NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3909 8.2649 123.5963 51.9611 19.9361 176.0006 2 N 4.8260 8.6232 118.1130 51.0232 41.3254 173.5080 3 A 4.3855 8.7654 125.8497 51.4754 20.5131 178.7065 4 F 3.6627 7.7181 119.7784 60.6885 42.2855 177.6467 5 L 3.9081 6.4721 125.4335 54.6419 39.2873 176.5792 *8 L 4.3880 8.0343 122.6874 54.3152 43.8223 178.4342 9 R 4.0367 7.8370 117.0188 55.2617 30.5297 174.7676 10 P 4.3395 0.0000 0.0000 61.8790 32.0285 176.3839 11 G 3.8326 8.4351 109.6332 46.4189 0.0000 172.9207 12 S 4.4097 8.1780 117.1434 56.4684 65.4872 174.5799 13 L 3.7922 8.3365 126.9430 55.9083 41.0706 177.6268 *15 R 4.0069 7.9500 114.3933 55.9287 31.3559 176.3207 *17 C 4.9937 8.1423 114.3274 57.1886 41.9983 174.4159 18 K 4.3333 7.8187 117.8514 56.7970 31.8901 177.1208 *21 Q 4.2702 8.0282 117.2561 56.0578 29.7116 174.2366 22 C 5.0172 9.1224 117.9412 53.7438 44.0183 173.2425 23 S 4.9702 8.3032 115.1622 56.6857 64.9030 174.5537 24 F 2.9429 7.9462 122.8552 58.1336 36.8127 174.6851 *27 A 4.1385 7.8824 127.0191 51.8690 20.7587 180.3276 28 R 4.2104 7.6589 114.5364 56.0307 29.4253 178.5796 *30 I 3.9132 7.9259 117.1435 60.8936 38.7472 177.4483 31 F 4.1669 8.1444 117.2414 58.2102 39.1140 176.6724 32 K 4.2097 8.7879 124.7797 57.2949 31.1353 175.7549 33 D 4.4892 7.7017 117.4769 53.5884 41.8978 177.5136 34 A 3.9023 8.5986 126.8734 53.0790 18.1000 179.2870 *36 R 4.2067 8.0963 120.2787 58.1680 31.9260 178.4418 37 T 3.5011 7.8499 114.3938 66.5502 68.3731 177.1195 38 K 4.3986 8.5193 120.7244 59.2815 31.7986 179.2364 39 L 3.9952 7.8321 119.7854 57.8170 42.3658 178.4862 40 F 4.2103 7.7504 120.8284 61.0822 39.4407 177.0889 41 W 4.2977 8.9977 128.6953 60.2802 30.6233 177.6282 42 I 3.6940 8.0954 113.2903 64.4585 36.5627 178.2906 43 S 4.2071 7.7716 114.9562 60.5767 63.0415 174.9473 44 Y 3.8848 7.2444 121.7779 60.1804 38.5424 177.0977 45 S 3.6444 7.5797 113.0538 59.5568 63.6878 174.7485 46 D 4.1674 7.0926 119.9118 55.5100 41.0013 177.8025 47 G 3.8301 7.8257 100.9958 45.6381 0.0000 172.5829 48 D 4.6944 8.0631 119.2533 52.5957 40.3423 177.1217 49 Q 4.1908 9.1013 126.9235 58.1361 29.0535 177.2162 50 C 4.2437 8.2663 114.4347 57.6625 40.7743 175.3119 51 A 3.8180 7.6724 123.0041 55.0181 17.8737 178.4067 52 S 4.3453 7.9202 107.2731 57.7475 63.9413 174.2213 53 S 3.5923 7.9467 117.0655 59.3463 59.9450 170.4556 54 P 4.1643 0.0000 0.0000 65.1274 31.9973 178.3116 55 C 4.5180 7.8674 116.5626 56.4777 37.2911 173.3878 56 Q 4.2226 9.0188 125.2122 54.9470 29.7405 175.2064 57 N 3.4692 9.3126 113.0365 54.4994 35.8127 175.4479 58 G 3.7448 8.2795 101.6273 46.0201 0.0000 174.4256 59 G 4.0119 7.6517 107.0709 45.6333 0.0000 173.7070 60 S 4.9033 9.2277 115.6972 56.6781 66.1134 172.8616 61 C 5.2240 8.9078 124.8618 55.4164 44.7103 172.4187 62 K 4.7150 9.1644 127.0865 54.4142 34.4789 174.8553 63 D 4.8843 8.9253 127.4088 54.7229 42.1904 174.9308 64 Q 4.5879 8.6834 122.1918 53.9802 33.3099 174.4053 65 L 4.3057 8.3579 118.4923 55.9044 41.6680 177.3749 66 Q 3.4740 9.1735 121.9181 56.2062 27.1222 173.2892 67 S 4.5042 7.4558 111.2747 58.5947 65.7331 172.4772 68 Y 5.3700 7.3436 116.9574 56.3500 40.6118 173.8355 69 I 4.5602 8.9940 113.5760 59.3434 40.7434 173.4861 70 C 5.2739 8.8338 122.9664 55.6647 38.6942 172.9268 71 F 4.6512 9.4793 123.1528 56.2759 40.1395 174.6031 72 C 5.0963 8.7391 121.3190 55.2366 40.6529 174.0456 73 L 4.4166 8.4698 120.6097 53.9901 42.0344 176.5232 74 P 4.2145 0.0000 0.0000 65.8233 31.4100 177.3990 75 A 4.0850 7.9358 118.4224 52.3075 18.6845 176.2975 76 F 5.3971 7.9504 114.3010 55.8697 43.1089 173.6318 77 E 4.5620 9.0529 119.2930 55.1348 32.7653 174.6687 78 G 4.2298 8.8062 104.2152 44.8053 0.0000 174.5186 79 R 3.8681 8.5125 119.1830 58.7753 30.2644 177.1142 80 N 4.9477 8.5637 113.1171 52.6335 38.9676 174.2242 81 C 4.4408 8.0499 113.3054 57.9306 38.3235 174.4987 82 E 3.9674 8.2743 119.3132 58.8654 29.8490 176.8327 83 T 4.2251 8.1224 117.9155 63.0074 68.7998 173.5735 84 H 4.7011 8.9316 125.0216 54.5640 28.9729 176.6171 85 K 4.0133 8.5722 125.8861 59.2937 32.0586 179.2955 86 D 4.3782 7.8847 117.2475 56.5027 40.9165 176.4732 87 D 4.8149 7.8619 117.9308 54.2785 40.7658 176.7137 88 Q 4.5281 7.5764 116.4197 55.7071 29.3964 177.1217 89 L 4.3455 7.6435 121.7518 54.2658 40.1753 175.4777 90 I 4.7607 7.1070 114.9614 58.3757 41.1130 178.1761 91 C 4.2796 9.1505 118.9408 60.1908 40.0979 176.4054 92 V 3.5797 7.6992 110.4569 62.3791 31.7423 176.0773 93 N 4.5658 8.2991 120.3718 52.7742 37.8377 174.2076 94 E 3.6344 9.0971 128.7841 57.2734 27.4473 174.7673 95 N 4.2770 8.1676 109.3868 53.6688 37.6946 174.3220 96 G 3.9982 8.9376 101.2562 45.6588 0.0000 175.7111 97 G 3.9236 8.2557 105.9308 45.3795 0.0000 174.0053 98 C 4.5065 7.9914 117.5876 56.4969 40.9590 173.6744 99 E 4.0412 8.7676 124.9196 58.6138 30.5869 177.0237 100 Q 4.0978 8.1574 113.1525 56.0058 30.7075 176.6237 101 Y 4.9610 5.3700 120.8048 57.8040 40.8489 174.7994 102 C 5.4531 8.8179 121.7576 54.9582 48.1982 173.1629 103 S 4.7378 9.0672 121.1605 56.7398 65.9819 173.1010 104 D 4.7521 8.6956 124.9214 54.3745 41.6643 175.9251 105 H 4.7887 8.5152 118.5739 54.1331 32.2463 172.8041 106 T 4.0089 8.5721 118.6649 63.0251 67.8521 174.8434 107 G 3.9641 10.5924 116.2144 45.7346 0.0000 172.1940 108 T 4.4198 6.9020 110.6008 60.7854 70.5097 172.3339 109 K 4.3575 8.3557 123.5599 56.1956 32.7576 177.1053 110 R 4.5229 8.5506 122.2892 56.2303 30.6712 175.3399 111 S 4.9399 8.9879 114.1828 56.8884 66.7823 171.9566 112 C 5.5649 8.7518 117.0277 55.5417 43.7895 173.1870 113 R 4.8500 8.9102 119.7421 55.0329 34.8159 173.0186 114 C 5.1545 8.5401 115.7768 55.2410 38.9715 174.0736 115 H 4.5452 9.1441 120.4689 55.3744 30.1651 174.3893 116 E 4.0301 8.4331 124.2616 58.2786 29.8095 177.2626 117 G 3.9754 9.9522 113.1463 45.2374 0.0000 171.8841 118 Y 5.3976 7.6182 115.5202 56.2998 42.3803 174.6791 119 S 4.8278 9.1394 115.0757 56.3047 66.9719 173.0448 120 L 4.5821 8.5160 123.7946 55.2773 42.8734 176.6800 121 L 4.4544 9.2971 126.7352 53.6975 43.0691 177.8564 122 A 4.0213 8.6354 122.6197 55.3758 18.6307 178.5781 123 D 4.3881 8.0665 114.1758 54.2378 39.6215 178.0411 124 G 4.0243 8.1777 108.1016 45.8158 0.0000 174.4166 125 V 4.3441 7.5890 110.7031 62.1476 35.1146 176.4154 126 S 4.9168 8.9419 116.1380 58.3143 64.2573 172.9430 127 C 5.5293 8.7586 119.3126 55.4804 43.1322 173.5016 128 T 4.8999 8.9833 116.9815 59.3785 70.4477 171.3459 129 P 4.3676 0.0000 0.0000 63.2208 31.7125 176.1694 130 T 4.5044 8.4876 112.6017 61.5303 69.7995 173.9590 131 V 4.4807 7.2054 114.1169 59.2027 35.7126 175.3020 132 E 3.8348 8.7987 121.5102 59.0896 29.7311 176.8713 133 Y 4.6787 7.3212 115.3714 55.1059 37.7830 173.4047 134 P 4.3302 0.0000 0.0000 62.0133 32.3024 177.2270 135 C 4.2339 8.4750 114.6258 59.5837 30.1540 174.3974 136 G 3.9359 8.8940 108.6734 45.8876 0.0000 173.3398 137 K 4.6077 7.4908 118.1737 54.3305 35.0444 176.4042 138 I 4.3348 7.9659 122.9401 58.8842 37.3406 174.3636 139 P 4.8668 0.0000 0.0000 64.8014 31.3449 178.9840 140 I 3.9243 7.8075 109.1131 62.6061 37.6629 176.2133 141 L 4.6073 7.9064 120.0534 54.4845 42.6283 176.2124 142 E 4.2389 8.1418 123.2266 56.5110 29.7120 175.0245 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 1 A 8.26 4.39 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 2 N 8.62 4.83 0.00 2.78 2.75 0.00 0.00 6.69 6.46 0.00 0.00 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 A 8.77 4.39 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 4 F 7.72 3.66 0.00 2.89 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 5 L 6.47 3.91 0.00 1.23 1.40 0.62 0.65 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 *8 L 8.03 4.39 0.00 1.82 1.78 1.05 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 9 R 7.84 4.04 0.00 1.78 1.85 0.00 3.20 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 10 P 0.00 4.34 0.00 2.01 1.95 0.00 3.70 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 11 G 8.44 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 12 S 8.18 4.41 0.00 3.73 3.65 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 13 L 8.34 3.79 0.00 1.41 1.44 0.23 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 *15 R 7.95 4.01 0.00 1.82 1.94 0.00 3.31 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 *17 C 8.14 4.99 0.00 3.16 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 18 K 7.82 4.33 0.00 1.83 1.90 0.00 1.83 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.64 7.81 *21 Q 8.03 4.27 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 22 C 9.12 5.02 0.00 3.22 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 23 S 8.30 4.97 0.00 4.08 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 24 F 7.95 2.94 0.00 2.06 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 *27 A 7.88 4.14 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 28 R 7.66 4.21 0.00 1.36 1.71 0.00 3.22 0.00 0.00 3.24 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.45 0.00 *30 I 7.93 3.91 1.57 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 1.19 0.47 0.22 0.00 0.00 31 F 8.14 4.17 0.00 2.89 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 32 K 8.79 4.21 0.00 1.88 1.96 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.31 7.81 33 D 7.70 4.49 0.00 2.73 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 34 A 8.60 3.90 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 *36 R 8.10 4.21 0.00 2.11 1.94 0.00 3.20 0.00 0.00 3.58 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 37 T 7.85 3.50 4.32 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 0.49 0.00 0.00 38 K 8.52 4.40 0.00 1.89 2.00 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.66 1.85 7.81 39 L 7.83 4.00 0.00 1.68 1.74 0.92 0.70 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 40 F 7.75 4.21 0.00 2.46 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 41 W 9.00 4.30 0.00 3.78 3.34 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 42 I 8.10 3.69 1.88 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 1.79 0.65 1.02 0.00 0.00 43 S 7.77 4.21 0.00 3.76 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 44 Y 7.24 3.88 0.00 2.01 2.34 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 45 S 7.58 3.64 0.00 3.44 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 46 D 7.09 4.17 0.00 2.92 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 47 G 7.83 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 48 D 8.06 4.69 0.00 2.70 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 49 Q 9.10 4.19 0.00 2.48 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.68 0.00 0.00 0.00 0.00 0.00 2.56 2.44 0.00 50 C 8.27 4.24 0.00 3.18 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 51 A 7.67 3.82 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 52 S 7.92 4.35 0.00 3.92 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 53 S 7.95 3.59 0.00 3.91 3.85 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 54 P 0.00 4.16 0.00 1.89 1.71 0.00 3.49 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.68 0.00 55 C 7.87 4.52 0.00 2.96 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 56 Q 9.02 4.22 0.00 2.05 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.27 6.24 0.00 0.00 0.00 0.00 0.00 2.30 2.53 0.00 57 N 9.31 3.47 0.00 1.77 1.42 0.00 0.00 6.92 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 58 G 8.28 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 0.00 0.00 0.00 59 G 7.65 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 60 S 9.23 4.90 0.00 3.76 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 61 C 8.91 5.22 0.00 2.94 2.96 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 62 K 9.16 4.71 0.00 2.18 1.93 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.50 7.81 63 D 8.93 4.88 0.00 2.86 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 64 Q 8.68 4.59 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.66 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 65 L 8.36 4.31 0.00 1.69 1.59 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 9.17 3.47 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 67 S 7.46 4.50 0.00 3.84 3.85 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 68 Y 7.34 5.37 0.00 2.95 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 69 I 8.99 4.56 1.58 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 1.38 1.02 0.79 0.00 0.00 70 C 8.83 5.27 0.00 3.05 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 71 F 9.48 4.65 0.00 3.09 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 72 C 8.74 5.10 0.00 3.02 3.14 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 0.00 73 L 8.47 4.42 0.00 2.03 1.76 1.02 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.21 0.00 2.04 2.15 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 75 A 7.94 4.09 0.70 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 76 F 7.95 5.40 0.00 3.02 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 77 E 9.05 4.56 0.00 2.13 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 2.22 2.28 0.00 78 G 8.81 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 79 R 8.51 3.87 0.00 1.76 2.00 0.00 3.22 0.00 0.00 3.10 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.56 0.00 80 N 8.56 4.95 0.00 2.96 2.98 0.00 0.00 7.00 7.38 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 81 C 8.05 4.44 0.00 3.25 3.13 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 82 E 8.27 3.97 0.00 2.12 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 2.33 2.31 0.00 83 T 8.12 4.23 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 1.25 0.00 0.00 84 H 8.93 4.70 0.00 3.32 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.57 4.01 0.00 1.72 1.78 0.00 1.68 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.41 7.81 86 D 7.88 4.38 0.00 2.62 2.70 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 87 D 7.86 4.81 0.00 2.81 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.58 4.53 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.47 0.00 0.00 0.00 0.00 0.00 2.56 2.40 0.00 89 L 7.64 4.35 0.00 1.57 1.60 0.97 0.98 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 90 I 7.11 4.76 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.55 0.91 0.00 0.00 91 C 9.15 4.28 0.00 3.15 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 92 V 7.70 3.58 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 0.66 0.00 0.00 0.93 0.00 0.00 93 N 8.30 4.57 0.00 2.78 2.90 0.00 0.00 7.17 7.56 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 94 E 9.10 3.63 0.00 2.15 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 2.21 0.00 95 N 8.17 4.28 0.00 2.96 2.82 0.00 0.00 7.56 7.91 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 96 G 8.94 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 97 G 8.26 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 0.00 0.00 0.00 98 C 7.99 4.51 0.00 3.04 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 99 E 8.77 4.04 0.00 1.93 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 0.00 2.20 2.21 0.00 100 Q 8.16 4.10 0.00 1.73 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.64 0.00 0.00 0.00 0.00 0.00 1.89 2.03 0.00 101 Y 5.37 4.96 0.00 3.02 2.74 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 0.00 102 C 8.82 5.45 0.00 3.05 2.93 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 0.00 103 S 9.07 4.74 0.00 3.72 3.55 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.70 4.75 0.00 2.51 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.52 4.79 0.00 3.29 3.17 0.00 5.81 0.00 0.00 0.00 0.00 6.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.57 4.01 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 1.22 0.00 0.00 107 G 10.59 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 0.00 108 T 6.90 4.42 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 1.22 0.00 0.00 109 K 8.36 4.36 0.00 1.82 1.71 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.45 7.81 110 R 8.55 4.52 0.00 1.98 1.91 0.00 3.09 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 111 S 8.99 4.94 0.00 3.92 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 0.00 112 C 8.75 5.56 0.00 3.01 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 0.00 113 R 8.91 4.85 0.00 1.88 1.92 0.00 3.13 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 114 C 8.54 5.15 0.00 2.82 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 0.00 115 H 9.14 4.55 0.00 2.74 3.05 0.00 5.60 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.43 4.03 0.00 1.98 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 2.37 2.45 0.00 117 G 9.95 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 0.00 118 Y 7.62 5.40 0.00 2.86 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 0.00 119 S 9.14 4.83 0.00 3.84 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 0.00 120 L 8.52 4.58 0.00 1.68 1.62 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 121 L 9.30 4.45 0.00 1.79 1.72 0.93 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.64 4.02 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 0.00 123 D 8.07 4.39 0.00 2.91 2.93 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 0.00 124 G 8.18 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 0.00 0.00 0.00 125 V 7.59 4.34 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 0.80 0.00 0.00 0.96 0.00 0.00 126 S 8.94 4.92 0.00 3.91 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 0.00 127 C 8.76 5.53 0.00 2.77 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 0.00 128 T 8.98 4.90 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 1.28 0.00 0.00 129 P 0.00 4.37 0.00 1.83 1.65 0.00 3.69 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 130 T 8.49 4.50 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 1.27 0.00 0.00 131 V 7.21 4.48 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 0.69 0.00 0.00 0.83 0.00 0.00 132 E 8.80 3.83 0.00 1.79 1.81 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 1.47 2.02 0.00 133 Y 7.32 4.68 0.00 2.98 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 0.00 134 P 0.00 4.33 0.00 1.61 1.45 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.73 0.00 135 C 8.48 4.23 0.00 3.16 3.15 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 0.00 136 G 8.89 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 0.00 137 K 7.49 4.61 0.00 1.93 1.91 0.00 1.75 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.52 1.60 7.81 138 I 7.97 4.33 1.89 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 1.43 0.96 0.93 0.00 0.00 139 P 0.00 4.87 0.00 2.31 2.31 0.00 3.94 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.27 0.00 140 I 7.81 3.92 1.89 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 1.43 0.54 0.93 0.00 0.00 141 L 7.91 4.61 0.00 1.80 1.73 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 142 E 8.14 4.24 0.00 2.01 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 2.18 2.39 0.00 * Residues marked with a * may have inaccurate shift predictions.