NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.2854 0.0000 0.0000 62.5785 32.5449 175.5125 2 Q 4.1616 8.4585 120.1053 53.4960 30.0540 169.5763 3 V 4.1125 8.0824 126.6554 61.3805 33.1354 175.4194 4 T 4.2294 8.3517 117.5386 61.5946 69.6577 173.9461 5 L 4.8122 7.7060 119.0267 54.3691 42.2749 178.1471 6 W 4.4700 8.2875 121.5170 59.1708 29.1194 176.1653 7 Q 4.7592 7.7757 114.7424 53.3864 31.0736 175.1775 8 R 4.0826 8.3240 118.8035 55.8111 30.6096 176.7253 9 P 4.6602 0.0000 0.0000 62.7761 29.5300 173.4110 10 L 5.0882 7.9133 126.1656 54.3929 43.6458 175.8198 11 V 4.6078 8.8427 116.0333 60.1093 36.7618 174.0042 12 T 5.0694 8.4334 117.9184 62.4127 69.7490 174.7189 13 I 4.8678 9.0230 118.9385 58.9199 41.6746 174.0681 14 K 4.9782 8.7276 123.3162 54.7524 35.5124 175.0312 15 I 4.2889 8.7366 127.5526 59.3118 40.5902 174.9340 16 G 3.8269 9.1080 121.3895 46.8817 0.0000 172.2242 17 G 3.9534 8.0671 98.4922 46.4518 0.0000 172.5188 18 Q 4.6658 7.7115 118.2267 53.6475 31.5164 174.9353 19 L 4.9826 8.5139 123.7404 53.8240 43.5735 175.9379 20 K 4.6563 8.9598 120.6898 55.2007 37.2701 174.5673 21 E 4.9649 8.6551 122.4277 55.6449 30.9550 175.1084 22 A 4.8409 8.8243 126.1061 50.6195 23.4584 174.7404 23 L 4.8241 8.9640 123.3593 53.9745 44.1167 175.5413 24 L 4.7562 8.6989 126.8739 53.7022 42.5700 175.7411 25 D 4.9091 8.9390 125.0651 52.4720 43.1772 176.6620 26 T 3.9990 8.9321 116.8301 63.5846 69.2699 175.3221 27 G 3.8036 8.6217 110.4611 45.1438 0.0000 172.9208 28 A 4.5516 7.5275 123.3247 50.0602 19.9786 178.0030 29 D 4.4331 8.9038 123.2119 57.1610 41.7915 176.2286 30 D 5.2970 8.0245 116.2695 52.5876 45.4540 174.9949 31 T 4.8648 7.9197 116.8076 62.4812 70.5207 174.3438 32 V 4.8461 9.2257 126.1914 61.1981 34.4620 174.2458 33 L 5.2035 8.8897 128.0488 52.6446 44.5429 176.1577 34 E 4.4153 10.0481 122.3841 56.1490 30.3066 176.5225 35 E 3.8337 7.6954 121.2509 57.5426 29.9665 176.2407 36 M 4.4018 8.2469 122.8175 55.0627 34.8944 174.6944 37 S 4.4807 8.3727 121.0281 57.1715 62.1021 173.0324 38 L 4.3888 7.6325 124.6311 52.0933 42.8464 175.3846 39 P 4.3505 0.0000 0.0000 63.3379 31.9308 174.9984 40 G 4.2503 8.4826 105.9405 43.7732 0.0000 172.7519 41 R 4.4065 8.3296 120.0882 54.4663 31.2569 174.7780 42 W 4.9871 7.1540 119.9158 54.6619 31.8783 173.9594 43 K 4.5669 8.6415 117.7524 53.9076 35.1732 175.0184 44 P 5.1612 0.0000 0.0000 63.0376 32.3654 175.3866 45 K 4.6461 8.8868 121.5064 55.8340 36.3118 174.1013 46 M 5.3576 8.7395 124.1334 53.5703 34.3097 175.1319 47 I 4.6203 8.7273 117.5882 59.0803 40.6932 174.8575 48 G 3.2305 8.0575 110.0114 44.0883 0.0000 173.0921 49 G 3.9396 7.2450 104.9981 45.7597 0.0000 172.2215 50 I 3.8352 8.3133 121.7510 62.9931 37.4350 175.9993 51 G 3.9901 8.3984 113.9189 44.2021 0.0000 172.3017 52 G 4.0323 7.2677 104.7567 44.1945 0.0000 172.5503 53 F 5.4497 8.9719 120.3688 55.8016 42.4658 174.7751 54 I 4.8051 8.7810 113.7236 59.1007 41.4312 173.8319 55 K 4.9240 8.5902 123.9631 55.6921 33.4854 175.7289 56 V 4.7236 9.3345 119.3405 60.0211 37.1320 173.9595 57 R 4.9581 8.6814 120.1063 54.5618 32.8705 175.1304 58 Q 5.0350 9.1537 125.5149 54.8938 30.8476 173.6988 59 Y 5.0477 9.2270 124.4312 56.3717 41.1473 174.5686 60 D 5.1449 8.7791 121.8304 52.7932 43.8988 175.7147 61 Q 3.5070 8.4049 116.8167 57.2891 26.0783 173.8154 62 I 4.4349 8.7241 119.2625 59.7467 39.7762 176.0193 63 L 4.9102 8.4540 128.8458 54.2996 42.8839 175.6147 64 I 4.8643 9.2808 126.5876 59.4239 41.9547 173.9327 65 E 4.9505 8.8783 125.3203 54.2806 32.2794 176.4591 66 I 4.4059 8.5358 130.1089 61.4094 37.8219 176.9005 *68 G 4.0122 8.0023 106.0785 43.5305 0.0000 173.0247 69 H 4.8139 8.0229 116.7738 53.2352 31.3065 173.4696 70 K 4.7577 8.6452 124.0714 56.3709 33.0399 176.4875 71 A 4.8767 8.7758 124.8295 50.6442 22.9800 174.9242 72 I 4.9036 8.9550 121.7582 58.9366 41.1794 175.0493 73 G 4.0091 8.3329 113.9701 46.7916 0.0000 171.0846 74 T 5.0706 8.5576 116.9876 63.2364 69.2234 174.8842 75 V 4.5369 8.9737 126.0881 61.0194 35.2632 173.8757 76 L 5.2378 8.7955 126.9733 53.1466 44.2010 175.3632 77 V 4.7521 8.9557 124.5809 61.4726 33.2181 174.8983 78 G 4.4492 8.4444 114.0561 44.2756 0.0000 170.8988 79 P 4.4782 0.0000 0.0000 62.8175 31.2855 176.8871 80 T 4.1605 7.6412 108.3577 61.8955 69.7316 172.8511 81 P 4.4237 0.0000 0.0000 64.9557 31.9194 176.4713 82 V 4.6125 7.2251 116.1794 59.5613 34.9153 174.9904 83 N 4.7566 8.6893 119.2316 53.3604 40.0195 174.0094 84 I 4.8819 9.2005 124.3265 59.6036 40.4591 174.4743 85 I 4.3750 9.1175 129.1173 60.2787 38.8712 175.9408 86 G 4.5428 8.4939 115.5675 43.7584 0.0000 173.9356 87 R 4.0889 8.8875 118.5342 59.2432 30.2194 179.1023 88 N 4.3785 7.6235 114.7137 55.1168 37.0570 176.2111 89 L 4.5263 7.7245 117.3904 55.6938 43.2415 178.5092 90 L 4.0567 7.9871 119.3813 57.9284 41.5540 179.5588 91 T 3.8926 7.9910 109.7364 64.9872 68.4710 176.4336 92 Q 4.1748 7.7176 118.4768 57.3383 28.7522 177.5973 93 I 4.4075 7.7492 111.8576 60.2365 38.3160 176.0531 94 G 3.8758 8.0513 108.7539 45.6711 0.0000 173.2675 95 C 4.2667 7.6286 119.9475 59.1343 31.9715 172.9166 96 T 4.7420 8.1268 115.4786 59.8454 71.6880 172.6516 97 L 4.6999 8.3425 121.8544 53.1835 43.3115 176.0219 98 N 5.0865 8.5962 120.1777 51.4477 41.9282 174.3820 99 F 4.5146 8.2159 116.0716 57.3601 37.6986 173.9839 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 P 0.00 4.29 0.00 2.20 2.14 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.98 0.00 2 Q 8.46 4.16 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.80 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 3 V 8.08 4.11 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 0.90 0.00 0.00 0.94 0.00 0.00 4 T 8.35 4.23 4.14 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 1.26 0.00 0.00 5 L 7.71 4.81 0.00 1.42 1.57 0.83 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 6 W 8.29 4.47 0.00 3.27 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 7 Q 7.78 4.76 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 8 R 8.32 4.08 0.00 1.81 1.88 0.00 3.21 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 9 P 0.00 4.66 0.00 2.11 2.21 0.00 3.68 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 2.16 1.99 0.00 10 L 7.91 5.09 0.00 1.55 1.64 0.98 0.98 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 11 V 8.84 4.61 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 0.72 0.00 0.00 0.98 0.00 0.00 12 T 8.43 5.07 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 1.21 0.00 0.00 13 I 9.02 4.87 1.87 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 1.27 1.14 0.91 0.00 0.00 14 K 8.73 4.98 0.00 1.82 1.63 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.31 1.34 7.81 15 I 8.74 4.29 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 1.12 1.19 0.88 0.00 0.00 16 G 9.11 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 17 G 8.07 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 18 Q 7.71 4.67 0.00 2.12 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.79 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 19 L 8.51 4.98 0.00 1.50 1.58 0.92 0.87 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 20 K 8.96 4.66 0.00 1.63 1.63 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.37 7.81 21 E 8.66 4.96 0.00 1.97 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 2.24 2.31 0.00 22 A 8.82 4.84 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.96 4.82 0.00 1.75 1.52 0.92 0.50 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 24 L 8.70 4.76 0.00 1.54 1.60 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 25 D 8.94 4.91 0.00 2.74 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 26 T 8.93 4.00 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 27 G 8.62 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 28 A 7.53 4.55 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 29 D 8.90 4.43 0.00 2.62 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 30 D 8.02 5.30 0.00 2.56 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 31 T 7.92 4.86 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 1.24 0.00 0.00 32 V 9.23 4.85 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 0.98 0.00 0.00 0.93 0.00 0.00 33 L 8.89 5.20 0.00 1.55 1.50 0.88 0.77 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 34 E 10.05 4.42 0.00 1.70 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 2.33 2.25 0.00 35 E 7.70 3.83 0.00 1.96 1.87 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 2.30 2.30 0.00 36 M 8.25 4.40 0.00 1.85 1.93 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 37 S 8.37 4.48 0.00 3.86 3.80 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 0.00 0.00 0.00 38 L 7.63 4.39 0.00 0.70 1.00 0.72 0.45 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 39 P 0.00 4.35 0.00 2.22 2.08 0.00 3.68 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 1.99 1.96 0.00 40 G 8.48 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 0.00 0.00 0.00 0.00 41 R 8.33 4.41 0.00 1.74 1.76 0.00 3.07 0.00 0.00 3.10 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.31 0.00 42 W 7.15 4.99 0.00 3.05 1.74 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 43 K 8.64 4.57 0.00 1.76 1.66 0.00 1.70 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.35 7.81 44 P 0.00 5.16 0.00 2.01 2.14 0.00 3.68 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 45 K 8.89 4.65 0.00 1.87 1.65 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.47 7.81 46 M 8.74 5.36 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.74 0.00 47 I 8.73 4.62 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.10 0.95 0.00 0.00 48 G 8.06 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 0.00 0.00 0.00 49 G 7.25 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 50 I 8.31 3.84 1.83 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 0.54 0.89 0.00 0.00 51 G 8.40 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 52 G 7.27 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 0.00 0.00 0.00 53 F 8.97 5.45 0.00 2.86 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 54 I 8.78 4.81 1.90 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 1.11 0.80 0.93 0.00 0.00 55 K 8.59 4.92 0.00 1.83 1.76 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.61 1.51 7.81 56 V 9.33 4.72 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 0.78 0.00 0.00 1.03 0.00 0.00 57 R 8.68 4.96 0.00 1.51 1.03 0.00 2.21 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.11 0.00 58 Q 9.15 5.03 0.00 2.16 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.75 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 59 Y 9.23 5.05 0.00 3.01 2.88 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 60 D 8.78 5.14 0.00 2.59 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 61 Q 8.40 3.51 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 62 I 8.72 4.43 1.89 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 1.20 1.06 0.89 0.00 0.00 63 L 8.45 4.91 0.00 1.64 1.57 1.00 0.98 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 64 I 9.28 4.86 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 1.10 0.52 0.91 0.00 0.00 65 E 8.88 4.95 0.00 2.03 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 0.00 2.27 2.29 0.00 66 I 8.54 4.41 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 1.23 1.07 0.91 0.00 0.00 *68 G 8.00 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 69 H 8.02 4.81 0.00 3.40 3.19 0.00 5.81 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.65 4.76 0.00 1.65 1.74 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.45 7.81 71 A 8.78 4.88 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 72 I 8.96 4.90 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 1.18 1.06 0.92 0.00 0.00 73 G 8.33 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 74 T 8.56 5.07 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 1.26 0.00 0.00 75 V 8.97 4.54 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 1.09 0.00 0.00 0.95 0.00 0.00 76 L 8.80 5.24 0.00 1.66 1.59 0.95 0.61 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 77 V 8.96 4.75 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 0.93 0.00 0.00 0.91 0.00 0.00 78 G 8.44 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 0.00 0.00 0.00 0.00 79 P 0.00 4.48 0.00 2.18 2.13 0.00 3.76 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 80 T 7.64 4.16 4.47 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 1.23 0.00 0.00 81 P 0.00 4.42 0.00 2.19 2.21 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 82 V 7.23 4.61 2.07 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 0.76 0.00 0.00 0.92 0.00 0.00 83 N 8.69 4.76 0.00 2.86 2.77 0.00 0.00 6.65 7.29 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 84 I 9.20 4.88 1.86 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 1.22 1.10 0.90 0.00 0.00 85 I 9.12 4.38 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 1.30 0.91 0.91 0.00 0.00 86 G 8.49 4.54 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 87 R 8.89 4.09 0.00 1.85 2.01 0.00 3.14 0.00 0.00 3.39 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 88 N 7.62 4.38 0.00 2.87 2.98 0.00 0.00 6.90 7.67 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 89 L 7.72 4.53 0.00 1.69 1.73 0.93 0.69 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 90 L 7.99 4.06 0.00 1.70 1.71 0.92 0.38 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 91 T 7.99 3.89 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 1.28 0.00 0.00 92 Q 7.72 4.17 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 93 I 7.75 4.41 1.77 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 1.71 0.57 0.93 0.00 0.00 94 G 8.05 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 95 C 7.63 4.27 0.00 2.94 2.95 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 96 T 8.13 4.74 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 1.20 0.00 0.00 97 L 8.34 4.70 0.00 1.72 1.75 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.60 5.09 0.00 2.65 2.66 0.00 0.00 6.86 7.45 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 99 F 8.22 4.51 0.00 3.08 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 * Residues marked with a * may have inaccurate shift predictions.