NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.3072 8.3149 120.1371 55.9048 33.4949 175.6075 3 L 4.0892 8.4394 123.0186 54.0107 42.3633 174.2580 4 Q 4.8176 9.0929 122.8347 54.5077 31.6334 175.0787 5 T 3.9933 8.8237 123.3210 64.5538 69.2831 173.7386 6 T 4.6136 8.7938 121.9605 61.9368 72.0091 172.8791 7 I 5.0710 8.4886 126.9233 59.6299 39.9171 175.1993 8 Q 4.6413 8.7977 123.6163 54.4960 33.1245 173.8464 9 H 5.1533 8.6454 118.2113 53.7872 32.3784 173.0613 10 E 4.2635 8.6835 122.8528 54.8714 30.7294 174.2452 11 P 4.3969 0.0000 0.0000 62.7746 31.9208 177.7674 12 K 4.1595 8.6999 122.1407 58.6890 32.2030 177.3986 13 D 4.5654 8.1266 116.5734 53.1966 39.8232 177.2321 14 G 3.9739 8.1163 108.8149 45.3909 0.0000 173.9768 15 S 4.4755 8.1516 114.6375 57.7804 64.4116 174.3336 16 G 3.9093 9.0412 108.0140 45.3018 0.0000 173.1125 17 F 4.6361 7.8757 117.8921 55.8167 40.6806 174.8322 18 D 4.9789 8.6470 125.6969 53.2913 44.2947 176.8348 19 R 4.3805 8.1201 118.9821 54.4501 31.0353 174.9607 *23 E 4.2193 8.5901 124.7289 54.8928 31.4399 176.5926 24 F 4.7017 7.8084 115.4138 58.0815 40.8394 175.8067 25 F 5.3480 8.1477 115.1987 55.6374 43.1996 173.6194 26 E 5.0932 9.0808 117.9667 54.9455 33.2347 174.1589 27 Y 5.2259 8.6935 117.1661 56.3040 41.9292 174.6342 28 R 4.6386 9.1797 124.4450 54.5528 32.4982 174.1037 29 D 5.1466 8.8179 126.7949 54.0868 41.7693 176.2569 30 T 4.0908 8.7085 115.6405 62.8008 69.6340 175.8872 31 G 3.9881 9.2964 111.8797 45.4240 0.0000 175.4817 32 V 3.6061 7.7840 119.5106 65.8003 31.5545 177.1980 33 N 5.0857 8.1691 117.6530 56.3681 38.7410 176.1249 34 E 3.9364 8.2465 119.7689 59.4160 29.5340 178.5624 35 A 4.1022 8.1502 119.9017 54.2248 18.4358 178.6840 36 T 4.5633 7.8042 105.8620 60.6210 69.2249 174.6048 37 G 3.8909 8.7174 108.3488 46.8816 0.0000 173.5622 38 G 3.8441 7.9561 108.1631 46.2229 0.0000 173.1693 *40 F 4.8802 7.6327 121.1959 57.7859 41.4242 174.2699 41 G 4.7130 9.1411 106.3761 44.9196 0.0000 171.5907 42 A 5.2879 8.4446 122.1914 50.8014 22.7417 174.9172 43 H 5.2080 8.8589 116.6775 54.5715 32.6696 172.5673 44 V 4.6748 9.0237 120.8812 61.8614 33.2867 174.4642 45 I 4.6050 8.9655 128.9972 59.4836 39.5803 174.5334 46 R 5.1177 8.8126 126.9604 53.9900 33.1134 174.5974 47 A 4.1120 8.7381 127.9676 52.2624 19.2692 176.9274 48 I 4.1606 7.6852 122.8359 59.0888 38.1688 174.4344 49 P 4.0287 0.0000 0.0000 63.1346 31.1292 176.1097 *52 E 4.1424 8.0876 119.7948 53.1337 32.2088 172.6313 53 A 4.1967 6.8001 122.0305 52.1194 21.7282 176.2567 54 K 4.3129 7.9999 120.7238 53.7227 32.6735 173.9093 55 P 4.4881 0.0000 0.0000 62.3481 32.0365 176.4297 56 T 4.5694 8.0628 119.7797 61.3265 72.0433 173.8479 57 W 4.6218 8.8542 127.2845 57.4289 30.4969 175.0198 58 H 5.4079 9.0607 119.0613 55.2232 32.1348 172.0280 59 T 5.0272 9.0009 107.9538 60.3859 72.1825 172.4701 60 H 5.5304 8.5322 118.2295 54.0802 32.6582 173.7062 61 T 4.6711 8.7293 114.1245 60.6559 66.2523 174.0233 62 V 4.2220 7.5374 120.4667 61.6263 35.8515 175.5257 63 G 3.6159 9.3285 112.3454 48.1495 0.0000 174.3503 64 F 4.8660 9.0389 121.1711 57.4405 42.2837 174.7302 65 Q 4.3843 7.2709 125.8054 54.8679 32.2121 172.5332 66 L 5.0392 8.4169 128.3347 53.2066 45.9025 174.8943 67 F 5.3378 9.2322 123.7757 55.8585 42.6440 173.7074 68 Y 4.9541 9.1123 123.0543 55.8509 42.0601 174.1874 69 V 4.0517 8.6056 127.9873 62.8255 32.2037 176.2809 70 L 4.6686 9.1153 128.1808 56.4688 43.1571 176.9673 71 R 4.4370 7.9688 116.7607 56.4213 33.5839 176.5289 72 G 4.1111 9.6227 112.1961 44.6964 0.0000 171.9079 73 W 5.7175 7.7863 115.2585 55.3320 32.0363 174.6096 74 V 4.8590 8.8729 120.4418 60.4046 34.2856 173.3338 75 E 4.6624 9.3696 125.5175 54.6633 31.5523 174.8849 76 F 5.3367 8.7222 125.3881 55.8868 42.5118 174.2243 77 E 5.0859 8.6505 120.5662 54.7832 33.1383 173.8353 78 Y 5.4286 8.7884 123.1688 55.9229 41.4655 176.5122 79 E 4.0527 9.3874 121.1456 59.3586 29.7563 178.0987 80 D 4.5839 8.5193 119.0532 55.1503 40.2313 177.2595 81 I 4.2399 7.9470 110.1775 59.3337 39.3063 176.9801 82 G 3.8793 8.3741 109.6154 44.9004 0.0000 171.9545 83 A 4.8820 8.4638 122.0664 52.1871 19.5648 178.3188 84 V 4.2669 8.7111 120.5045 60.7126 35.1736 173.4352 *86 L 4.4401 8.4270 118.1773 55.4879 43.4201 176.4798 87 E 5.2622 8.7081 120.7492 52.9023 32.7063 174.7815 88 A 4.2545 8.4242 122.0979 54.5466 18.4848 178.1118 89 G 4.1717 8.5067 111.2589 45.9122 0.0000 174.2375 90 G 3.9337 7.9301 107.9948 46.0278 0.0000 173.1224 91 S 5.3903 9.0414 116.0491 56.2418 67.1316 172.8485 92 A 4.9265 9.2109 123.2341 50.3251 22.1117 174.6850 93 F 4.7517 9.3548 126.4369 57.7036 40.9527 174.4572 94 Q 4.1456 7.6533 125.9586 53.1480 29.9948 174.0735 95 P 4.0681 0.0000 0.0000 61.5289 32.9753 174.2566 96 P 4.3629 0.0000 0.0000 63.4905 31.3714 176.6196 97 G 3.9473 8.9209 110.6816 44.8162 0.0000 173.4013 98 V 3.8763 7.5660 119.1355 61.8956 32.0811 176.1728 99 R 4.5871 9.0308 123.2902 56.5103 31.2620 175.2570 100 H 5.4526 9.1983 118.8691 54.9681 32.7516 172.0244 101 R 4.6158 8.2223 113.9826 54.9814 33.4532 173.2397 102 E 4.7887 8.4918 120.6278 54.9974 30.7966 176.2583 103 L 4.3211 8.8569 127.9932 56.6752 42.8033 177.1390 104 R 4.5621 7.5783 113.0744 56.3884 31.7480 173.0673 105 H 4.8560 8.2365 114.4930 53.9383 31.7276 173.2285 106 S 3.4758 7.1199 114.7027 57.7891 63.6098 175.1684 107 D 4.3294 8.5107 120.8306 56.5129 40.8205 176.9780 108 D 4.7612 7.6138 117.1753 52.5973 39.9059 175.8873 109 L 4.1974 7.5166 122.6426 56.1156 43.3069 175.4910 110 E 5.3233 9.2758 126.4898 54.4587 33.1376 174.4876 111 V 5.0179 8.8777 125.8636 60.0021 35.3526 173.9578 112 L 4.8640 9.2372 126.9656 54.4410 43.6513 174.6311 113 E 4.6783 9.2044 127.4139 54.2846 32.3570 174.3227 114 I 5.1492 8.3880 127.6746 59.5204 40.2348 175.0306 115 V 5.0241 9.1170 125.7402 60.3172 35.5554 174.0558 116 S 4.7893 9.0063 116.0113 55.9803 65.6715 171.9814 117 P 4.7309 0.0000 0.0000 62.1000 32.1411 176.1019 118 A 4.1619 8.7637 122.1092 53.9731 18.6740 179.2291 119 G 3.8401 7.5630 104.3121 44.9524 0.0000 173.7717 120 F 4.5657 7.6067 112.8575 56.7019 39.3251 175.8994 121 A 4.7013 9.0206 122.4968 51.4906 21.0879 176.2930 122 T 5.2247 8.3923 114.7570 62.0228 72.2770 173.8496 123 S 4.8018 8.9656 121.5021 56.4549 66.5585 173.6643 124 V 4.1663 8.4717 124.6754 62.6436 32.2062 175.5865 125 V 3.8074 8.6687 128.8953 62.9461 32.0815 175.0683 126 D 4.6937 8.7150 128.3356 53.1965 41.2126 176.4524 127 L 4.2024 8.4235 123.4692 54.8303 41.8180 176.7523 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 2 K 8.31 4.31 0.00 1.78 1.83 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.48 7.81 3 L 8.44 4.09 0.00 1.88 1.81 1.14 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 9.09 4.82 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.88 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 5 T 8.82 3.99 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 0.17 0.00 0.00 6 T 8.79 4.61 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 1.21 0.00 0.00 7 I 8.49 5.07 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 1.31 0.90 0.79 0.00 0.00 8 Q 8.80 4.64 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 9 H 8.65 5.15 0.00 3.01 3.15 0.00 5.69 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.68 4.26 0.00 2.26 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 2.47 2.48 0.00 11 P 0.00 4.40 0.00 2.46 2.00 0.00 3.80 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 12 K 8.70 4.16 0.00 2.02 1.89 0.00 1.85 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.00 7.81 13 D 8.13 4.57 0.00 2.78 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 14 G 8.12 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 0.00 0.00 0.00 15 S 8.15 4.48 0.00 4.04 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 16 G 9.04 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 0.00 0.00 0.00 17 F 7.88 4.64 0.00 3.03 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 18 D 8.65 4.98 0.00 2.62 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.12 4.38 0.00 1.76 1.68 0.00 3.30 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.15 0.00 *23 E 8.59 4.22 0.00 1.62 1.35 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 1.47 1.87 0.00 24 F 7.81 4.70 0.00 3.07 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 F 8.15 5.35 0.00 2.93 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 9.08 5.09 0.00 2.07 2.05 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 2.32 2.26 0.00 27 Y 8.69 5.23 0.00 2.77 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 28 R 9.18 4.64 0.00 1.89 1.83 0.00 3.12 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 29 D 8.82 5.15 0.00 2.79 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.71 4.09 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 31 G 9.30 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 32 V 7.78 3.61 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 0.94 0.00 0.00 33 N 8.17 5.09 0.00 2.93 2.84 0.00 0.00 7.31 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 34 E 8.25 3.94 0.00 2.09 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 2.39 2.40 0.00 35 A 8.15 4.10 1.37 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 0.00 0.00 36 T 7.80 4.56 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 1.34 0.00 0.00 37 G 8.72 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 38 G 7.96 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 *40 F 7.63 4.88 0.00 3.11 3.09 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 0.00 0.00 0.00 41 G 9.14 4.71 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 42 A 8.44 5.29 1.23 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 43 H 8.86 5.21 0.00 3.46 3.50 0.00 5.25 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 9.02 4.67 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 1.11 0.00 0.00 0.99 0.00 0.00 45 I 8.97 4.61 1.79 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.67 0.37 0.00 0.00 46 R 8.81 5.12 0.00 1.80 1.71 0.00 3.10 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 47 A 8.74 4.11 1.16 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 0.00 0.00 48 I 7.69 4.16 1.85 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 1.18 0.54 0.85 0.00 0.00 49 P 0.00 4.03 0.00 2.00 1.95 0.00 3.66 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 *52 E 8.09 4.14 0.00 2.01 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.89 0.00 53 A 6.80 4.20 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 54 K 8.00 4.31 0.00 1.63 1.66 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.27 1.34 7.81 55 P 0.00 4.49 0.00 1.80 1.89 0.00 3.66 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.98 0.00 56 T 8.06 4.57 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 1.26 0.00 0.00 57 W 8.85 4.62 0.00 3.28 3.03 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 58 H 9.06 5.41 0.00 3.30 3.37 0.00 5.21 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 9.00 5.03 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 60 H 8.53 5.53 0.00 2.86 2.88 0.00 5.61 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.73 4.67 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 1.27 0.00 0.00 62 V 7.54 4.22 1.98 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 0.38 0.00 0.00 0.73 0.00 0.00 63 G 9.33 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 64 F 9.04 4.87 0.00 3.25 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 65 Q 7.27 4.38 0.00 1.75 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.64 0.00 0.00 0.00 0.00 0.00 1.94 1.85 0.00 66 L 8.42 5.04 0.00 1.46 1.30 1.11 1.21 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 67 F 9.23 5.34 0.00 3.05 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 68 Y 9.11 4.95 0.00 3.08 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.61 4.05 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 0.93 0.00 0.00 0.95 0.00 0.00 70 L 9.12 4.67 0.00 1.74 1.79 1.05 1.06 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 71 R 7.97 4.44 0.00 1.88 1.72 0.00 3.24 0.00 0.00 3.36 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 72 G 9.62 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 0.00 0.00 0.00 0.00 73 W 7.79 5.72 0.00 3.42 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 74 V 8.87 4.86 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 0.20 0.00 0.00 0.23 0.00 0.00 75 E 9.37 4.66 0.00 2.03 1.82 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 2.16 2.30 0.00 76 F 8.72 5.34 0.00 2.96 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.65 5.09 0.00 1.75 1.14 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 2.38 2.31 0.00 78 Y 8.79 5.43 0.00 3.04 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 79 E 9.39 4.05 0.00 1.90 1.99 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 2.55 2.31 0.00 80 D 8.52 4.58 0.00 2.83 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.95 4.24 1.93 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 0.88 0.91 0.00 0.00 82 G 8.37 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 83 A 8.46 4.88 1.25 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 0.00 0.00 84 V 8.71 4.27 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 1.09 0.00 0.00 1.06 0.00 0.00 *86 L 8.43 4.44 0.00 1.73 1.69 1.11 0.87 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 87 E 8.71 5.26 0.00 2.03 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 2.35 2.23 0.00 88 A 8.42 4.25 1.35 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 0.00 0.00 0.00 89 G 8.51 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 G 7.93 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 0.00 0.00 0.00 91 S 9.04 5.39 0.00 4.05 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 92 A 9.21 4.93 1.37 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 0.00 0.00 93 F 9.35 4.75 0.00 3.11 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 94 Q 7.65 4.15 0.00 1.72 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.64 0.00 0.00 0.00 0.00 0.00 2.13 2.25 0.00 95 P 0.00 4.07 0.00 1.98 1.97 0.00 3.35 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.18 0.00 96 P 0.00 4.36 0.00 2.04 2.18 0.00 3.86 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.28 0.00 97 G 8.92 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 98 V 7.57 3.88 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 0.70 0.00 0.00 1.09 0.00 0.00 99 R 9.03 4.59 0.00 1.78 1.92 0.00 3.00 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.62 0.00 100 H 9.20 5.45 0.00 2.69 3.36 0.00 5.27 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 R 8.22 4.62 0.00 1.42 1.46 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.85 0.00 102 E 8.49 4.79 0.00 2.17 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 103 L 8.86 4.32 0.00 1.63 1.63 0.89 0.65 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 0.00 104 R 7.58 4.56 0.00 2.04 2.04 0.00 3.10 0.00 0.00 3.44 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.68 0.00 105 H 8.24 4.86 0.00 2.95 3.18 0.00 5.53 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 S 7.12 3.48 0.00 3.35 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 0.00 107 D 8.51 4.33 0.00 2.60 2.69 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 0.00 108 D 7.61 4.76 0.00 2.73 2.69 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 0.00 109 L 7.52 4.20 0.00 1.75 1.54 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 110 E 9.28 5.32 0.00 2.05 1.75 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 2.24 2.26 0.00 111 V 8.88 5.02 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 0.82 0.00 0.00 1.26 0.00 0.00 112 L 9.24 4.86 0.00 1.89 1.85 1.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 113 E 9.20 4.68 0.00 2.06 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 0.00 1.93 1.47 0.00 114 I 8.39 5.15 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.51 1.17 0.00 0.00 115 V 9.12 5.02 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 1.07 0.00 0.00 0.70 0.00 0.00 116 S 9.01 4.79 0.00 2.99 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 4.73 0.00 2.12 2.02 0.00 3.99 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 2.09 2.00 0.00 118 A 8.76 4.16 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 0.00 119 G 7.56 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 0.00 120 F 7.61 4.57 0.00 3.14 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 0.00 121 A 9.02 4.70 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 0.00 122 T 8.39 5.22 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 1.31 0.00 0.00 123 S 8.97 4.80 0.00 3.77 3.74 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 0.00 0.00 0.00 124 V 8.47 4.17 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 0.86 0.00 0.00 0.97 0.00 0.00 125 V 8.67 3.81 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 0.73 0.00 0.00 0.98 0.00 0.00 126 D 8.71 4.69 0.00 2.71 2.61 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 0.00 127 L 8.42 4.20 0.00 1.63 1.53 1.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.