NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 45 S 4.4279 8.3349 115.4101 58.4343 64.3138 174.9056 46 D 4.2299 8.5564 120.2298 55.5323 42.2547 176.6422 47 M 3.8611 8.3670 117.8465 59.4910 33.1153 178.1418 48 T 3.7635 7.9973 112.2212 64.8899 67.1778 175.4878 49 R 3.8020 7.8944 121.0205 59.6660 30.0790 177.7684 50 D 4.3335 7.9962 117.5891 57.0352 41.3241 179.0337 51 G 3.5204 7.6828 105.7652 47.6162 0.0000 175.4076 52 L 3.8678 7.7547 122.9720 57.7616 41.8326 178.5116 53 A 3.9252 7.4177 120.4923 56.1050 18.2421 178.7381 54 N 4.4256 8.2601 115.2532 55.8321 38.7042 176.9393 55 K 3.7744 8.9021 119.5167 59.7502 32.4554 178.9325 56 A 4.2050 7.9681 120.0636 53.9931 18.7324 179.3737 57 L 3.8126 7.6012 119.0701 58.2093 41.9569 179.0589 58 A 3.9270 7.8471 119.4174 55.3519 18.6588 179.5570 59 V 3.6908 7.5095 115.1982 65.7353 31.5014 178.0865 60 A 3.9871 8.0321 120.7010 54.8775 17.6582 179.4090 61 R 4.0129 7.9198 115.9915 58.6177 29.9789 179.2037 62 T 3.9294 7.7265 115.7468 66.4612 68.7812 176.2351 63 L 4.2454 7.8191 119.9051 57.1199 41.8876 178.6938 64 A 4.2066 8.2182 119.7063 54.0991 18.3569 178.0149 65 D 4.5792 7.3667 114.1695 56.7442 42.1495 178.8435 66 S 4.4900 8.6639 114.5020 58.2022 64.3645 171.6502 67 P 4.6795 0.0000 0.0000 64.6283 32.2452 176.8449 68 E 3.9671 8.3407 116.0461 60.2516 29.0710 178.1056 69 I 3.5889 8.0925 119.6683 63.6899 37.0446 177.2940 70 R 3.9152 8.1447 120.7250 60.1120 30.0424 178.0876 71 Q 4.2883 7.8548 117.5304 57.6672 29.1649 177.6059 72 G 3.8125 10.1550 106.5815 47.8695 0.0000 175.6011 73 L 4.1092 8.0721 120.0376 57.8274 41.7558 178.8626 74 Q 4.1987 7.8066 115.9029 59.0041 29.3906 175.4023 75 K 4.8356 10.0790 120.6392 55.4326 34.5433 174.0897 76 K 4.7433 8.0904 114.8522 54.0739 35.4715 173.8488 77 P 2.9700 0.0000 0.0000 66.5177 31.2650 177.8136 78 Q 3.9656 7.7236 121.7269 56.9712 29.0616 177.0453 79 E 4.5452 7.4751 115.9819 55.4159 31.0876 177.6190 80 S 4.4554 7.4359 113.0354 58.9453 63.1137 174.4402 81 G 4.2484 8.2490 99.4320 44.0940 0.0000 172.9062 82 I 4.1976 7.7110 116.4451 61.8663 38.3264 176.2361 83 Q 4.0682 7.7272 117.9451 59.4578 28.3282 178.0504 84 A 4.1846 7.9815 122.8105 54.5584 18.7336 178.9625 85 I 3.6050 7.8171 110.4259 64.5434 37.2774 177.4777 86 A 4.0196 7.9841 122.0333 55.0339 18.0663 179.1650 87 E 3.5498 10.7800 116.6501 59.7180 29.4912 179.4528 88 A 4.0383 10.6000 120.3796 54.5225 18.3291 179.6326 89 V 3.4654 8.4727 118.2780 66.2898 31.3477 177.8824 90 R 3.8055 7.9100 116.2546 59.3909 30.0125 177.6229 91 K 4.0224 7.6605 117.7500 60.3156 32.3648 178.1801 92 R 3.9543 7.9983 116.8424 57.9642 29.7865 176.7867 93 N 4.8259 7.6724 113.6741 53.0652 38.4730 176.1310 94 D 4.6340 8.7025 116.9116 55.2487 41.0409 172.9370 95 L 4.7170 7.6934 116.3432 54.3894 43.6364 175.0056 96 L 4.8934 7.2944 119.0258 54.1816 43.3258 172.9703 97 F 5.2906 7.4819 119.7695 55.0323 39.3664 172.7318 98 I 4.3530 8.0597 120.8961 59.8174 38.7120 174.5905 99 V 4.4720 8.4498 129.7594 59.7408 34.1623 174.7112 100 V 4.6682 8.0491 123.1868 61.1430 33.7212 174.5282 101 T 3.9678 8.1013 116.7571 59.6923 71.3613 174.3773 102 D 4.6375 9.5019 124.0779 54.1441 43.2813 175.8342 103 M 4.2798 9.0397 117.7109 53.2083 30.2998 176.8025 104 Q 4.3716 7.3124 114.3623 55.2326 31.3736 173.2280 105 S 4.3610 8.9058 120.4977 57.5712 63.1904 172.3029 106 L 5.1585 8.0103 129.9739 54.1720 43.3711 173.4792 107 R 4.3065 8.2093 125.2338 56.1236 29.7907 176.2118 108 Y 4.3515 8.9232 122.3059 60.0113 38.3651 176.2946 109 S 4.9070 8.2629 112.4610 56.0586 65.5149 171.9408 110 H 5.3786 8.5534 126.6800 55.1000 31.8500 172.6340 111 P 4.4451 0.0000 0.0000 65.9701 31.3536 176.6337 112 E 4.2359 8.2778 118.3526 55.0768 30.3427 176.8866 113 A 4.1581 8.5722 125.6308 55.2285 19.0521 179.9607 114 Q 3.9544 8.0036 113.4729 58.9745 28.9797 178.0040 115 R 3.8367 7.7183 116.8927 58.9399 30.0596 176.7895 116 I 3.3761 6.9645 117.2264 63.5766 37.2220 177.8142 117 G 3.9587 8.0282 117.2462 48.4146 0.0000 174.1841 118 Q 4.1039 8.2983 119.9916 56.8064 29.3501 173.9395 119 P 4.1122 0.0000 0.0000 62.6871 31.5648 175.4437 120 F 4.4873 9.0436 122.7241 58.6362 42.0192 172.9331 121 K 3.3447 6.9202 124.3817 56.7125 30.8550 176.5186 122 G 3.7756 7.7029 106.8188 47.0140 0.0000 175.8782 123 D 4.3078 8.0551 117.0736 55.5263 40.1687 175.5884 124 D 4.2010 7.7858 119.5617 56.6241 40.3744 178.4583 125 I 3.3610 7.1036 113.3438 63.4888 37.6437 177.8969 126 L 3.4952 6.8228 120.1167 57.5654 41.0397 179.1559 127 K 4.1575 7.4672 117.2697 58.4705 32.2318 179.0779 128 A 4.4319 7.5712 121.7519 54.7184 18.4460 179.4351 129 L 3.7953 8.2219 117.2082 57.8904 41.7665 178.3807 130 N 4.6095 7.6197 113.7280 52.6822 38.5775 173.0561 131 G 3.6708 9.4106 111.4271 46.8711 0.0000 173.2720 132 E 5.4013 7.7612 131.0844 55.4205 31.9115 175.7910 133 E 4.7327 8.4963 125.1188 56.4756 30.7956 175.4686 134 N 4.9919 8.5098 118.8912 52.7878 42.9379 173.4993 135 V 5.3181 8.3613 123.0915 60.5226 35.1369 173.9965 136 A 4.6758 8.8612 122.0483 51.4769 23.1557 175.0206 137 I 4.7833 8.3218 119.7877 60.0248 38.8453 175.1043 138 N 5.0487 8.8915 124.1603 52.3929 42.0642 174.3199 139 R 4.6504 8.3894 121.5997 55.2402 32.9881 174.6274 140 G 4.0977 8.4345 111.9534 43.0156 0.0000 170.2594 141 F 4.0574 8.6513 117.7980 58.7856 38.9102 176.6143 142 L 3.6993 8.8135 124.8078 55.9051 41.6359 174.6797 143 A 4.5930 8.6355 119.6356 53.0610 18.7855 176.8847 144 Q 4.2337 7.8953 114.1458 56.5457 29.1344 176.6630 145 A 4.6220 8.6868 124.0439 51.0137 23.4459 174.5620 146 L 5.1867 8.3380 121.0671 53.7581 45.3253 175.1769 147 R 4.9566 8.4651 117.2661 54.9876 33.1096 174.6260 148 V 4.6947 8.1111 114.3317 59.9723 34.5743 174.6023 149 F 5.1120 8.8966 119.6125 56.2057 42.9918 174.4602 150 T 4.8176 8.9991 111.8740 59.7416 72.5015 170.8233 151 P 5.1584 0.0000 0.0000 61.3982 33.9036 174.3370 152 I 4.3045 8.6446 122.4725 59.7709 40.0514 174.1913 153 Y 5.1258 8.1947 123.4427 56.1513 40.0445 176.2560 154 D 4.3784 9.2659 122.5402 55.8853 41.3592 176.3249 155 E 4.3169 9.2840 118.0970 57.1065 29.4851 174.5988 156 N 4.8980 7.7389 110.4072 52.7647 40.6236 174.9054 157 H 3.4754 8.4526 115.0984 56.3523 28.5753 174.0958 158 K 4.4968 7.6166 117.6730 54.6449 32.4836 176.0717 159 Q 4.3274 8.7895 123.5341 56.4633 28.7180 175.9126 160 I 4.6081 8.7607 114.2679 60.0001 39.7131 174.4069 161 G 4.0909 7.4477 109.0861 46.1508 0.0000 172.2295 162 V 4.9293 8.4363 118.5147 61.0374 35.7274 174.0744 163 V 4.6994 9.2410 127.0573 61.2494 33.4405 174.3059 164 A 4.9090 8.4995 129.5079 50.2959 22.6906 175.5851 165 I 4.2745 7.8899 120.0538 60.1636 41.3080 174.3871 166 G 3.5815 8.3894 115.7309 43.8155 0.0000 171.3113 167 L 4.2547 8.0541 128.9489 53.7998 41.7384 175.8932 168 E 4.1563 8.5233 128.7885 57.4805 29.8587 175.9702 169 L 4.0794 7.5092 118.8307 54.1219 44.4917 173.0855 170 S 5.4461 8.9437 121.3007 58.2537 59.8089 177.0699 171 R 4.7739 8.7567 115.0966 55.3437 28.8259 174.5382 172 V 4.2158 7.9307 117.6718 60.8588 37.0123 174.6067 173 T 3.7362 7.5342 114.5833 65.6052 67.2112 174.6569 174 Q 3.8796 7.8143 119.6283 60.0982 29.0381 179.0640 175 Q 4.0251 8.0420 117.7423 59.2889 28.4625 179.2127 176 I 3.8468 8.2854 121.0404 64.1227 36.8245 178.2955 177 N 4.2729 8.1215 116.9547 56.3941 38.6800 177.0063 178 D 4.4851 7.7976 118.9770 57.0027 41.1256 178.0157 179 S 4.0506 7.6407 114.6979 61.8880 63.2472 175.2736 *180 R 4.1216 7.2599 123.0384 55.6492 29.8431 176.8955 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 45 S 8.33 4.43 0.00 3.99 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 46 D 8.56 4.23 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 47 M 8.37 3.86 0.00 2.06 2.09 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 2.67 2.62 0.00 48 T 8.00 3.76 4.19 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 49 R 7.89 3.80 0.00 2.09 2.00 0.00 3.14 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 50 D 8.00 4.33 0.00 2.71 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 51 G 7.68 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.75 3.87 0.00 1.66 1.67 0.83 1.02 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 53 A 7.42 3.93 1.43 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 0.00 0.00 0.00 54 N 8.26 4.43 0.00 2.79 2.72 0.00 0.00 7.31 6.86 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 55 K 8.90 3.77 0.00 1.87 1.85 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.54 7.81 56 A 7.97 4.21 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 57 L 7.60 3.81 0.00 1.81 1.86 0.91 1.10 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 58 A 7.85 3.93 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 59 V 7.51 3.69 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 0.94 0.00 0.00 0.99 0.00 0.00 60 A 8.03 3.99 1.43 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 0.00 0.00 0.00 61 R 7.92 4.01 0.00 2.04 1.99 0.00 3.14 0.00 0.00 3.18 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 62 T 7.73 3.93 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 1.21 0.00 0.00 63 L 7.82 4.25 0.00 1.65 1.76 1.04 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.22 4.21 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 65 D 7.37 4.58 0.00 2.76 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 66 S 8.66 4.49 0.00 3.98 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 67 P 0.00 4.68 0.00 2.30 2.27 0.00 3.79 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 68 E 8.34 3.97 0.00 2.16 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 0.00 2.31 2.46 0.00 69 I 8.09 3.59 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 1.49 1.33 1.03 0.00 0.00 70 R 8.14 3.92 0.00 1.89 1.98 0.00 3.20 0.00 0.00 3.28 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 71 Q 7.85 4.29 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 72 G 10.15 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 73 L 8.07 4.11 0.00 1.71 1.80 0.99 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 7.81 4.20 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.60 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 75 K 10.08 4.84 0.00 1.70 1.71 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.36 7.81 76 K 8.09 4.74 0.00 1.89 1.84 0.00 1.54 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.29 1.30 7.81 77 P 0.00 2.97 0.00 2.02 2.03 0.00 3.72 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.28 0.00 78 Q 7.72 3.97 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.85 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 79 E 7.48 4.55 0.00 1.78 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 2.17 2.16 0.00 80 S 7.44 4.46 0.00 3.89 3.57 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 81 G 8.25 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 82 I 7.71 4.20 2.13 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.27 1.04 0.00 0.00 83 Q 7.73 4.07 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 84 A 7.98 4.18 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 85 I 7.82 3.60 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.08 0.91 0.00 0.00 86 A 7.98 4.02 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 87 E 10.78 3.55 0.00 2.14 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 2.34 2.41 0.00 88 A 10.60 4.04 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 89 V 8.47 3.47 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 0.94 0.00 0.00 0.94 0.00 0.00 90 R 7.91 3.81 0.00 1.84 2.08 0.00 3.31 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 91 K 7.66 4.02 0.00 1.78 1.82 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.53 7.81 92 R 8.00 3.95 0.00 2.05 1.75 0.00 3.33 0.00 0.00 3.23 8.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 93 N 7.67 4.83 0.00 2.86 2.91 0.00 0.00 5.61 8.01 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 94 D 8.70 4.63 0.00 2.84 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 95 L 7.69 4.72 0.00 1.67 1.58 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.29 4.89 0.00 1.76 1.62 0.84 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 97 F 7.48 5.29 0.00 2.93 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 98 I 8.06 4.35 1.83 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 1.36 0.70 0.91 0.00 0.00 99 V 8.45 4.47 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 0.66 0.00 0.00 0.65 0.00 0.00 100 V 8.05 4.67 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 0.76 0.00 0.00 0.89 0.00 0.00 101 T 8.10 3.97 4.38 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 1.03 0.00 0.00 102 D 9.50 4.64 0.00 2.88 2.79 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 0.00 103 M 9.04 4.28 0.00 1.92 2.17 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.53 0.00 104 Q 7.31 4.37 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 7.06 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 105 S 8.91 4.36 0.00 3.95 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 0.00 106 L 8.01 5.16 0.00 2.04 1.94 1.08 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.21 4.31 0.00 1.88 2.24 0.00 3.08 0.00 0.00 2.74 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.75 0.00 108 Y 8.92 4.35 0.00 2.87 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 0.00 109 S 8.26 4.91 0.00 4.03 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 0.00 110 H 8.55 5.38 0.00 3.19 3.26 0.00 5.61 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 P 0.00 4.45 0.00 2.29 2.22 0.00 3.58 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 112 E 8.28 4.24 0.00 1.91 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 2.36 2.43 0.00 113 A 8.57 4.16 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 0.00 114 Q 8.00 3.95 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.02 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 115 R 7.72 3.84 0.00 1.35 1.33 0.00 3.28 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.54 0.00 116 I 6.96 3.38 2.00 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 1.40 0.54 0.97 0.00 0.00 117 G 8.03 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 0.00 118 Q 8.30 4.10 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.56 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 119 P 0.00 4.11 0.00 2.19 2.13 0.00 4.33 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.05 0.00 120 F 9.04 4.49 0.00 3.06 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 0.00 121 K 6.92 3.34 0.00 1.33 1.61 0.00 1.75 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.17 7.81 122 G 7.70 3.78 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 0.00 0.00 0.00 123 D 8.06 4.31 0.00 2.79 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 0.00 124 D 7.79 4.20 0.00 1.58 1.76 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 0.00 125 I 7.10 3.36 1.76 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 1.39 0.64 0.82 0.00 0.00 126 L 6.82 3.50 0.00 1.75 1.72 0.85 0.72 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 0.00 127 K 7.47 4.16 0.00 1.51 1.79 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.52 7.81 128 A 7.57 4.43 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 0.00 129 L 8.22 3.80 0.00 1.54 1.72 0.85 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 130 N 7.62 4.61 0.00 2.85 2.79 0.00 0.00 7.19 7.51 0.00 0.00 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 G 9.41 3.67 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 0.00 132 E 7.76 5.40 0.00 2.18 1.75 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 0.00 2.12 2.14 0.00 133 E 8.50 4.73 0.00 1.92 1.89 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 2.33 2.33 0.00 134 N 8.51 4.99 0.00 2.74 2.57 0.00 0.00 6.55 7.55 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 0.00 135 V 8.36 5.32 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 0.90 0.00 0.00 0.96 0.00 0.00 136 A 8.86 4.68 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 0.00 137 I 8.32 4.78 1.90 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 1.25 0.67 0.96 0.00 0.00 138 N 8.89 5.05 0.00 2.91 2.80 0.00 0.00 6.92 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 8.39 4.65 0.00 1.65 1.76 0.00 3.20 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 140 G 8.43 4.10 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 0.00 0.00 0.00 141 F 8.65 4.06 0.00 3.11 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 0.00 142 L 8.81 3.70 0.00 1.82 1.87 1.10 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 143 A 8.64 4.59 1.37 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 0.00 0.00 0.00 144 Q 7.90 4.23 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.66 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 145 A 8.69 4.62 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.34 5.19 0.00 1.75 1.47 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 147 R 8.47 4.96 0.00 1.73 1.89 0.00 2.94 0.00 0.00 3.31 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.42 0.00 148 V 8.11 4.69 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 1.02 0.00 0.00 0.81 0.00 0.00 149 F 8.90 5.11 0.00 3.07 2.85 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 0.00 150 T 9.00 4.82 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 0.00 151 P 0.00 5.16 0.00 1.65 2.04 0.00 3.68 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 1.58 1.91 0.00 152 I 8.64 4.30 1.70 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.66 0.89 0.00 0.00 153 Y 8.19 5.13 0.00 2.95 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 0.00 154 D 9.27 4.38 0.00 2.61 2.75 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 0.00 0.00 0.00 0.00 155 E 9.28 4.32 0.00 2.09 2.38 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 2.18 2.24 0.00 156 N 7.74 4.90 0.00 2.80 2.73 0.00 0.00 6.71 8.17 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 0.00 157 H 8.45 3.48 0.00 3.13 3.38 0.00 5.91 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 K 7.62 4.50 0.00 2.06 1.79 0.00 1.68 0.00 0.00 1.88 0.00 0.00 3.10 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.46 7.81 159 Q 8.79 4.33 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.92 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 160 I 8.76 4.61 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 1.20 0.83 0.98 0.00 0.00 161 G 7.45 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 0.00 0.00 0.00 162 V 8.44 4.93 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 1.06 0.00 0.00 0.99 0.00 0.00 163 V 9.24 4.70 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 0.83 0.00 0.00 0.87 0.00 0.00 164 A 8.50 4.91 0.79 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 0.00 165 I 7.89 4.27 1.70 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.58 0.77 0.00 0.00 166 G 8.39 3.58 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 0.00 0.00 0.00 167 L 8.05 4.25 0.00 1.48 1.46 0.83 0.78 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 0.00 168 E 8.52 4.16 0.00 2.15 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 2.68 2.41 0.00 169 L 7.51 4.08 0.00 1.83 1.80 0.92 0.91 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 0.00 170 S 8.94 5.45 0.00 4.03 3.49 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 0.00 171 R 8.76 4.77 0.00 1.84 1.91 0.00 3.31 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 172 V 7.93 4.22 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 0.68 0.00 0.00 0.95 0.00 0.00 173 T 7.53 3.74 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 1.27 0.00 0.00 174 Q 7.81 3.88 0.00 2.31 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.54 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 175 Q 8.04 4.03 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.67 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 176 I 8.29 3.85 2.02 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 1.51 0.98 0.91 0.00 0.00 177 N 8.12 4.27 0.00 2.68 2.86 0.00 0.00 7.07 8.52 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 0.00 178 D 7.80 4.49 0.00 2.67 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 0.00 179 S 7.64 4.05 0.00 4.02 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 *180 R 7.26 4.12 0.00 1.42 2.02 0.00 3.23 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 * Residues marked with a * may have inaccurate shift predictions.