NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -8 S 4.3047 8.3231 115.4143 56.7045 64.9866 174.6656 -7 G 3.7874 8.3209 107.0216 44.9617 0.0000 172.3997 -6 L 4.3401 8.6506 121.2251 55.2578 43.1578 175.4052 -5 V 4.8593 7.5847 109.5108 56.9912 35.7725 173.4901 -4 P 4.7393 0.0000 0.0000 62.1856 32.0145 177.7938 -3 R 4.0763 8.1601 118.5555 58.3591 30.0839 177.7848 -2 G 4.6702 8.0816 105.9548 45.1191 0.0000 176.3397 -1 S 4.1300 8.0057 116.6338 60.4777 63.3601 173.9885 0 H 4.7658 7.6277 115.6178 53.0978 30.4037 173.8018 -6 I 4.1701 8.4906 119.3251 61.2578 39.5578 174.2051 -5 T 5.0893 7.7047 103.9108 56.5912 72.6725 171.8901 -4 V 4.4393 7.9820 118.6092 61.0856 32.8145 176.7938 -3 D 4.3763 8.2701 118.4555 56.5591 40.2839 177.7848 -2 I 4.8802 7.7516 117.0547 61.1191 39.0726 177.8397 -1 T 4.0100 7.8457 114.5338 63.9777 69.3601 174.0885 0 V 4.1558 7.2377 116.6178 60.2978 34.3037 176.0018 9 N 4.7799 9.0947 126.1340 51.8471 38.6143 175.5349 10 D 4.3740 8.5028 117.1024 56.7540 40.8431 177.3010 11 E 4.2403 8.3302 116.8646 56.0900 29.8489 176.7864 12 G 3.8999 8.4031 107.4583 45.7786 0.0000 173.4660 13 K 4.5432 8.4672 119.3620 54.2834 33.5761 176.3071 14 V 4.2383 8.9073 124.0485 63.0315 31.5444 175.5207 15 T 4.4404 8.5267 118.1699 63.3501 70.7315 174.4901 16 D 5.3655 7.8385 119.4439 52.6954 45.3324 175.2643 17 V 5.1344 8.9650 121.6933 61.6546 35.0378 174.2743 18 I 5.7175 8.1048 127.0642 58.4929 41.0857 173.7538 *20 D 4.3545 8.5732 121.1709 55.7668 41.3970 175.8069 21 G 4.0739 9.1041 111.8864 45.6666 0.0000 174.4976 22 H 4.2756 8.0580 113.5920 57.5376 29.3120 175.5531 23 A 4.3745 7.2615 124.2872 51.5297 18.8690 177.4385 *33 V 3.8942 7.6090 123.3241 63.4029 34.0135 176.8339 34 C 4.0119 7.9791 118.4899 62.3414 31.4949 174.8143 35 A 4.0402 8.0761 122.0643 55.3139 17.8659 179.4634 36 G 3.5420 8.0294 102.9938 48.0651 0.0000 175.4279 37 A 3.9382 7.9278 123.9427 54.6255 18.3043 179.8647 38 S 3.5441 8.5498 113.6698 61.5667 62.9525 176.7983 39 A 4.0083 7.9493 123.3876 55.1123 18.1006 179.9114 40 V 3.4827 7.8272 116.7352 65.9843 31.6213 177.8419 41 L 3.7243 7.7394 120.1015 58.3112 41.8213 179.0200 42 F 4.4738 7.9007 118.0247 60.4080 38.8356 178.0208 43 G 3.6397 8.2749 105.4683 47.9515 0.0000 175.9630 44 S 4.1579 8.1351 117.6590 61.1761 62.8299 176.8678 45 V 3.6574 7.8837 120.9392 66.3117 31.3506 177.8132 46 N 4.3832 8.5388 116.0648 56.2621 38.2776 177.3421 47 A 4.0174 8.1608 122.2430 55.0745 18.5996 179.6130 48 I 3.6607 7.9987 118.5415 64.7857 37.0104 178.7887 49 I 3.8602 7.6310 119.2491 64.2594 37.0225 178.3684 50 G 3.8100 8.1823 105.2086 46.1701 0.0000 174.2703 51 L 4.6538 8.0883 118.4932 54.4641 43.4500 175.6545 52 T 4.7466 7.6291 107.4041 59.6516 71.7299 173.8054 53 S 4.4376 8.4449 114.2222 58.6034 63.6952 174.0685 54 E 4.1012 7.9418 123.3576 56.2378 29.8015 176.5971 55 R 4.5055 8.1397 124.3250 53.3751 31.0433 173.2884 56 P 4.6192 0.0000 0.0000 62.1676 32.7668 175.4096 57 D 4.5349 9.0031 123.1666 53.9856 42.1678 174.9726 58 I 4.8119 8.2604 126.9205 59.6216 39.3488 174.8773 59 N 4.9211 8.6689 123.9029 51.8037 42.8537 172.9032 60 Y 5.4843 7.5719 116.9741 57.0812 40.9500 173.6922 61 D 4.7719 8.9539 121.1802 52.5896 40.6871 177.0323 62 D 4.4870 8.6398 118.2780 56.9854 40.7343 177.2993 63 N 4.6279 8.7397 115.0615 52.9576 38.8278 176.0585 64 G 3.8955 8.5452 107.6174 45.1010 0.0000 174.0695 65 G 3.8270 8.0641 108.9640 45.2196 0.0000 172.7217 66 H 4.2842 8.9659 113.7576 56.6898 26.8008 175.9662 67 F 4.7725 8.1412 121.4000 58.6081 40.8020 174.0393 68 H 5.2441 9.2906 127.9805 54.5499 32.1495 172.7725 69 I 4.4110 8.8896 128.1786 60.0132 38.8004 174.7288 70 R 5.0130 8.6758 128.6634 54.2411 32.1533 175.3003 71 S 4.5400 9.0405 123.8390 59.1951 63.0793 173.9286 72 V 3.9273 9.4509 124.2340 64.4349 32.5959 176.6226 73 D 4.6674 8.7570 126.9125 52.7818 39.6266 176.7086 74 T 4.1034 8.1803 114.8310 63.1820 69.2720 175.4007 75 N 4.6139 7.9288 118.6325 53.2516 38.8138 175.2189 76 N 4.5779 7.9732 118.4854 52.8696 39.0212 175.0183 77 D 4.3719 8.5897 129.4189 57.2564 40.9909 178.6800 78 E 3.9265 8.2156 118.4704 59.3818 29.6152 178.8786 79 A 4.0273 8.4764 120.8958 55.3741 18.3352 179.7264 80 Q 3.9390 8.3343 116.6249 58.9300 28.6796 178.6700 81 L 3.9686 8.1722 121.5316 58.2348 41.8930 179.1528 82 I 3.7186 7.7056 118.7033 64.3123 37.1092 178.0881 83 L 4.1598 7.9316 118.8848 57.9555 41.6918 179.1995 84 Q 4.2514 8.4669 118.3262 59.2034 28.4990 179.6420 85 T 4.1039 8.0099 113.8413 64.2239 68.1610 176.1728 *87 L 4.2480 7.8651 123.1543 54.9121 43.9548 179.3043 88 V 3.7782 8.1530 118.0610 66.2422 31.4110 178.0651 89 S 4.1278 8.4319 113.0801 61.3240 62.1487 176.1692 90 L 4.0215 7.8395 121.3050 57.8297 41.4446 179.1678 91 Q 4.0559 8.5365 118.4688 59.3126 28.7734 179.1136 92 T 3.8833 8.0624 116.6696 66.6072 68.4213 176.7608 93 I 3.8719 7.7009 121.3752 64.4990 36.9852 177.9700 94 E 4.0030 8.3086 119.0411 59.5609 29.4368 178.3995 95 E 4.0666 8.2071 117.7349 59.0583 29.5229 178.4146 96 E 4.0539 7.5671 117.2472 57.2731 31.3831 176.1069 97 Y 4.7741 8.0535 116.8210 56.0292 37.9875 175.7590 98 N 4.5581 8.1571 118.9787 54.8018 38.3070 176.9850 99 E 4.2710 8.1707 115.3673 57.3126 30.3346 176.5065 100 N 4.8707 7.9145 115.4110 53.0521 40.7736 174.3635 101 I 5.4684 7.5733 116.8674 59.1625 41.3734 174.4279 102 R 4.7345 8.5115 127.8330 54.6894 32.4997 173.9812 103 L 4.6448 9.1886 127.4366 53.6453 43.1144 175.8417 104 N 4.9196 8.4377 121.5075 52.0383 41.3555 172.8676 105 Y 4.7666 8.7442 124.5946 56.7516 39.1137 175.9248 106 K 4.2645 8.6306 123.0401 56.6124 31.9969 177.1350 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 -8 S 8.32 4.30 0.00 4.00 4.07 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 -7 G 8.32 3.79 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 0.00 0.00 0.00 -6 L 8.65 4.34 0.00 1.74 1.72 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 -5 V 7.58 4.86 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 0.88 0.00 0.00 0.95 0.00 0.00 -4 P 0.00 4.74 0.00 2.21 2.18 0.00 3.87 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 2.07 1.95 0.00 -3 R 8.16 4.08 0.00 1.87 2.09 0.00 3.56 0.00 0.00 3.31 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.56 0.00 -2 G 8.08 4.67 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 0.00 0.00 0.00 -1 S 8.01 4.13 0.00 4.05 4.09 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 0 H 7.63 4.77 0.00 3.22 3.33 0.00 5.75 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -6 I 8.49 4.17 1.87 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 1.31 1.80 0.91 0.00 0.00 -5 T 7.70 5.09 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 1.23 0.00 0.00 -4 V 7.98 4.44 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 1.20 0.00 0.00 0.93 0.00 0.00 -3 D 8.27 4.38 0.00 2.73 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 -2 I 7.75 4.88 1.87 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 1.10 1.19 0.91 0.00 0.00 -1 T 7.85 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 1.21 0.00 0.00 0 V 7.24 4.16 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 0.73 0.00 0.00 0.93 0.00 0.00 9 N 9.09 4.78 0.00 2.98 2.98 0.00 0.00 6.59 7.75 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 10 D 8.50 4.37 0.00 2.70 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 11 E 8.33 4.24 0.00 2.12 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 2.28 2.30 0.00 12 G 8.40 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 13 K 8.47 4.54 0.00 1.87 1.73 0.00 1.81 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.51 7.81 14 V 8.91 4.24 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 0.80 0.00 0.00 0.98 0.00 0.00 15 T 8.53 4.44 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 1.23 0.00 0.00 16 D 7.84 5.37 0.00 2.54 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 17 V 8.96 5.13 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 1.04 0.00 0.00 0.93 0.00 0.00 18 I 8.10 5.72 1.87 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.40 0.97 0.00 0.00 *20 D 8.57 4.35 0.00 2.66 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 9.10 4.07 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 0.00 0.00 0.00 22 H 8.06 4.28 0.00 3.24 3.37 0.00 5.52 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.26 4.37 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 *33 V 7.61 3.89 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 0.91 0.00 0.00 0.29 0.00 0.00 34 C 7.98 4.01 0.00 3.01 2.87 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 35 A 8.08 4.04 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 36 G 8.03 3.54 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 0.00 0.00 0.00 37 A 7.93 3.94 1.30 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 38 S 8.55 3.54 0.00 3.86 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 39 A 7.95 4.01 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 40 V 7.83 3.48 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 0.95 0.00 0.00 0.98 0.00 0.00 41 L 7.74 3.72 0.00 1.48 0.96 0.80 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.90 4.47 0.00 3.00 2.86 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 0.00 0.00 0.00 43 G 8.27 3.64 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 0.00 0.00 0.00 44 S 8.14 4.16 0.00 4.05 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 45 V 7.88 3.66 2.41 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 1.24 0.00 0.00 1.25 0.00 0.00 46 N 8.54 4.38 0.00 2.97 2.89 0.00 0.00 6.98 7.64 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 47 A 8.16 4.02 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 48 I 8.00 3.66 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 1.55 1.26 0.94 0.00 0.00 49 I 7.63 3.86 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.51 0.94 0.00 0.00 50 G 8.18 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 51 L 8.09 4.65 0.00 1.73 1.70 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.63 4.75 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 1.25 0.00 0.00 53 S 8.44 4.44 0.00 4.00 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 54 E 7.94 4.10 0.00 1.96 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 2.33 2.34 0.00 55 R 8.14 4.51 0.00 1.79 1.83 0.00 3.44 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 56 P 0.00 4.62 0.00 1.95 2.05 0.00 3.70 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 2.06 2.10 0.00 57 D 9.00 4.53 0.00 2.74 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.26 4.81 1.85 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 1.52 1.11 0.71 0.00 0.00 59 N 8.67 4.92 0.00 2.47 2.51 0.00 0.00 6.14 8.34 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 60 Y 7.57 5.48 0.00 3.17 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 61 D 8.95 4.77 0.00 3.02 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 D 8.64 4.49 0.00 2.73 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 63 N 8.74 4.63 0.00 2.84 2.87 0.00 0.00 7.14 8.47 0.00 0.00 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 G 8.55 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 65 G 8.06 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 66 H 8.97 4.28 0.00 3.45 3.38 0.00 5.81 0.00 0.00 0.00 0.00 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 F 8.14 4.77 0.00 3.38 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 68 H 9.29 5.24 0.00 3.15 3.16 0.00 5.64 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 69 I 8.89 4.41 1.93 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.85 0.95 0.00 0.00 70 R 8.68 5.01 0.00 1.69 1.77 0.00 3.38 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 71 S 9.04 4.54 0.00 3.76 3.79 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 72 V 9.45 3.93 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 0.74 0.00 0.00 0.97 0.00 0.00 73 D 8.76 4.67 0.00 2.75 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 74 T 8.18 4.10 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 1.22 0.00 0.00 75 N 7.93 4.61 0.00 2.86 2.88 0.00 0.00 6.91 8.93 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 76 N 7.97 4.58 0.00 2.98 2.81 0.00 0.00 7.20 7.87 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 77 D 8.59 4.37 0.00 2.73 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 78 E 8.22 3.93 0.00 2.19 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 2.40 2.38 0.00 79 A 8.48 4.03 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 80 Q 8.33 3.94 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.52 2.60 0.00 81 L 8.17 3.97 0.00 1.86 1.86 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 82 I 7.71 3.72 2.03 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 1.54 0.81 0.97 0.00 0.00 83 L 7.93 4.16 0.00 1.79 1.76 0.94 0.98 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 84 Q 8.47 4.25 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.07 0.00 0.00 0.00 0.00 0.00 2.71 2.57 0.00 85 T 8.01 4.10 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 1.22 0.00 0.00 *87 L 7.87 4.25 0.00 1.94 1.86 1.01 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.15 3.78 2.22 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 1.00 0.00 0.00 1.02 0.00 0.00 89 S 8.43 4.13 0.00 4.01 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 90 L 7.84 4.02 0.00 1.86 1.68 0.86 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.54 4.06 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.72 0.00 92 T 8.06 3.88 4.45 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 1.22 0.00 0.00 93 I 7.70 3.87 2.06 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.85 1.00 0.00 0.00 94 E 8.31 4.00 0.00 2.07 2.17 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 2.36 2.61 0.00 95 E 8.21 4.07 0.00 2.16 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 0.00 2.34 2.57 0.00 96 E 7.57 4.05 0.00 1.91 1.63 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 1.47 2.00 0.00 97 Y 8.05 4.77 0.00 2.97 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 98 N 8.16 4.56 0.00 2.82 3.10 0.00 0.00 6.37 7.66 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 99 E 8.17 4.27 0.00 2.11 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 0.00 2.33 2.36 0.00 100 N 7.91 4.87 0.00 2.67 2.83 0.00 0.00 6.63 8.32 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 0.00 101 I 7.57 5.47 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 1.23 1.03 1.02 0.00 0.00 102 R 8.51 4.73 0.00 1.81 1.75 0.00 3.28 0.00 0.00 3.23 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 103 L 9.19 4.64 0.00 1.75 1.56 0.91 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 104 N 8.44 4.92 0.00 2.64 2.77 0.00 0.00 7.09 7.54 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 0.00 105 Y 8.74 4.77 0.00 2.92 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 0.00 106 K 8.63 4.26 0.00 1.79 1.73 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.37 7.81 * Residues marked with a * may have inaccurate shift predictions.