NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 30 L 4.2983 8.1731 120.6321 54.6285 43.9635 177.6762 31 G 2.5846 7.9468 107.3040 45.3459 0.0000 172.9517 32 K 3.8326 9.1969 117.4107 57.4240 30.4389 174.7117 33 G 3.8240 8.3108 107.6014 45.4322 0.0000 175.3289 34 F 4.1638 7.9457 118.0459 58.0215 39.3605 173.4322 35 G 3.9051 8.1104 107.3305 44.3112 0.0000 174.0620 36 D 4.8797 8.7634 125.4925 55.3538 41.3288 176.6450 37 H 4.6754 8.1585 113.9525 55.7695 29.1359 174.8401 38 I 4.1403 7.1410 121.2507 59.7069 38.7297 174.8441 39 H 4.4183 8.3380 124.3178 55.5398 29.6903 174.0910 40 W 5.0465 8.6269 127.1110 55.2157 30.7873 175.9369 41 R 4.9334 8.9909 123.3952 54.1992 33.4850 175.6313 42 T 4.1628 8.3241 111.2639 61.3257 70.2019 175.2926 43 L 4.0121 8.6850 125.6391 58.8267 41.9288 179.4823 44 E 3.9738 8.0270 117.6944 61.3789 29.8860 180.5797 45 D 4.6850 8.1043 120.4138 56.9877 40.7763 179.2039 46 G 3.6366 8.5524 106.7147 47.8221 0.0000 175.9038 47 K 4.0284 8.4944 121.4642 58.8956 31.9981 179.4030 48 K 3.9328 7.8871 119.9652 59.4986 32.1308 178.5237 49 E 3.9185 8.3604 119.3955 59.1308 29.5369 178.5528 50 A 3.9824 8.4183 120.9818 55.1756 18.2603 179.4576 51 A 4.0238 7.8499 117.7582 55.3809 18.5476 179.4629 52 A 4.1030 7.8834 118.1836 54.7846 18.6180 179.2161 53 S 4.5074 8.4787 111.8871 57.8092 63.4665 174.7262 54 G 3.8890 7.9295 109.4926 46.4897 0.0000 173.1833 55 L 4.7623 7.5783 118.7875 51.7741 44.1676 174.8495 56 P 4.5997 0.0000 0.0000 63.0378 33.0226 174.7777 57 L 5.3714 8.9299 120.2950 53.4036 44.7645 175.2783 58 M 4.7239 9.0164 122.0168 53.7340 34.8076 174.3514 59 V 4.7348 8.5803 126.7599 61.1371 34.5706 174.0465 60 I 4.5895 8.6326 129.3882 59.6931 39.4076 174.5402 61 I 4.8387 8.6581 129.6176 60.0110 38.9593 174.8755 62 H 5.1359 8.8447 121.4379 54.2705 32.6065 172.3097 63 K 4.7390 8.0311 117.3269 54.2617 35.3022 177.7464 64 S 4.1825 9.0112 118.1704 59.7073 63.2910 174.9176 65 W 4.6583 7.1824 116.5424 56.6559 29.2063 177.0847 66 C 4.6393 7.3500 120.6007 55.9930 45.8254 174.2636 67 G 3.5010 8.7318 114.1975 47.7740 0.0000 175.7793 68 A 4.0755 7.9923 122.6449 55.1569 18.3926 180.3122 69 C 4.2292 8.0665 114.6032 59.9230 40.1563 175.9088 70 K 3.6707 7.8217 119.8210 59.5494 31.8293 178.3510 71 A 4.0847 7.8386 119.7576 55.0325 18.5275 179.0886 72 L 4.0696 7.9221 118.9379 57.8594 42.0311 178.9941 73 K 3.2248 7.5038 118.7449 59.0169 32.0265 177.4436 74 P 4.2473 0.0000 0.0000 65.6472 31.0410 178.5275 75 K 4.0049 7.9607 117.3411 59.2285 32.1918 178.5936 76 F 4.2277 8.6368 120.8373 61.3828 39.2155 177.2047 77 A 4.5217 8.7394 121.0041 54.0120 18.2813 178.3990 78 E 4.5127 7.9694 113.6119 55.7148 30.6050 176.2166 79 S 4.4053 7.5358 116.7380 57.7309 62.6038 174.5355 80 T 3.8801 8.5869 125.8786 66.7395 68.1461 176.1363 81 E 3.8996 8.0567 120.7174 59.2044 29.7642 178.6695 82 I 3.4989 7.8092 120.0003 64.3205 36.8750 178.3014 83 S 4.0326 7.6422 112.3442 61.4019 62.6953 175.7282 84 E 4.1740 8.3852 121.4276 59.5878 29.2766 179.4773 85 L 4.2354 8.2313 119.2483 57.5119 41.6581 179.5961 86 S 4.3008 8.0576 114.2731 61.4984 62.5517 176.1776 87 H 4.3398 7.4632 117.8704 58.2297 28.4473 176.2807 88 N 4.6104 8.0576 116.2001 52.7114 38.8676 174.4752 89 F 5.1021 7.4258 118.5759 55.4181 43.4011 175.0274 90 V 3.9604 8.8773 122.0886 62.6243 32.2979 174.7448 91 M 4.7701 8.4223 128.5889 54.4646 33.6951 175.6446 92 V 5.1698 9.2766 123.1302 60.0300 35.1486 173.5026 93 N 5.2455 9.0346 124.8511 50.8801 39.8136 173.7283 94 L 4.6757 8.9434 122.6924 53.0347 44.5547 174.7859 95 E 4.4879 9.3185 126.1891 54.5003 31.9914 175.2680 96 D 4.0986 8.7541 128.7506 56.2528 40.8415 177.3867 97 E 4.2622 9.0230 124.8093 58.3794 29.5307 177.5154 98 E 4.0921 8.0608 116.8607 58.7833 29.7400 177.1328 99 E 3.7937 7.6775 120.5115 55.5084 30.0368 174.8425 100 P 4.1777 0.0000 0.0000 62.6150 32.2151 177.2256 101 K 4.2251 8.1843 125.0216 54.2199 30.7946 174.9532 102 D 4.5450 7.5246 119.5940 52.9392 43.9178 175.5604 103 E 4.1829 8.9440 127.0425 58.7718 29.7640 178.8582 104 D 4.2853 8.3424 118.3908 56.7527 40.8342 177.1459 105 F 4.4157 8.1541 116.2176 57.3039 39.2787 176.2614 106 S 4.6595 7.8556 115.1678 56.4997 62.4741 173.5149 107 P 4.4300 0.0000 0.0000 65.6493 31.8413 177.3922 108 D 4.8578 8.6718 116.4386 52.2625 39.9544 174.2966 109 G 4.2947 6.9967 103.9686 44.7222 0.0000 174.5679 110 G 3.9738 8.3379 106.4640 45.0179 0.0000 173.5107 111 Y 4.4424 7.6598 117.8620 56.8106 38.5333 175.1801 112 I 4.8190 7.9928 112.6433 58.4653 40.6503 172.9893 113 P 4.8400 0.0000 0.0000 62.9847 32.6107 175.3942 114 R 5.2345 8.8170 118.8620 54.5741 33.7604 174.7538 115 I 4.8464 8.9283 123.7481 59.5520 39.3423 175.0628 116 L 4.7491 8.6365 126.8848 52.7686 45.3887 175.4993 117 F 5.3242 8.6766 120.3039 55.7954 41.9103 174.5225 118 L 5.3714 8.9942 122.5691 52.7365 45.3859 176.3853 119 D 5.0260 8.8556 122.2211 52.1122 40.3532 175.6449 120 P 4.6153 0.0000 0.0000 64.6453 31.2732 177.8750 121 S 4.3027 8.2210 110.8790 58.9212 63.3915 174.9106 122 G 4.0053 8.6132 110.4175 45.2168 0.0000 173.6377 123 K 4.1917 8.2421 120.2144 55.2106 32.9058 176.7731 124 V 3.7646 8.0257 123.3122 63.2231 32.2488 175.8069 125 H 4.6026 8.7611 125.2670 53.3485 27.9528 173.1692 126 P 4.5609 0.0000 0.0000 63.9055 31.7044 178.0225 127 E 4.1077 8.1162 116.5517 58.0358 29.9929 176.5803 128 I 4.2717 7.7117 121.5639 60.1528 37.0723 174.7449 129 I 4.7234 8.0576 117.8137 58.5372 40.7717 175.3603 130 N 4.3705 8.7184 119.7274 52.4409 37.0194 175.1110 131 E 3.9738 8.5580 125.1731 58.6953 29.8701 177.9147 132 N 4.7535 8.2517 113.8917 52.9712 39.1040 175.3419 133 G 4.0759 7.4651 109.3489 44.3333 0.0000 172.2284 134 N 4.6614 8.5393 118.4150 51.7578 39.7213 175.3795 135 P 4.1832 0.0000 0.0000 65.2951 31.4718 177.3552 136 S 4.0236 8.2061 114.4025 60.0456 63.5645 174.1162 137 Y 4.3982 7.4813 118.0517 55.6614 38.2434 175.9859 138 K 3.7265 9.2324 123.0325 58.6443 32.9172 178.6237 139 Y 4.8791 8.3873 115.1029 57.5432 38.2260 174.6271 140 F 5.2306 8.1453 123.1301 57.1521 39.3075 174.4711 141 Y 4.7939 8.4737 125.7931 56.4024 39.8372 176.3253 142 V 4.2736 8.7999 115.5935 60.7159 33.6827 176.1607 143 S 4.7583 7.6732 114.0072 55.4521 67.3363 174.4269 144 A 3.9842 8.5744 124.4645 55.4951 18.2680 179.8976 145 E 3.9402 8.2019 116.5213 59.7429 29.6997 179.5277 146 Q 4.1194 8.1950 118.0367 58.9114 28.7195 178.8715 147 V 3.4099 7.9714 119.3449 65.9497 31.4699 178.0690 148 V 3.5262 8.1079 118.3163 66.3205 31.3355 178.0287 149 Q 4.1271 8.1965 117.4814 58.8066 28.4302 179.0673 150 G 3.7706 8.2489 106.4468 48.1390 0.0000 175.7054 151 M 3.7101 8.2755 121.6530 57.8734 32.0809 179.0171 152 K 3.9676 8.3554 118.9683 59.4094 32.2035 179.0296 153 E 3.8909 8.2279 119.3021 59.2606 29.5210 178.7515 154 A 3.8460 7.8933 121.0431 54.9544 17.7534 179.3610 155 Q 3.6446 8.4395 118.4258 59.3379 28.9046 178.4818 156 E 3.9493 7.7853 117.9811 59.3906 29.9276 178.8887 157 R 4.1853 8.2680 118.5557 58.2515 30.0694 177.6417 158 L 4.6651 7.9558 116.7902 55.4382 42.9658 177.0047 159 T 4.0205 7.5953 115.9747 64.1695 68.8918 175.0169 160 G 3.8282 9.2419 115.2748 46.8274 0.0000 173.5291 *161 D 4.3962 8.3726 114.4313 53.2262 37.2331 178.0290 162 A 4.1395 7.6907 125.4783 55.7964 18.5963 180.1931 163 F 4.1813 8.0434 112.3729 60.2191 38.1087 176.2359 *164 R 4.1254 7.8858 123.4317 56.3236 29.9001 179.5250 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 30 L 8.17 4.30 0.00 1.82 1.91 1.03 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 31 G 7.95 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 0.00 0.00 0.00 32 K 9.20 3.83 0.00 1.79 1.81 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.36 7.81 33 G 8.31 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 34 F 7.95 4.16 0.00 2.69 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 35 G 8.11 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 0.00 0.00 0.00 36 D 8.76 4.88 0.00 2.78 2.82 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 37 H 8.16 4.68 0.00 3.32 3.46 0.00 5.50 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 7.14 4.14 1.79 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.46 -0.23 0.00 0.00 39 H 8.34 4.42 0.00 3.01 3.09 0.00 5.72 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 W 8.63 5.05 0.00 3.26 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 41 R 8.99 4.93 0.00 1.77 1.80 0.00 2.72 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.51 0.00 42 T 8.32 4.16 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 43 L 8.68 4.01 0.00 1.68 1.63 0.95 0.69 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 44 E 8.03 3.97 0.00 2.01 1.94 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 2.31 1.97 0.00 45 D 8.10 4.68 0.00 2.74 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.55 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 47 K 8.49 4.03 0.00 1.87 1.91 0.00 1.72 0.00 0.00 1.63 0.00 0.00 3.11 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.52 1.63 7.81 48 K 7.89 3.93 0.00 1.79 2.02 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.46 7.81 49 E 8.36 3.92 0.00 2.10 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 0.00 2.32 2.35 0.00 50 A 8.42 3.98 1.49 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 0.00 0.00 51 A 7.85 4.02 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 52 A 7.88 4.10 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 53 S 8.48 4.51 0.00 3.93 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 54 G 7.93 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 0.00 0.00 0.00 55 L 7.58 4.76 0.00 1.60 1.52 0.92 0.95 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 56 P 0.00 4.60 0.00 2.34 2.22 0.00 3.58 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 1.45 1.71 0.00 57 L 8.93 5.37 0.00 1.75 1.68 1.03 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 58 M 9.02 4.72 0.00 1.84 1.44 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.14 0.00 59 V 8.58 4.73 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 0.97 0.00 0.00 1.01 0.00 0.00 60 I 8.63 4.59 1.24 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.22 0.22 0.00 0.00 61 I 8.66 4.84 1.82 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 1.14 0.90 0.82 0.00 0.00 62 H 8.84 5.14 0.00 3.19 3.33 0.00 5.40 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.03 4.74 0.00 0.79 0.74 0.00 1.40 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.99 0.79 7.81 64 S 9.01 4.18 0.00 3.96 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 65 W 7.18 4.66 0.00 3.40 3.40 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 66 C 7.35 4.64 0.00 2.59 2.82 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 67 G 8.73 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.99 4.08 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.07 4.23 0.00 3.02 3.09 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 70 K 7.82 3.67 0.00 1.69 1.96 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.39 7.81 71 A 7.84 4.08 1.34 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 0.00 0.00 0.00 72 L 7.92 4.07 0.00 1.88 1.70 1.04 0.88 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 73 K 7.50 3.22 0.00 1.59 1.55 0.00 1.32 0.00 0.00 1.28 0.00 0.00 2.27 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.30 0.62 7.81 74 P 0.00 4.25 0.00 2.25 2.28 0.00 3.65 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 2.05 2.01 0.00 75 K 7.96 4.00 0.00 1.98 1.97 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.47 1.51 7.81 76 F 8.64 4.23 0.00 3.46 3.34 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 0.00 77 A 8.74 4.52 1.49 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 0.00 0.00 78 E 7.97 4.51 0.00 2.44 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 2.26 2.17 0.00 79 S 7.54 4.41 0.00 3.80 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 80 T 8.59 3.88 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 1.24 0.00 0.00 81 E 8.06 3.90 0.00 2.01 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 2.35 2.39 0.00 82 I 7.81 3.50 1.57 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.51 0.14 0.00 0.00 83 S 7.64 4.03 0.00 3.99 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 84 E 8.39 4.17 0.00 2.21 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 2.36 2.51 0.00 85 L 8.23 4.24 0.00 1.69 1.86 0.92 1.00 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 86 S 8.06 4.30 0.00 3.89 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 0.00 87 H 7.46 4.34 0.00 3.25 3.41 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 N 8.06 4.61 0.00 2.59 2.51 0.00 0.00 6.76 6.81 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 89 F 7.43 5.10 0.00 3.00 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 90 V 8.88 3.96 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 1.05 0.00 0.00 0.95 0.00 0.00 91 M 8.42 4.77 0.00 1.22 1.65 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 92 V 9.28 5.17 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 1.13 0.00 0.00 1.03 0.00 0.00 93 N 9.03 5.25 0.00 2.08 1.81 0.00 0.00 6.03 7.79 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 94 L 8.94 4.68 0.00 1.36 1.57 0.65 0.57 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 95 E 9.32 4.49 0.00 1.79 1.64 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 2.09 2.02 0.00 96 D 8.75 4.10 0.00 2.88 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 0.00 0.00 0.00 97 E 9.02 4.26 0.00 1.99 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 2.23 1.90 0.00 98 E 8.06 4.09 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 2.28 2.26 0.00 99 E 7.68 3.79 0.00 1.85 1.81 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 2.24 2.18 0.00 100 P 0.00 4.18 0.00 1.62 1.52 0.00 3.39 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.46 0.00 101 K 8.18 4.23 0.00 1.95 1.73 0.00 1.91 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.38 0.99 7.81 102 D 7.52 4.54 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 0.00 103 E 8.94 4.18 0.00 2.05 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 2.42 2.29 0.00 104 D 8.34 4.29 0.00 2.54 2.33 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 0.00 105 F 8.15 4.42 0.00 3.12 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 0.00 106 S 7.86 4.66 0.00 4.07 3.92 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 0.00 107 P 0.00 4.43 0.00 2.27 2.17 0.00 3.40 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.98 0.00 108 D 8.67 4.86 0.00 2.80 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 0.00 109 G 7.00 4.29 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 0.00 110 G 8.34 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 0.00 111 Y 7.66 4.44 0.00 2.98 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 0.00 112 I 7.99 4.82 1.87 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.72 0.88 0.00 0.00 113 P 0.00 4.84 0.00 2.15 2.16 0.00 3.87 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 2.03 0.00 114 R 8.82 5.23 0.00 1.76 1.90 0.00 2.84 0.00 0.00 2.66 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.58 0.00 115 I 8.93 4.85 1.72 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.61 0.30 0.00 0.00 116 L 8.64 4.75 0.00 1.44 1.30 0.82 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 117 F 8.68 5.32 0.00 3.03 3.02 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 0.00 118 L 8.99 5.37 0.00 1.67 1.57 0.93 1.22 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 0.00 119 D 8.86 5.03 0.00 3.07 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 0.00 120 P 0.00 4.62 0.00 2.11 2.34 0.00 3.85 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 2.06 2.14 0.00 121 S 8.22 4.30 0.00 4.03 4.05 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 0.00 122 G 8.61 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 0.00 123 K 8.24 4.19 0.00 2.03 1.65 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.40 7.81 124 V 8.03 3.76 1.73 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 0.50 0.00 0.00 0.04 0.00 0.00 125 H 8.76 4.60 0.00 3.30 3.39 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.56 0.00 2.28 2.11 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.88 0.00 127 E 8.12 4.11 0.00 2.15 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 2.33 2.32 0.00 128 I 7.71 4.27 2.13 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 0.66 0.94 0.00 0.00 129 I 8.06 4.72 1.81 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 1.39 0.64 0.95 0.00 0.00 130 N 8.72 4.37 0.00 1.44 2.34 0.00 0.00 7.65 7.59 0.00 0.00 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 E 8.56 3.97 0.00 2.00 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 2.49 2.30 0.00 132 N 8.25 4.75 0.00 2.71 2.83 0.00 0.00 6.79 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 0.00 133 G 7.47 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 0.00 0.00 0.00 134 N 8.54 4.66 0.00 2.81 2.85 0.00 0.00 6.69 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 0.00 135 P 0.00 4.18 0.00 2.12 2.10 0.00 3.76 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.94 0.00 136 S 8.21 4.02 0.00 3.19 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 0.00 137 Y 7.48 4.40 0.00 2.64 1.88 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 0.00 138 K 9.23 3.73 0.00 0.83 0.90 0.00 1.62 0.00 0.00 1.47 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.24 1.40 7.81 139 Y 8.39 4.88 0.00 3.32 3.38 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 0.00 140 F 8.15 5.23 0.00 2.84 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 0.00 141 Y 8.47 4.79 0.00 2.93 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 0.00 142 V 8.80 4.27 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 0.40 0.00 0.00 0.98 0.00 0.00 143 S 7.67 4.76 0.00 4.17 3.92 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 0.00 144 A 8.57 3.98 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 0.00 145 E 8.20 3.94 0.00 2.09 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 2.41 2.48 0.00 146 Q 8.19 4.12 0.00 2.45 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 147 V 7.97 3.41 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 0.88 0.00 0.00 1.04 0.00 0.00 148 V 8.11 3.53 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 1.09 0.00 0.00 0.89 0.00 0.00 149 Q 8.20 4.13 0.00 2.38 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.63 2.56 0.00 150 G 8.25 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 M 8.28 3.71 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.36 0.00 152 K 8.36 3.97 0.00 1.93 1.86 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.59 7.81 153 E 8.23 3.89 0.00 2.04 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 2.32 0.00 154 A 7.89 3.85 0.74 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 0.00 0.00 155 Q 8.44 3.64 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.25 2.15 0.00 156 E 7.79 3.95 0.00 2.43 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 2.34 2.18 0.00 157 R 8.27 4.19 0.00 1.94 2.00 0.00 3.12 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 158 L 7.96 4.67 0.00 1.77 1.72 0.99 0.48 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 0.00 159 T 7.60 4.02 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 1.14 0.00 0.00 160 G 9.24 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 *161 D 8.37 4.40 0.00 2.84 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 0.00 162 A 7.69 4.14 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 0.00 163 F 8.04 4.18 0.00 3.23 3.32 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 0.00 0.00 0.00 0.00 *164 R 7.89 4.13 0.00 1.60 1.79 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 1.45 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.