NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 4.1628 8.1976 108.0320 46.7755 0.0000 171.6269 3 L 4.9257 8.2164 118.8858 54.7197 43.5477 173.7092 4 C 5.1885 9.7678 117.6614 54.6831 43.6963 175.3676 5 L 4.6269 8.7514 122.7423 55.0647 42.1599 176.5677 6 A 4.3060 8.8079 126.0580 51.3317 19.1657 177.3343 *16 E 4.1202 8.7389 123.4788 55.5499 29.5978 173.4395 17 P 4.4400 0.0000 0.0000 62.3492 32.2675 177.3510 18 H 4.6441 8.5550 117.7717 54.8790 27.4936 174.6895 19 I 4.7026 7.6866 116.2351 58.5944 40.7587 175.0863 20 E 4.2895 8.6661 121.1269 55.9476 29.5911 176.7958 21 L 4.4424 8.5390 123.5081 55.3476 42.6802 176.6328 22 A 4.7724 7.6494 121.4146 51.5218 19.6800 176.0799 23 G 3.8741 8.1090 110.6817 46.8163 0.0000 175.2277 24 G 4.0139 8.0926 108.5825 47.3072 0.0000 174.1167 25 N 4.5794 8.7444 122.8581 52.8431 38.5523 174.9656 26 V 3.9837 7.3912 119.7995 63.1787 32.3963 174.9826 27 H 4.8567 9.1374 125.4780 54.0369 30.5719 174.0480 28 L 4.5164 8.6219 126.2120 55.0212 42.7924 175.9884 29 I 4.4665 9.0830 127.9941 59.6942 38.9763 175.6821 30 T 4.7555 8.4238 115.1886 60.2371 69.9731 174.1925 31 T 4.6626 7.4958 111.8800 59.5849 72.9170 174.6264 32 K 3.6540 8.4930 122.7866 59.5614 32.0925 179.4022 33 E 4.0018 8.1087 117.4143 59.5646 29.3756 179.3069 34 R 3.8024 8.0681 119.0105 58.4734 29.9718 178.6512 35 W 4.0883 7.8664 128.3410 60.7954 30.6206 177.8491 36 D 4.2576 8.1761 118.6955 57.1083 40.1868 178.4700 37 Q 3.8895 8.6184 120.6001 59.2500 28.9979 178.7838 38 K 3.8444 8.1413 119.6103 59.3793 32.0105 179.3937 39 L 3.7155 7.6650 119.6813 57.5962 41.3445 179.8180 40 S 4.0378 8.1674 114.4149 61.2652 63.0000 176.0440 41 E 3.8270 8.2323 122.9485 59.0102 29.4096 178.6900 42 A 3.9730 8.1000 120.8560 55.0666 18.3740 179.5966 43 S 3.9830 8.2837 111.8459 61.7172 62.3230 176.5572 44 R 3.9598 8.0854 119.7177 58.9246 29.9032 177.8463 45 D 4.7054 8.0829 115.6024 52.9407 41.9038 176.2443 46 G 3.8987 7.7659 106.9861 46.9771 0.0000 173.8320 47 K 4.7489 8.2847 116.8980 54.1570 35.4102 177.6952 48 I 4.2117 8.2939 123.9028 61.2744 38.8378 174.8205 49 V 4.6030 8.9192 126.4944 61.2043 33.9034 174.1107 50 L 4.7578 8.9062 129.8254 53.2571 44.0289 174.6687 51 A 4.9274 9.1983 129.6164 50.3065 21.4837 174.6556 52 N 4.4765 8.8548 122.8955 52.2846 40.3562 174.1521 53 F 4.8288 9.2108 127.5294 56.7578 39.9968 175.4258 54 S 4.9265 8.9780 119.2718 56.3932 67.7517 172.9961 55 A 4.6201 7.8327 121.7618 49.9908 20.9099 178.0089 56 R 3.8411 8.6516 121.4960 58.4770 30.4032 177.8562 57 W 4.4028 7.3970 112.7986 57.3674 29.0752 176.9374 58 C 4.6129 7.3003 121.0441 55.2277 42.5757 173.2492 59 G 3.8441 8.8398 115.5043 48.0539 0.0000 172.7289 60 P 4.2803 0.0000 0.0000 65.1809 31.1031 178.8589 61 S 4.0245 7.8087 112.4470 61.7518 62.9632 176.5591 62 R 4.0657 7.9110 120.5874 58.9629 29.5086 178.8679 63 Q 3.9809 8.1113 119.2499 59.2610 29.3895 177.9011 64 I 4.0793 7.9506 118.3211 62.5863 37.9966 177.2174 65 A 4.1544 7.6628 122.6343 55.2736 18.1497 177.8419 66 P 4.2534 0.0000 0.0000 66.1269 31.3492 177.9504 67 Y 4.2462 8.1143 118.9860 60.5807 38.8300 176.6911 68 Y 4.2002 8.6232 120.9597 60.8636 38.7369 178.2395 69 I 3.5012 8.1721 120.8855 64.2988 37.2601 177.9738 70 E 3.8221 8.2700 120.1537 59.3412 29.4019 178.7342 71 L 3.9028 7.9615 119.5196 57.8126 41.3968 179.7038 72 S 2.0000 6.9770 113.1330 60.4789 62.8871 175.9506 73 E 4.0123 7.3678 121.6719 58.4646 29.1620 178.4825 74 N 4.2194 7.7767 115.9907 54.6077 40.2202 175.1932 75 Y 4.8057 7.7917 117.4943 55.9515 37.8969 174.8080 76 P 4.4455 0.0000 0.0000 64.9334 32.2514 178.8010 77 S 4.2817 8.2369 114.7326 60.8271 63.0196 174.0417 78 L 4.8394 7.9097 119.4227 53.3970 43.6366 176.1601 79 M 4.4741 8.7492 122.7682 54.7003 33.5759 174.7452 80 F 5.0564 9.0534 125.7214 56.2910 40.9098 174.9643 81 L 5.5104 9.3736 124.2327 52.8114 45.4143 175.8461 82 V 4.8077 8.9226 121.2185 60.0049 34.6119 174.2674 83 I 4.7796 8.3903 125.6861 58.4864 39.7241 174.2868 84 D 4.9024 8.5924 127.6090 53.4624 41.3525 177.3609 85 V 3.8643 8.7664 120.7229 63.4159 31.7632 177.9655 86 D 4.7182 8.3009 118.1832 55.4343 41.3179 177.6293 87 E 4.4146 8.2747 118.3699 57.2139 31.9003 177.4002 88 L 4.7358 7.4604 119.0787 53.6347 39.0633 177.2605 89 S 4.5629 7.6614 118.9940 60.9730 63.8522 176.3472 90 D 4.3639 8.0789 122.0839 57.0227 40.7286 178.2481 91 F 4.2783 8.2546 120.6475 61.6000 39.1880 177.2164 92 S 3.8549 8.3032 114.5092 61.2757 62.5122 176.4909 93 A 4.0445 8.0862 123.8528 55.1920 17.9276 179.8660 94 S 4.0164 7.8173 111.5759 60.9260 63.0543 175.7738 95 W 3.8787 7.3679 119.4705 55.2097 29.2006 175.4740 96 E 3.6802 8.0367 118.7950 57.0320 27.9081 174.8096 97 I 3.8681 7.4623 118.2986 61.2098 37.5266 176.3506 98 K 4.5380 8.5950 124.3720 57.1015 34.0114 176.0052 99 A 5.1926 7.7537 119.3494 50.7765 22.3391 175.4714 100 T 4.7241 8.7647 109.8262 58.9937 72.2226 171.6183 101 P 4.7197 0.0000 0.0000 62.9093 33.3436 174.7747 102 T 4.8115 8.3945 119.0510 61.8066 71.3207 172.9618 103 F 5.2424 9.5121 125.8222 55.8793 41.3965 174.5826 104 F 5.1660 9.3936 123.3026 55.8975 41.5781 174.8120 105 F 5.1432 9.5112 122.8037 56.3360 40.6392 174.8301 106 L 5.4512 9.4395 124.2081 52.9207 45.3577 175.3919 107 R 4.7354 8.8431 124.3739 55.0123 32.2562 175.7134 108 D 4.3271 9.8913 126.7868 55.5286 38.6104 174.6016 109 G 4.1640 8.6139 103.6777 45.7068 0.0000 173.7939 110 Q 4.7233 7.9118 117.3696 53.5172 31.0955 174.7834 111 Q 4.6966 8.7666 121.4126 56.7590 29.3744 175.9321 112 V 4.3890 8.7298 118.6586 61.9987 33.7501 174.8038 113 D 4.5588 8.0495 118.3079 53.9917 44.6222 173.7244 114 K 5.1081 8.3647 119.8955 55.4381 35.2188 174.2391 115 L 4.8027 9.1885 128.2478 53.4762 45.7744 174.7167 116 V 4.5836 8.5701 125.9419 62.3045 33.3040 174.9288 117 G 3.9916 9.1490 114.6853 44.8468 0.0000 174.0532 118 A 4.4034 8.4107 124.3929 50.5469 17.2995 176.5091 119 N 4.8254 7.7553 117.9593 50.6449 40.9061 174.1314 120 K 4.0720 8.4057 127.7149 59.1618 32.3329 177.2845 121 P 4.3200 0.0000 0.0000 65.7450 31.2066 178.3397 122 E 3.9717 8.6469 118.0600 58.8338 29.5373 178.4538 123 L 3.9280 7.9079 120.4944 58.3661 42.1597 178.4286 124 H 4.2541 8.4670 118.0470 59.3925 29.8533 177.3006 125 K 3.9076 8.2158 120.2251 59.5006 31.8612 179.5299 126 K 3.7661 8.3036 118.9393 59.1239 31.9163 179.5671 127 I 3.7125 7.7629 120.4258 64.5664 37.0674 178.5780 128 T 3.8029 7.7603 110.3670 64.6905 68.4759 176.3388 129 A 3.9154 7.9920 123.7067 54.8897 18.1941 179.4998 130 I 3.6035 7.4657 115.9905 64.1068 38.0934 177.8344 131 L 4.1784 7.9030 119.8085 57.5187 41.2267 178.8417 132 D 4.3788 8.0625 117.8255 56.6998 41.2196 177.3751 133 S 4.5186 7.5104 111.8439 57.3817 63.8105 174.3761 134 L 4.1259 7.0171 123.2024 54.2199 42.2008 175.4226 135 P 4.5025 0.0000 0.0000 61.6502 32.4170 175.3425 136 P 4.4266 0.0000 0.0000 66.4485 30.4997 178.6475 137 S 4.2709 8.1143 112.2030 60.3820 63.1408 174.8811 138 D 4.8014 8.1851 120.5274 54.0830 41.6673 176.3755 139 K 4.1874 7.5537 123.1122 56.6025 32.1372 176.6396 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 G 8.20 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 0.00 0.00 0.00 0.00 3 L 8.22 4.93 0.00 1.80 1.63 0.94 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 4 C 9.77 5.19 0.00 2.84 3.27 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 5 L 8.75 4.63 0.00 1.60 1.66 0.95 0.89 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 6 A 8.81 4.31 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 *16 E 8.74 4.12 0.00 2.12 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 2.27 2.38 0.00 17 P 0.00 4.44 0.00 2.25 2.07 0.00 4.03 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 18 H 8.55 4.64 0.00 3.15 3.32 0.00 5.66 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 7.69 4.70 1.90 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 1.44 0.55 0.94 0.00 0.00 20 E 8.67 4.29 0.00 2.00 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 0.00 2.30 2.34 0.00 21 L 8.54 4.44 0.00 1.64 1.73 0.86 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.65 4.77 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 23 G 8.11 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 24 G 8.09 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 25 N 8.74 4.58 0.00 2.61 2.70 0.00 0.00 6.86 7.19 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 26 V 7.39 3.98 2.20 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 0.99 0.00 0.00 0.80 0.00 0.00 27 H 9.14 4.86 0.00 3.11 3.20 0.00 5.67 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.62 4.52 0.00 1.65 1.58 0.91 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 29 I 9.08 4.47 1.86 0.00 0.00 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 1.32 1.51 1.00 0.00 0.00 30 T 8.42 4.76 4.24 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 1.20 0.00 0.00 31 T 7.50 4.66 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 32 K 8.49 3.65 0.00 1.75 1.81 0.00 1.66 0.00 0.00 1.87 0.00 0.00 3.08 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.15 1.37 7.81 33 E 8.11 4.00 0.00 2.18 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 0.00 2.35 2.39 0.00 34 R 8.07 3.80 0.00 2.01 2.01 0.00 3.13 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 35 W 7.87 4.09 0.00 3.00 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 36 D 8.18 4.26 0.00 2.90 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 37 Q 8.62 3.89 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 38 K 8.14 3.84 0.00 1.55 1.64 0.00 1.60 0.00 0.00 1.51 0.00 0.00 2.50 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.57 1.51 7.81 39 L 7.67 3.72 0.00 1.41 1.49 -0.56 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.17 4.04 0.00 4.01 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 41 E 8.23 3.83 0.00 2.06 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 2.26 2.30 0.00 42 A 8.10 3.97 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 43 S 8.28 3.98 0.00 3.93 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 44 R 8.09 3.96 0.00 1.92 1.97 0.00 3.19 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.89 0.00 45 D 8.08 4.71 0.00 2.72 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 46 G 7.77 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 47 K 8.28 4.75 0.00 1.56 1.71 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.38 7.81 48 I 8.29 4.21 1.94 0.00 0.00 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 1.29 0.67 1.10 0.00 0.00 49 V 8.92 4.60 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 0.64 0.00 0.00 0.80 0.00 0.00 50 L 8.91 4.76 0.00 1.10 0.79 -0.04 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 51 A 9.20 4.93 1.40 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 0.00 0.00 0.00 52 N 8.85 4.48 0.00 2.14 2.55 0.00 0.00 6.76 7.25 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 53 F 9.21 4.83 0.00 2.91 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 54 S 8.98 4.93 0.00 3.52 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.83 4.62 0.03 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 56 R 8.65 3.84 0.00 2.04 2.02 0.00 3.47 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 57 W 7.40 4.40 0.00 3.53 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 58 C 7.30 4.61 0.00 1.83 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 59 G 8.84 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 60 P 0.00 4.28 0.00 2.13 2.29 0.00 3.58 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 2.21 2.20 0.00 61 S 7.81 4.02 0.00 3.91 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 62 R 7.91 4.07 0.00 2.03 1.98 0.00 3.14 0.00 0.00 3.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 63 Q 8.11 3.98 0.00 2.15 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.00 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 64 I 7.95 4.08 2.02 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.59 1.17 0.00 0.00 65 A 7.66 4.15 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.25 0.00 2.36 2.38 0.00 3.92 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.08 0.00 67 Y 8.11 4.25 0.00 3.06 3.27 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 68 Y 8.62 4.20 0.00 3.31 3.27 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 69 I 8.17 3.50 2.04 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 1.56 0.71 0.89 0.00 0.00 70 E 8.27 3.82 0.00 2.06 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 0.00 2.35 2.46 0.00 71 L 7.96 3.90 0.00 1.70 1.81 0.60 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 72 S 6.98 2.00 0.00 3.08 2.94 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 73 E 7.37 4.01 0.00 1.97 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 2.14 2.32 0.00 74 N 7.78 4.22 0.00 2.54 2.26 0.00 0.00 6.80 6.83 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 75 Y 7.79 4.81 0.00 3.31 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 76 P 0.00 4.45 0.00 2.17 2.14 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 77 S 8.24 4.28 0.00 4.01 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 78 L 7.91 4.84 0.00 1.98 1.53 0.86 0.74 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 79 M 8.75 4.47 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 80 F 9.05 5.06 0.00 2.77 2.72 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 0.00 0.00 0.00 81 L 9.37 5.51 0.00 1.54 1.56 0.67 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.92 4.81 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 0.95 0.00 0.00 0.91 0.00 0.00 83 I 8.39 4.78 1.01 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.77 0.84 0.00 0.00 84 D 8.59 4.90 0.00 2.70 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 85 V 8.77 3.86 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 1.05 0.00 0.00 0.96 0.00 0.00 86 D 8.30 4.72 0.00 2.95 2.83 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 87 E 8.27 4.41 0.00 2.05 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 0.00 2.41 2.48 0.00 88 L 7.46 4.74 0.00 1.76 1.76 0.76 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.66 4.56 0.00 4.09 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 90 D 8.08 4.36 0.00 2.78 2.81 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 91 F 8.25 4.28 0.00 2.96 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 92 S 8.30 3.85 0.00 3.95 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 93 A 8.09 4.04 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 94 S 7.82 4.02 0.00 4.01 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 95 W 7.37 3.88 0.00 2.60 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 96 E 8.04 3.68 0.00 1.99 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 2.21 2.23 0.00 97 I 7.46 3.87 1.76 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.40 0.88 0.00 0.00 98 K 8.59 4.54 0.00 1.69 1.83 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.57 7.81 99 A 7.75 5.19 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 0.00 100 T 8.76 4.72 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 1.05 0.00 0.00 101 P 0.00 4.72 0.00 1.39 1.91 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.03 0.00 102 T 8.39 4.81 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 0.85 0.00 0.00 103 F 9.51 5.24 0.00 2.97 2.78 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 0.00 104 F 9.39 5.17 0.00 3.32 3.25 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 0.00 105 F 9.51 5.14 0.00 3.29 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 0.00 106 L 9.44 5.45 0.00 1.60 1.69 1.23 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.84 4.74 0.00 2.00 1.83 0.00 3.32 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 108 D 9.89 4.33 0.00 2.85 2.73 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 0.00 0.00 0.00 109 G 8.61 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 0.00 0.00 0.00 0.00 110 Q 7.91 4.72 0.00 2.31 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.94 0.00 0.00 0.00 0.00 0.00 2.26 2.59 0.00 111 Q 8.77 4.70 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.52 2.89 0.00 112 V 8.73 4.39 2.13 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 0.77 0.00 0.00 1.12 0.00 0.00 113 D 8.05 4.56 0.00 2.49 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 0.00 0.00 0.00 0.00 114 K 8.36 5.11 0.00 1.81 1.61 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.47 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.12 0.86 7.81 115 L 9.19 4.80 0.00 1.85 1.62 0.91 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.57 4.58 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 0.83 0.00 0.00 0.85 0.00 0.00 117 G 9.15 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 0.00 118 A 8.41 4.40 1.34 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 0.00 119 N 7.76 4.83 0.00 2.76 2.73 0.00 0.00 7.06 6.00 0.00 0.00 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 K 8.41 4.07 0.00 1.58 1.06 0.00 1.44 0.00 0.00 1.22 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.54 1.46 7.81 121 P 0.00 4.32 0.00 2.16 2.11 0.00 3.77 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 2.09 2.11 0.00 122 E 8.65 3.97 0.00 2.20 1.97 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 2.31 2.34 0.00 123 L 7.91 3.93 0.00 1.75 1.89 0.40 0.71 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 0.00 124 H 8.47 4.25 0.00 3.62 3.55 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 8.22 3.91 0.00 1.97 1.80 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.69 7.81 126 K 8.30 3.77 0.00 1.78 1.01 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.36 1.57 7.81 127 I 7.76 3.71 1.76 0.00 0.00 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 1.66 1.38 0.12 0.00 0.00 128 T 7.76 3.80 4.24 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 1.27 0.00 0.00 129 A 7.99 3.92 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 0.00 130 I 7.47 3.60 1.71 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 1.54 0.72 1.00 0.00 0.00 131 L 7.90 4.18 0.00 1.80 1.75 1.06 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 132 D 8.06 4.38 0.00 2.74 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 0.00 133 S 7.51 4.52 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 0.00 134 L 7.02 4.13 0.00 1.73 1.66 0.99 0.98 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 0.00 135 P 0.00 4.50 0.00 2.22 2.18 0.00 3.73 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 2.18 1.96 0.00 136 P 0.00 4.43 0.00 2.28 2.38 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 137 S 8.11 4.27 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 0.00 138 D 8.19 4.80 0.00 2.72 2.75 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 0.00 139 K 7.55 4.19 0.00 1.88 1.73 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.25 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.54 7.81 * Residues marked with a * may have inaccurate shift predictions.