NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 Q 4.2115 8.2033 119.5779 55.6344 30.8504 173.4630 3 F 5.3300 8.6268 120.9619 55.0409 41.8096 173.0119 4 S 4.8628 8.9768 117.6771 57.0229 66.4076 173.8538 5 T 4.8222 8.8219 115.0369 62.5765 69.5081 174.4277 6 T 4.6468 8.0089 114.1344 60.1996 70.4902 174.3304 7 P 4.5383 0.0000 0.0000 64.7969 31.9931 175.7925 8 T 4.6882 7.5626 107.2540 59.8269 72.1015 173.0867 9 L 4.6042 8.0867 120.4190 52.4945 43.4996 176.2142 10 E 4.1098 8.7344 123.5623 58.2323 30.0047 178.0266 11 G 4.0102 9.4356 111.5764 44.9905 0.0000 172.6170 12 L 5.1985 7.6299 117.6237 53.0627 45.6090 175.5806 13 T 4.6802 8.5602 116.4569 61.6880 71.8303 173.7187 14 I 4.1995 8.4369 127.1643 61.5103 37.0483 175.8755 15 V 4.2048 8.6711 127.4332 63.3550 33.0565 175.4576 16 E 4.7129 7.6600 120.4725 55.3837 33.1168 172.9373 17 Y 4.6027 8.7947 124.6183 56.8152 39.2409 175.1174 18 C 4.6483 9.3043 121.2315 59.2565 29.6621 173.5036 19 G 3.8493 8.3937 105.8164 43.9310 0.0000 172.9333 20 V 4.3882 8.1098 119.1806 62.6526 32.1289 175.5807 21 V 4.7569 8.9974 121.2859 59.9438 35.1550 174.6116 22 T 5.0754 8.2795 111.0741 60.5466 72.1180 173.0464 23 G 4.3524 8.9037 108.7652 45.0692 0.0000 171.2402 24 E 5.7104 9.4909 118.2100 55.4147 33.0787 174.0541 25 A 4.7165 8.1992 120.2039 50.7538 22.3476 175.5885 26 I 4.6550 8.2745 121.1464 59.4521 40.0754 175.0351 27 L 4.4575 8.8070 128.1242 53.3262 42.5066 177.4119 28 G 3.8091 8.7831 112.8698 44.7677 0.0000 173.6927 29 A 4.8708 8.9740 122.7527 54.5740 18.0747 179.6945 30 N 4.3930 8.2603 114.9205 56.2765 37.2243 177.3190 31 I 4.0497 7.9195 121.6319 64.1021 37.2961 177.7984 32 F 4.1360 8.3406 121.2698 61.5455 39.0168 177.1216 33 R 4.0458 8.4992 116.4210 59.7724 30.0245 178.5841 34 D 4.3659 8.3549 117.1424 56.4226 40.8508 177.8405 35 F 4.6770 8.7056 116.4899 57.2989 41.1123 176.1925 36 F 4.2537 8.4469 116.3316 58.4440 40.4424 176.0495 37 A 4.1252 7.7241 121.7221 53.5791 18.5182 176.9885 38 G 3.9726 8.8967 108.3483 46.1751 0.0000 173.8665 39 I 3.6868 7.4094 119.7659 61.3837 37.5438 175.5021 40 R 4.6103 8.1624 123.6815 55.4566 33.2830 176.5335 41 D 4.1256 8.5333 122.5445 55.7780 38.9159 174.4765 42 I 4.3921 8.3915 127.7403 60.4273 38.9803 174.8360 43 V 4.3582 8.3621 125.0277 60.8253 33.6747 175.3598 44 G 4.0382 8.5625 115.9678 44.4470 0.0000 174.5903 45 G 3.3614 8.4904 108.5662 47.7358 0.0000 175.3330 46 R 3.9328 8.0972 120.0045 58.7403 30.1253 177.0703 47 S 4.5758 7.9467 108.6302 57.7266 63.9073 173.7403 48 G 3.8264 7.4627 111.6270 43.8693 0.0000 174.9335 49 A 3.9894 8.5952 126.8394 55.0492 19.0147 179.0623 50 Y 3.6376 8.0537 114.3881 60.3887 37.3190 178.4662 51 E 3.6609 6.4936 119.5203 58.7421 29.6844 178.9648 52 K 3.8807 7.7569 118.7119 59.1695 31.9480 179.1889 53 E 3.8393 7.5453 118.4415 59.1831 29.4762 178.9444 54 L 4.1551 8.1017 119.1111 57.8575 41.6610 179.4830 55 R 3.8906 8.2973 118.9167 59.2847 29.9772 178.2266 56 K 3.8313 7.8977 118.6534 59.6106 32.1378 178.4087 57 A 4.0114 8.1770 120.8648 55.4241 18.3353 179.8592 58 R 3.8828 8.4242 116.8640 59.1303 30.1186 178.8456 59 E 3.9821 8.4813 119.3895 59.4474 29.6932 179.0413 60 I 3.7023 7.9574 119.4871 64.2582 37.1069 178.1051 61 A 3.9590 8.0811 121.6707 55.4589 18.0886 179.7566 62 F 3.7636 8.1826 116.0190 60.3747 38.8609 177.6888 63 E 4.2014 8.3581 118.3278 59.4473 29.2685 178.8793 64 E 3.8852 8.1490 119.0560 59.2638 29.8384 178.3781 65 L 4.0487 8.1301 120.5757 58.4300 42.1080 179.3138 66 G 3.9361 9.1975 106.5956 47.9282 0.0000 175.6314 67 S 4.2143 8.6983 115.8471 61.0772 62.2685 176.2512 68 Q 3.9967 8.5575 121.1095 58.8045 28.4720 178.4895 69 A 4.0128 7.9032 121.3493 55.2113 18.3684 179.4142 70 R 3.7826 7.9856 116.9412 59.8225 29.8959 178.5763 71 A 4.0044 7.5757 119.0208 54.8916 18.4462 178.8738 72 L 4.2465 7.5592 115.5834 55.4264 41.8983 178.0478 73 G 3.8212 8.1592 107.4627 45.3300 0.0000 173.6506 74 A 4.3800 7.5889 122.1408 51.6997 19.1193 177.6685 75 D 4.9760 8.3941 116.9723 52.8792 40.6119 175.3381 76 A 4.6621 7.5126 119.7374 51.0722 23.2181 175.3959 77 V 4.7906 8.8008 119.2106 61.3848 34.6508 175.1630 78 V 4.7124 8.6916 120.4487 58.9395 35.6396 175.3672 79 G 4.1226 8.7036 108.1316 46.8290 0.0000 174.3219 80 I 4.3898 7.9348 118.8665 61.0701 38.2914 176.5120 81 D 5.0462 9.4829 125.7382 52.4041 44.2994 174.6290 82 I 4.7379 8.3864 122.3768 59.2182 40.3663 173.8600 83 D 5.0436 8.8815 127.9646 52.6508 45.1868 173.3851 84 Y 5.0577 8.7375 119.8055 56.2218 40.2529 175.0071 85 E 4.7048 8.6409 122.2114 54.7874 33.3037 175.1622 86 T 4.2877 8.5949 121.7511 63.0555 69.3993 174.4713 87 V 4.3599 8.1263 118.2617 59.8549 35.8458 175.6221 88 G 3.9824 8.5229 106.6775 45.0739 0.0000 174.7965 89 Q 4.0687 8.3848 117.5363 58.1605 28.7568 177.5556 90 N 4.8897 7.8588 113.2397 51.9376 39.5644 173.9929 91 G 3.9532 7.7510 104.7174 46.7249 0.0000 174.9118 92 S 3.1864 7.2572 111.6774 55.8420 62.9080 172.2706 *94 L 4.5331 7.1612 123.3287 54.7615 44.5836 174.9583 *96 V 4.1057 8.0596 117.2579 62.8405 32.8441 174.9207 97 S 5.2579 8.4714 122.5195 56.3284 65.9376 173.3335 98 V 4.8192 8.7700 122.9641 60.0069 34.2590 174.6243 99 S 4.9332 8.5711 116.3451 57.5230 67.0517 173.5512 100 G 4.0432 7.8636 105.8726 46.8011 0.0000 171.3576 101 T 5.2226 8.1404 116.7138 61.3178 71.4042 174.0479 102 A 4.6613 8.8811 129.7574 52.2508 19.5112 176.6555 103 V 4.6942 8.8462 115.4118 59.4611 36.7137 174.3255 104 K 5.0221 8.7058 124.9671 55.2525 33.8370 175.4023 105 T 5.0958 9.0015 116.8348 59.8241 72.0790 173.2038 106 R 4.5522 8.8576 122.6699 54.1304 33.1091 174.4784 107 R 4.2239 8.6634 126.9339 56.7414 30.5602 176.9276 108 N 4.4098 8.9952 123.9281 55.2829 39.2700 175.3477 109 I 4.0463 7.0666 124.0907 61.2679 37.5391 175.2066 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 Q 8.20 4.21 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 3 F 8.63 5.33 0.00 2.91 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 4 S 8.98 4.86 0.00 3.91 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 5 T 8.82 4.82 4.37 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 1.29 0.00 0.00 6 T 8.01 4.65 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 1.24 0.00 0.00 7 P 0.00 4.54 0.00 2.26 2.26 0.00 3.74 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 8 T 7.56 4.69 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 1.27 0.00 0.00 9 L 8.09 4.60 0.00 1.66 1.59 0.89 0.86 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 10 E 8.73 4.11 0.00 1.96 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 2.33 2.34 0.00 11 G 9.44 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 12 L 7.63 5.20 0.00 1.57 1.62 0.89 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.56 4.68 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 1.22 0.00 0.00 14 I 8.44 4.20 1.75 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.38 -0.06 0.00 0.00 15 V 8.67 4.20 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 0.70 0.00 0.00 0.91 0.00 0.00 16 E 7.66 4.71 0.00 2.00 1.65 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 2.29 2.35 0.00 17 Y 8.79 4.60 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 18 C 9.30 4.65 0.00 2.83 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 19 G 8.39 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 0.00 0.00 0.00 20 V 8.11 4.39 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 0.86 0.00 0.00 0.95 0.00 0.00 21 V 9.00 4.76 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 0.81 0.00 0.00 1.03 0.00 0.00 22 T 8.28 5.08 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 1.18 0.00 0.00 23 G 8.90 4.35 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 0.00 24 E 9.49 5.71 0.00 1.91 1.80 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 2.16 2.21 0.00 25 A 8.20 4.72 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 26 I 8.27 4.66 1.87 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 1.32 0.70 0.90 0.00 0.00 27 L 8.81 4.46 0.00 1.54 1.71 1.03 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.78 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 29 A 8.97 4.87 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 30 N 8.26 4.39 0.00 3.03 3.16 0.00 0.00 6.27 7.69 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 31 I 7.92 4.05 2.23 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.06 1.18 0.00 0.00 32 F 8.34 4.14 0.00 3.24 3.24 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 33 R 8.50 4.05 0.00 1.98 2.05 0.00 3.27 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.02 0.00 34 D 8.35 4.37 0.00 2.76 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 0.00 0.00 0.00 0.00 35 F 8.71 4.68 0.00 3.05 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 36 F 8.45 4.25 0.00 1.51 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 0.00 0.00 0.00 0.00 37 A 7.72 4.13 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 38 G 8.90 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 39 I 7.41 3.69 1.86 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.51 0.84 0.00 0.00 40 R 8.16 4.61 0.00 1.71 1.76 0.00 3.38 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 41 D 8.53 4.13 0.00 2.87 2.49 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 42 I 8.39 4.39 1.88 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 1.30 0.60 0.92 0.00 0.00 43 V 8.36 4.36 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 0.96 0.00 0.00 0.99 0.00 0.00 44 G 8.56 4.04 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 0.00 0.00 0.00 45 G 8.49 3.36 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 0.00 46 R 8.10 3.93 0.00 1.73 1.94 0.00 3.23 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 47 S 7.95 4.58 0.00 3.97 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 48 G 7.46 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 49 A 8.60 3.99 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.05 3.64 0.00 1.43 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 6.49 3.66 0.00 1.44 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 2.26 2.23 0.00 52 K 7.76 3.88 0.00 1.81 1.72 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.36 7.81 53 E 7.55 3.84 0.00 2.02 1.93 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 1.47 1.47 0.00 54 L 8.10 4.16 0.00 1.95 1.93 1.19 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 55 R 8.30 3.89 0.00 1.98 2.03 0.00 3.08 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 56 K 7.90 3.83 0.00 2.02 1.96 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.47 7.81 57 A 8.18 4.01 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 58 R 8.42 3.88 0.00 2.11 2.20 0.00 3.31 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 59 E 8.48 3.98 0.00 2.32 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 2.32 2.36 0.00 60 I 7.96 3.70 2.00 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 1.47 0.77 0.91 0.00 0.00 61 A 8.08 3.96 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 62 F 8.18 3.76 0.00 3.22 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 63 E 8.36 4.20 0.00 2.31 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 2.39 2.39 0.00 64 E 8.15 3.89 0.00 2.03 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 2.29 2.32 0.00 65 L 8.13 4.05 0.00 1.75 1.81 0.86 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 66 G 9.20 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 67 S 8.70 4.21 0.00 3.89 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 68 Q 8.56 4.00 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.39 2.66 0.00 69 A 7.90 4.01 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 70 R 7.99 3.78 0.00 2.14 1.96 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 71 A 7.58 4.00 1.38 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 0.00 0.00 0.00 72 L 7.56 4.25 0.00 1.69 1.73 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.16 3.82 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 0.00 0.00 0.00 74 A 7.59 4.38 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 75 D 8.39 4.98 0.00 2.59 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 76 A 7.51 4.66 1.12 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 0.00 0.00 0.00 0.00 0.00 77 V 8.80 4.79 2.40 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 1.17 0.00 0.00 1.03 0.00 0.00 78 V 8.69 4.71 2.32 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 0.65 0.00 0.00 1.06 0.00 0.00 79 G 8.70 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 80 I 7.93 4.39 2.11 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.78 1.00 0.00 0.00 81 D 9.48 5.05 0.00 2.49 2.49 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 82 I 8.39 4.74 1.81 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 0.97 0.54 0.96 0.00 0.00 83 D 8.88 5.04 0.00 2.76 2.39 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 84 Y 8.74 5.06 0.00 2.79 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 85 E 8.64 4.70 0.00 1.90 1.79 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 2.26 2.35 0.00 86 T 8.59 4.29 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 1.02 0.00 0.00 87 V 8.13 4.36 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 0.69 0.00 0.00 0.88 0.00 0.00 88 G 8.52 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 89 Q 8.38 4.07 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.31 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 90 N 7.86 4.89 0.00 2.60 2.72 0.00 0.00 7.05 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 91 G 7.75 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 92 S 7.26 3.19 0.00 3.70 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 *94 L 7.16 4.53 0.00 1.69 1.60 1.04 1.01 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 *96 V 8.06 4.11 1.96 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 0.50 0.00 0.00 0.99 0.00 0.00 97 S 8.47 5.26 0.00 3.80 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 98 V 8.77 4.82 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 0.30 0.00 0.00 0.32 0.00 0.00 99 S 8.57 4.93 0.00 3.83 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 0.00 100 G 7.86 4.04 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 0.00 0.00 0.00 101 T 8.14 5.22 4.35 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 1.41 0.00 0.00 102 A 8.88 4.66 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 0.00 103 V 8.85 4.69 1.78 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 0.34 0.00 0.00 0.86 0.00 0.00 104 K 8.71 5.02 0.00 1.76 1.58 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.44 7.81 105 T 9.00 5.10 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 1.12 0.00 0.00 106 R 8.86 4.55 0.00 1.79 1.75 0.00 3.09 0.00 0.00 3.08 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 107 R 8.66 4.22 0.00 1.88 1.90 0.00 3.39 0.00 0.00 3.51 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 108 N 9.00 4.41 0.00 2.71 2.87 0.00 0.00 6.89 6.73 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 0.00 109 I 7.07 4.05 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 1.15 0.58 0.90 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.