2624 33.4263 176.9543 106 T 3.8194 8.3038 119.7206 65.3872 68.7965 174.9239 107 G 3.9352 9.0807 114.0043 45.5233 0.0000 173.8062 108 T 3.8725 7.2045 108.1549 61.0200 69.5336 176.3077 109 G 3.9522 8.2049 109.0189 45.7285 0.0000 172.9280 110 Y 5.0213 7.4903 116.5715 57.7008 39.5400 175.2442 111 T 4.6427 9.3204 114.8237 64.9630 73.3188 174.9323 112 L 4.6618 8.2632 120.4368 55.3669 42.2606 176.8597 113 S 5.0205 9.0125 118.4579 57.1665 67.8848 172.6537 114 V 4.9371 8.7863 118.9111 61.9114 35.1736 173.6306 115 W 6.3000 9.0215 121.7875 55.8314 31.9196 173.2167 116 M 4.6808 8.5732 116.7175 54.7190 33.6827 172.6840 117 N 5.6034 8.6288 117.5853 50.8330 40.8771 175.1103 118 S 4.1360 8.2937 111.7653 59.3639 63.0748 175.2050 119 V 4.1465 7.8855 113.8818 61.2170 31.5391 176.7766 120 G 3.8833 7.8048 108.9110 45.1365 0.0000 174.0600 121 D 4.3746 8.2475 121.0744 53.7958 41.1967 175.4342 122 G 4.8880 7.9927 110.9317 43.9053 0.0000 171.2637 123 Y 5.0370 8.4882 118.6945 56.1186 43.0007 174.0356 124 K 4.9625 8.8115 122.9018 55.0983 34.5115 174.9373 125 C 5.5350 9.1371 121.9958 55.3016 43.3120 175.3072 126 R 4.0931 8.9299 120.9473 58.6897 30.7037 176.2146 127 D 5.3285 8.1157 115.4907 49.5736 43.1214 175.9242 128 A 4.2064 8.8724 121.3361 54.5579 18.3849 179.3980 129 A 3.9566 8.0612 118.8991 55.6999 18.3556 179.9520 130 S 4.1012 8.9062 113.6836 61.4215 62.8300 176.8152 131 A 4.1627 7.7273 122.8944 55.2416 18.0146 179.9433 132 R 3.8037 7.9173 115.3195 58.7307 30.1975 178.2256 133 A 4.0845 7.6340 117.7321 51.3164 19.7847 176.3459 134 H 2.0000 7.5198 113.4734 55.6662 26.4996 175.4722 135 L 4.1207 7.7331 118.0615 55.0239 42.2809 177.6953 136 E 4.5177 8.7149 120.0285 56.1375 31.1098 176.1071 137 T 4.6863 7.5671 109.4120 59.2020 70.9378 173.9100 138 L 4.2165 8.5367 125.2006 55.1788 42.4541 175.4319 139 S 4.4277 8.2898 119.6652 59.1076 67.7105 176.8372 *142 V 3.8586 7.1252 113.2052 60.8507 32.5868 173.8732 143 G 4.2972 8.9807 105.5982 46.0119 0.0000 171.1884 144 C 5.8439 8.2157 114.7251 55.4310 40.4357 173.6423 145 E 5.0383 9.1636 116.7286 54.5593 32.8711 174.6112 146 A 3.6410 8.9379 127.0475 52.7855 18.9610 178.1170 *147 F 3.9398 7.8463 120.1657 56.8031 37.9867 172.0795 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 *28 F 8.18 4.74 0.00 2.22 2.36 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 29 E 8.01 3.72 0.00 1.69 1.72 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 1.81 1.47 0.00 30 K 8.22 4.01 0.00 1.84 1.84 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.49 7.81 31 G 8.20 3.75 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 0.00 0.00 0.00 32 Y 8.18 4.03 0.00 3.38 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 0.00 33 Q 8.80 3.95 0.00 2.25 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 34 S 8.88 4.18 0.00 3.99 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 35 Q 8.14 4.09 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.59 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 36 L 8.23 4.11 0.00 1.43 1.64 0.75 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 8.01 3.85 0.00 3.12 2.99 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 38 T 7.84 3.94 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 1.24 0.00 0.00 39 E 8.31 3.92 0.00 2.29 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 0.00 2.36 2.40 0.00 40 M 8.10 3.98 0.00 1.94 1.85 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.40 0.00 41 V 7.80 3.49 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 1.01 0.00 0.00 0.92 0.00 0.00 42 G 8.19 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 43 I 7.50 3.64 1.64 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.09 0.32 0.70 0.00 0.00 44 N 8.34 4.44 0.00 2.98 2.88 0.00 0.00 7.25 6.57 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 45 N 8.14 4.49 0.00 3.06 2.90 0.00 0.00 7.07 7.32 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 46 I 7.78 3.99 2.16 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.91 0.81 0.00 0.00 47 S 8.21 4.20 0.00 3.99 3.68 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 48 K 8.53 4.10 0.00 2.05 1.94 0.00 1.71 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.81 7.81 49 Q 7.81 3.96 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.74 0.00 0.00 0.00 0.00 0.00 2.69 2.55 0.00 50 F 7.73 4.17 0.00 2.80 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 51 I 7.53 3.41 1.96 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.87 0.93 0.00 0.00 52 L 7.54 3.97 0.00 1.77 1.71 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 53 K 8.33 4.19 0.00 1.84 1.99 0.00 1.59 0.00 0.00 1.76 0.00 0.00 3.25 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.55 1.42 7.81 54 N 7.64 4.95 0.00 2.36 2.43 0.00 0.00 6.62 8.07 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 55 P 0.00 4.44 0.00 2.14 2.12 0.00 3.68 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 1.95 1.94 0.00 56 L 7.58 4.53 0.00 1.62 1.70 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 57 D 7.63 4.53 0.00 2.80 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 58 D 8.44 4.63 0.00 2.93 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 59 N 8.69 4.13 0.00 2.71 2.89 0.00 0.00 6.82 7.37 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 60 Q 8.05 3.92 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.86 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 61 T 8.02 3.87 4.38 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 1.31 0.00 0.00 62 I 7.76 3.90 2.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.79 0.98 0.00 0.00 63 K 7.68 3.34 0.00 0.94 1.63 0.00 1.33 0.00 0.00 1.46 0.00 0.00 2.92 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.28 0.95 7.81 64 S 8.15 4.28 0.00 4.03 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 65 K 8.20 3.91 0.00 2.00 1.48 0.00 2.17 0.00 0.00 1.87 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.79 7.81 66 L 8.17 4.03 0.00 2.07 1.90 1.00 0.73 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 67 E 8.61 4.09 0.00 2.32 2.06 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 2.40 2.49 0.00 68 R 8.23 3.86 0.00 1.87 2.16 0.00 3.09 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 69 F 8.67 4.12 0.00 2.80 3.23 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 70 V 8.86 3.34 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 0.86 0.00 0.00 0.99 0.00 0.00 71 S 8.19 4.26 0.00 4.01 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 72 G 7.64 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 73 Y 6.86 3.76 0.00 2.70 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 74 K 7.37 4.42 0.00 1.56 1.66 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.33 7.81 75 M 8.56 4.66 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.65 0.00 76 N 8.58 4.21 0.00 2.77 2.83 0.00 0.00 7.19 8.83 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 77 P 0.00 4.47 0.00 2.28 2.32 0.00 3.71 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 *78 K 7.85 4.26 0.00 1.87 1.75 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.08 7.81 79 I 7.71 4.52 2.02 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 1.68 0.83 1.21 0.00 0.00 80 A 8.25 4.11 1.41 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 81 E 7.91 3.97 0.00 2.22 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 0.00 2.22 2.31 0.00 82 K 8.09 4.03 0.00 1.61 0.74 0.00 0.68 0.00 0.00 1.13 0.00 0.00 2.36 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.18 0.75 7.81 83 Y 7.58 5.37 0.00 3.00 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 84 N 9.06 5.02 0.00 2.70 2.76 0.00 0.00 6.53 7.21 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 85 V 8.45 4.95 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 0.72 0.00 0.00 0.90 0.00 0.00 86 S 9.19 4.97 0.00 3.81 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 87 V 8.11 4.93 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 0.80 0.00 0.00 0.51 0.00 0.00 88 H 8.50 4.89 0.00 3.06 3.19 0.00 5.56 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.83 5.16 0.00 3.07 3.11 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 0.00 *94 K 8.17 4.16 0.00 2.00 2.06 0.00 1.52 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.52 7.81 95 P 0.00 4.79 0.00 1.97 2.06 0.00 3.83 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 2.08 2.11 0.00 96 R 8.03 4.23 0.00 1.84 2.04 0.00 3.25 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 97 A 8.01 4.75 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 98 Y 7.97 5.15 0.00 2.48 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.33 5.40 0.00 4.09 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 0.00 100 L 9.16 5.29 0.00 1.55 1.57 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 101 V 8.88 4.85 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 1.08 0.00 0.00 0.92 0.00 0.00 102 G 9.35 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 0.00 103 V 8.65 5.08 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 0.77 0.00 0.00 1.01 0.00 0.00 104 P 0.00 4.93 0.00 2.04 2.12 0.00 3.83 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.61 0.00 105 K 9.16 4.26 0.00 1.54 1.66 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.50 7.81 106 T 8.30 3.82 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 1.20 0.00 0.00 107 G 9.08 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 0.00 108 T 7.20 3.87 3.41 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 0.89 0.00 0.00 109 G 8.20 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 0.00 0.00 0.00 110 Y 7.49 5.02 0.00 2.78 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 0.00 111 T 9.32 4.64 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 1.32 0.00 0.00 112 L 8.26 4.66 0.00 1.57 1.65 0.95 0.86 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 0.00 113 S 9.01 5.02 0.00 3.97 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 0.00 114 V 8.79 4.94 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 0.74 0.00 0.00 0.99 0.00 0.00 115 W 9.02 6.30 0.00 3.31 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 0.00 116 M 8.57 4.68 0.00 1.74 1.99 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.35 0.00 117 N 8.63 5.60 0.00 2.86 3.24 0.00 0.00 7.04 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 0.00 118 S 8.29 4.14 0.00 3.45 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 0.00 119 V 7.89 4.15 2.06 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 0.69 0.00 0.00 0.98 0.00 0.00 120 G 7.80 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 0.00 121 D 8.25 4.37 0.00 2.94 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 7.99 4.89 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 0.00 123 Y 8.49 5.04 0.00 2.19 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 0.00 124 K 8.81 4.96 0.00 1.69 1.72 0.00 1.43 0.00 0.00 1.76 0.00 0.00 2.77 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.44 1.30 7.81 125 C 9.14 5.54 0.00 2.95 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 0.00 126 R 8.93 4.09 0.00 1.72 2.01 0.00 3.37 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 127 D 8.12 5.33 0.00 2.82 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 0.00 128 A 8.87 4.21 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 0.00 129 A 8.06 3.96 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 0.00 130 S 8.91 4.10 0.00 3.91 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 0.00 131 A 7.73 4.16 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 0.00 0.00 0.00 0.00 0.00 132 R 7.92 3.80 0.00 1.98 1.95 0.00 3.15 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 133 A 7.63 4.08 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 0.00 134 H 7.52 2.00 0.00 2.34 1.31 0.00 5.86 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 7.73 4.12 0.00 1.66 1.61 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.71 4.52 0.00 1.98 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 2.16 2.09 0.00 137 T 7.57 4.69 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 1.26 0.00 0.00 138 L 8.54 4.22 0.00 1.69 1.67 0.94 0.98 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 0.00 139 S 8.29 4.43 0.00 3.96 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 *142 V 7.13 3.86 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 0.88 0.00 0.00 0.94 0.00 0.00 143 G 8.98 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 0.00 0.00 0.00 0.00 144 C 8.22 5.84 0.00 3.19 3.31 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 0.00 145 E 9.16 5.04 0.00 2.02 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 2.22 2.29 0.00 146 A 8.94 3.64 0.91 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 *147 F 7.85 3.94 0.00 2.27 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.