NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 L 4.3432 8.0433 120.6283 54.6968 43.2820 178.4727 32 E 3.9256 8.2473 119.6536 57.6800 30.1716 174.6514 33 E 4.0471 8.1939 119.4840 59.3961 29.6141 178.0779 34 Q 4.0966 8.0120 118.2902 58.0937 29.0007 176.7888 35 L 4.2565 7.3659 119.8371 57.3120 42.4961 176.4548 36 N 4.5369 8.0210 117.1010 54.8071 38.9162 176.3967 37 K 3.8373 7.8724 118.6814 59.9480 32.5076 178.8282 38 S 4.0383 7.4907 109.6473 61.5010 62.2008 176.0654 39 L 3.9803 8.0812 122.9530 57.6419 41.6929 178.8268 40 K 3.9568 7.8205 119.3647 59.5892 32.2077 178.7270 41 T 3.8513 8.8540 117.2159 66.7034 68.2563 176.7235 42 I 3.7572 8.0261 121.5548 64.0771 37.3059 178.0378 43 A 3.9694 7.9650 121.8557 55.5116 18.2203 179.5983 44 S 4.1881 8.3873 110.9984 60.6031 62.3273 176.2106 45 Q 3.8551 7.6529 122.8391 59.5096 28.8476 177.1518 46 K 3.7566 8.2634 120.2963 59.8450 31.9667 177.9922 47 A 3.9663 8.2528 120.0172 55.3222 17.8251 179.6230 48 A 3.9278 7.9024 119.0390 55.5353 18.5512 179.7418 49 I 3.5317 8.2562 118.4857 64.8705 37.1735 178.6720 50 E 3.8440 8.8298 120.3645 59.6854 29.7979 178.3742 51 N 4.2730 8.0763 116.4335 56.9037 38.5366 176.3112 52 Y 4.1469 7.9223 119.8546 61.1863 38.9884 178.6642 53 N 4.3293 8.3774 117.1762 56.2149 38.5559 176.5416 54 Q 4.4092 8.1724 117.8578 56.8575 29.6222 176.4305 55 L 4.3223 7.4704 120.2971 57.9549 42.7574 178.0576 56 K 3.8058 8.3341 120.0628 59.3356 31.6352 178.2464 57 E 3.9280 8.1324 119.6360 59.2110 29.7435 177.7881 58 D 4.4926 7.9640 116.5269 55.0915 41.0287 177.5072 59 Y 4.2742 7.5211 120.7777 60.3510 39.4463 176.7392 60 N 3.9825 8.4165 117.3295 56.3669 38.5226 177.6920 61 T 3.9301 7.3246 117.0237 66.4762 68.5789 176.8063 62 L 3.8820 7.1998 119.5840 57.7375 41.5028 179.5759 63 K 3.8203 7.5546 117.9373 58.7924 32.1019 178.5443 64 R 3.9818 7.2646 117.9126 59.4147 30.0907 177.9815 65 E 3.9160 8.0642 118.2701 59.3791 28.1271 179.1331 66 L 3.7644 8.3619 120.0837 57.1227 41.8432 177.9371 67 S 4.5728 7.8690 114.2954 58.0531 63.2966 174.4742 68 D 5.2643 8.6238 123.8035 53.9652 41.6042 177.7995 69 R 4.3418 7.6679 117.5387 57.4313 30.7834 177.9878 70 D 4.4209 7.5361 118.8337 56.9995 40.7761 178.4724 71 D 4.3431 7.9303 119.2518 57.2538 40.8926 177.9014 72 E 4.1288 7.9347 117.7161 57.9089 29.5677 177.8311 73 V 4.1764 7.4950 116.5106 64.2707 32.6068 177.1367 74 K 4.1761 7.7678 116.8200 58.3237 32.2766 179.0162 75 R 4.1441 8.0105 118.9654 58.6975 30.1762 178.6730 76 L 3.9330 7.3351 118.7977 58.1366 41.6703 179.4166 77 R 4.1761 7.8298 113.8322 57.4917 30.2353 177.7797 78 E 4.3537 8.1072 118.5213 57.7014 29.8965 177.9642 79 D 4.5042 7.8836 119.0511 56.9645 40.9462 178.4923 80 I 3.8672 7.7081 117.7701 62.7217 36.9974 177.4082 81 A 4.0979 7.6295 122.2114 54.5179 19.0208 179.3314 82 K 3.9908 7.6044 116.4224 59.1582 32.4215 178.5984 83 E 4.0212 9.0641 120.8164 58.5393 29.6454 177.6333 84 N 4.6977 7.6831 115.0813 54.1264 38.8643 175.9830 85 E 4.3774 7.7628 120.5945 56.3602 29.7557 176.8238 86 L 4.4545 7.4113 117.0773 56.4955 42.3004 178.5316 87 R 4.0930 7.3703 116.0735 59.2040 30.1681 178.1496 88 T 3.9287 7.5569 115.8361 66.4523 68.2831 176.4051 89 K 3.9562 7.9100 119.6094 60.1218 32.6630 178.5484 90 A 4.1080 7.6249 118.9637 53.3594 18.3386 177.7774 91 E 4.4487 7.9827 116.0535 56.2981 31.3219 177.2046 92 E 4.2860 7.8218 118.1315 58.9792 29.8079 177.6775 93 E 4.2518 8.1934 116.1141 56.8839 30.3590 177.8721 94 A 4.5364 8.0130 123.7025 53.1602 20.4564 178.5321 95 D 4.5368 7.8696 115.2653 55.9219 41.5248 177.7701 96 K 4.1024 8.0026 118.2518 57.8525 32.4781 177.3383 97 L 4.3360 7.4631 119.6343 58.0913 42.8150 177.7885 98 N 4.3976 7.7159 114.6174 55.7976 38.4608 176.9911 99 K 4.3683 7.8631 119.3723 57.7517 32.2956 177.7590 100 E 4.4043 7.8864 116.8690 56.6736 29.9387 177.1608 101 V 4.1697 7.2243 118.5990 64.2672 33.1248 176.8825 102 E 3.9098 8.4204 119.3938 59.4359 29.4307 178.5531 103 D 4.3671 8.0376 118.8341 57.1273 40.8483 178.4522 104 L 3.9154 7.8485 120.2647 58.9126 42.2203 178.4041 105 T 3.8148 8.4033 115.5781 67.1517 68.5457 176.2333 106 A 4.1419 8.3793 122.4770 54.9556 18.1717 179.4504 107 S 4.2739 7.8828 111.7221 60.9695 62.5645 175.9900 108 L 4.0801 7.9789 123.4566 57.9885 41.4361 178.6285 109 F 4.2682 8.4607 120.3362 60.7856 39.1807 176.6195 110 D 4.4722 7.8555 117.2805 56.8482 40.8742 178.4566 111 E 3.7007 7.8917 117.7112 59.3074 29.2072 179.2021 112 A 4.0043 7.9481 120.1735 54.3242 18.3037 179.0074 113 N 4.2815 7.3368 113.5217 55.6046 39.4458 177.3363 114 N 4.3037 8.7877 118.7475 56.5886 38.4450 176.2524 115 L 4.0652 8.0201 122.8090 57.0994 41.8920 178.5619 116 V 3.5183 7.6851 120.2370 66.8150 31.8983 177.6519 117 A 4.0043 8.2997 120.7073 55.1534 17.9432 178.2011 118 D 4.5938 8.1716 116.3484 54.1167 40.2215 177.6687 119 A 4.3123 8.0701 121.8510 53.2646 19.5865 178.0135 120 R 4.4982 7.7379 117.0764 56.1634 31.1713 177.6384 *122 E 4.3595 8.0403 117.4549 55.8870 31.9459 178.1884 123 K 4.0646 7.9430 120.2477 59.6004 32.6092 178.2834 124 Y 4.3706 8.5215 117.2885 59.8893 37.9398 178.3718 125 A 4.0651 8.0179 121.8634 55.0335 18.6434 178.8318 126 I 4.0929 7.2320 114.7946 62.0943 37.8293 177.5516 127 E 4.0681 8.1100 121.7979 59.3787 29.6880 178.5699 128 I 3.8985 7.6566 119.2220 64.1404 36.9450 178.4777 129 L 4.0492 7.5806 119.1863 57.6022 41.0673 178.4577 130 N 4.6390 7.8621 114.6711 54.1776 38.6640 177.3140 131 K 4.0602 7.8184 121.4044 59.0941 32.5811 179.1914 132 R 3.9632 7.8818 115.8803 59.3947 29.0400 178.7124 133 L 4.0380 7.7744 119.7413 57.5757 41.0194 179.2345 134 T 3.8980 7.7510 114.8672 65.5187 68.6101 176.3821 135 E 4.3164 8.2771 119.7841 57.8324 29.4278 177.9738 136 Q 4.2241 8.1982 117.4940 57.4243 28.7972 177.3895 137 L 4.2965 7.3226 118.4840 56.1696 42.2626 178.2356 138 R 5.1368 7.1827 115.8808 57.1680 30.3696 177.7784 139 E 4.1388 8.0622 117.6767 57.6096 29.7848 177.3527 140 K 4.4138 7.4038 116.5611 56.6046 32.7932 175.7745 141 D 4.8035 7.8172 118.3256 54.9515 41.3466 177.3783 *143 L 4.2729 7.9443 119.2258 54.2448 43.7260 176.0174 144 L 4.3287 7.6121 123.9345 55.9007 42.3477 175.6492 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 31 L 8.04 4.34 0.00 1.69 1.74 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.25 3.93 0.00 2.01 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 2.29 2.37 0.00 33 E 8.19 4.05 0.00 2.07 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 2.37 2.42 0.00 34 Q 8.01 4.10 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.65 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 35 L 7.37 4.26 0.00 1.83 1.74 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.02 4.54 0.00 2.98 2.78 0.00 0.00 6.98 6.89 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 37 K 7.87 3.84 0.00 1.83 1.88 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.54 7.81 38 S 7.49 4.04 0.00 4.01 3.89 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 39 L 8.08 3.98 0.00 1.85 1.84 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 40 K 7.82 3.96 0.00 1.86 1.90 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.52 7.81 41 T 8.85 3.85 4.41 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 1.21 0.00 0.00 42 I 8.03 3.76 2.08 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 1.58 0.85 0.91 0.00 0.00 43 A 7.97 3.97 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 44 S 8.39 4.19 0.00 3.89 3.86 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 45 Q 7.65 3.86 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.51 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 46 K 8.26 3.76 0.00 1.86 1.94 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.49 7.81 47 A 8.25 3.97 1.39 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 0.00 0.00 48 A 7.90 3.93 1.45 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 49 I 8.26 3.53 1.99 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 1.40 0.96 0.95 0.00 0.00 50 E 8.83 3.84 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 2.43 0.00 51 N 8.08 4.27 0.00 3.00 2.88 0.00 0.00 6.68 7.71 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 52 Y 7.92 4.15 0.00 2.79 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 53 N 8.38 4.33 0.00 2.84 2.88 0.00 0.00 6.68 7.11 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 54 Q 8.17 4.41 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 55 L 7.47 4.32 0.00 1.84 1.72 0.91 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.33 3.81 0.00 1.54 1.66 0.00 1.22 0.00 0.00 1.08 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.47 7.81 57 E 8.13 3.93 0.00 2.32 1.83 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 2.31 2.36 0.00 58 D 7.96 4.49 0.00 2.90 2.68 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 59 Y 7.52 4.27 0.00 2.97 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.42 3.98 0.00 2.80 2.84 0.00 0.00 7.14 7.52 0.00 0.00 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 T 7.32 3.93 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 1.18 0.00 0.00 62 L 7.20 3.88 0.00 1.82 1.60 0.95 0.80 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 63 K 7.55 3.82 0.00 1.02 1.40 0.00 1.76 0.00 0.00 1.52 0.00 0.00 2.63 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.31 7.81 64 R 7.26 3.98 0.00 2.06 2.06 0.00 3.12 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.62 0.00 65 E 8.06 3.92 0.00 2.02 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 0.00 2.30 2.44 0.00 66 L 8.36 3.76 0.00 1.73 1.65 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.87 4.57 0.00 3.98 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 68 D 8.62 5.26 0.00 2.73 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 69 R 7.67 4.34 0.00 1.79 1.95 0.00 3.40 0.00 0.00 3.32 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.63 0.00 70 D 7.54 4.42 0.00 2.78 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 71 D 7.93 4.34 0.00 2.80 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 72 E 7.93 4.13 0.00 2.05 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 2.30 2.31 0.00 73 V 7.50 4.18 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 1.00 0.00 0.00 0.95 0.00 0.00 74 K 7.77 4.18 0.00 1.85 1.84 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.65 7.81 75 R 8.01 4.14 0.00 1.86 1.96 0.00 3.14 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.90 0.00 76 L 7.34 3.93 0.00 1.89 1.71 0.92 0.90 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 77 R 7.83 4.18 0.00 1.89 1.97 0.00 3.14 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 1.66 1.74 0.00 78 E 8.11 4.35 0.00 2.19 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 2.26 2.52 0.00 79 D 7.88 4.50 0.00 2.81 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 80 I 7.71 3.87 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 1.57 0.72 0.91 0.00 0.00 81 A 7.63 4.10 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 82 K 7.60 3.99 0.00 1.90 1.81 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.44 7.81 83 E 9.06 4.02 0.00 2.11 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 2.30 2.39 0.00 84 N 7.68 4.70 0.00 2.98 2.83 0.00 0.00 6.50 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 85 E 7.76 4.38 0.00 2.08 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 2.28 2.19 0.00 86 L 7.41 4.45 0.00 1.75 1.68 0.92 0.85 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 87 R 7.37 4.09 0.00 1.86 1.98 0.00 3.33 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 88 T 7.56 3.93 4.41 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 1.25 0.00 0.00 89 K 7.91 3.96 0.00 1.97 2.07 0.00 1.50 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.51 7.81 90 A 7.62 4.11 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 91 E 7.98 4.45 0.00 2.07 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 2.22 2.30 0.00 92 E 7.82 4.29 0.00 2.05 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 0.00 2.36 2.67 0.00 93 E 8.19 4.25 0.00 2.01 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 0.00 2.34 2.32 0.00 94 A 8.01 4.54 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 95 D 7.87 4.54 0.00 2.71 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 96 K 8.00 4.10 0.00 1.86 1.81 0.00 1.81 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.49 7.81 97 L 7.46 4.34 0.00 1.78 1.85 0.92 0.67 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 98 N 7.72 4.40 0.00 2.82 2.85 0.00 0.00 7.11 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 99 K 7.86 4.37 0.00 1.75 1.84 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.42 1.46 7.81 100 E 7.89 4.40 0.00 2.07 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 2.39 2.48 0.00 101 V 7.22 4.17 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 1.06 0.00 0.00 0.99 0.00 0.00 102 E 8.42 3.91 0.00 2.37 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 2.29 2.33 0.00 103 D 8.04 4.37 0.00 2.85 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 0.00 104 L 7.85 3.92 0.00 1.76 1.84 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 105 T 8.40 3.81 4.34 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 1.18 0.00 0.00 106 A 8.38 4.14 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 0.00 107 S 7.88 4.27 0.00 3.95 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 0.00 108 L 7.98 4.08 0.00 1.86 1.95 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 109 F 8.46 4.27 0.00 3.26 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 0.00 110 D 7.86 4.47 0.00 2.82 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 0.00 111 E 7.89 3.70 0.00 2.23 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 2.33 2.36 0.00 112 A 7.95 4.00 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 0.00 113 N 7.34 4.28 0.00 2.68 2.71 0.00 0.00 6.86 6.80 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 0.00 114 N 8.79 4.30 0.00 2.73 2.85 0.00 0.00 6.69 6.62 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 0.00 115 L 8.02 4.07 0.00 1.97 1.69 0.91 0.86 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 0.00 116 V 7.69 3.52 2.02 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 0.85 0.00 0.00 0.95 0.00 0.00 117 A 8.30 4.00 1.39 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 0.00 0.00 118 D 8.17 4.59 0.00 2.86 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 0.00 119 A 8.07 4.31 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 0.00 120 R 7.74 4.50 0.00 2.08 2.07 0.00 3.45 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.85 0.00 *122 E 8.04 4.36 0.00 2.07 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 2.31 2.49 0.00 123 K 7.94 4.06 0.00 1.90 2.00 0.00 1.53 0.00 0.00 1.60 0.00 0.00 2.62 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.26 1.41 7.81 124 Y 8.52 4.37 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.02 4.07 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 0.00 126 I 7.23 4.09 1.96 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 1.60 0.87 0.91 0.00 0.00 127 E 8.11 4.07 0.00 2.18 2.01 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 2.24 2.24 0.00 128 I 7.66 3.90 1.90 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 0.92 0.93 0.00 0.00 129 L 7.58 4.05 0.00 1.94 1.71 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 130 N 7.86 4.64 0.00 2.85 2.83 0.00 0.00 6.98 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 0.00 131 K 7.82 4.06 0.00 1.95 1.84 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.58 7.81 132 R 7.88 3.96 0.00 2.03 2.19 0.00 2.96 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 133 L 7.77 4.04 0.00 1.67 1.75 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.75 3.90 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 0.00 135 E 8.28 4.32 0.00 2.07 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 2.28 2.51 0.00 136 Q 8.20 4.22 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.76 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 137 L 7.32 4.30 0.00 1.66 1.71 0.94 0.86 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 0.00 138 R 7.18 5.14 0.00 2.03 1.96 0.00 3.13 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.47 0.00 139 E 8.06 4.14 0.00 2.12 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 2.31 0.00 140 K 7.40 4.41 0.00 2.09 1.96 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.46 7.81 141 D 7.82 4.80 0.00 2.91 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *143 L 7.94 4.27 0.00 1.61 1.72 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.61 4.33 0.00 1.59 1.58 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.