NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 A 4.1957 8.2649 123.5622 51.0008 21.0851 176.2380 4 L 4.5074 7.2151 115.0223 51.2561 46.1351 174.1356 5 P 4.5087 0.0000 0.0000 61.8871 33.2229 175.5343 6 P 4.3919 0.0000 0.0000 65.4977 31.1179 179.2875 7 V 3.8081 7.7539 117.2120 64.1919 31.1436 177.3752 8 Y 4.0085 7.6812 119.3594 59.8726 38.5894 176.4182 9 S 4.4656 7.7929 113.7861 58.1716 63.3609 174.3676 10 F 4.7713 8.4632 125.5119 56.4741 38.1058 174.7858 11 P 3.9596 0.0000 0.0000 64.8901 31.7341 176.9528 12 P 4.1031 0.0000 0.0000 65.1656 31.4248 178.3998 13 L 4.1954 7.9648 119.9622 58.1315 42.0796 177.7170 14 Y 4.2714 8.7778 115.5629 60.2788 38.0710 175.9954 15 T 4.3042 7.3330 116.5085 62.1225 69.3801 174.8691 16 R 3.3749 8.2302 126.3632 56.1069 30.7076 175.2569 17 Q 4.3947 7.7966 122.6680 53.3495 30.2702 174.0188 18 P 4.2873 0.0000 0.0000 63.6146 31.0749 174.8575 19 N 4.8016 8.6365 133.9730 52.7509 41.3390 174.4175 20 S 4.1070 8.4937 121.4131 62.1714 62.0884 175.5010 21 L 3.9310 7.8518 119.5706 58.6498 41.5761 179.3239 22 T 3.9507 8.1459 114.3932 66.9081 68.5866 176.0896 23 R 3.9196 8.4009 120.4216 59.8992 29.9385 178.1770 24 R 3.9377 8.0035 118.0630 59.7765 29.8739 178.5137 25 Q 3.9556 8.3673 117.7013 58.9712 28.8711 177.8606 26 Q 4.0515 8.2769 120.1542 59.6031 28.8483 178.7948 27 I 3.7139 8.5160 120.5744 64.5830 37.1555 178.2923 28 S 4.1693 7.8196 115.7930 62.1791 62.6573 176.8048 29 T 3.8205 8.2004 118.3926 66.6687 68.1293 176.5537 30 W 3.9152 8.0442 120.3355 59.7491 29.1558 178.2311 31 I 3.6793 8.5224 120.4981 64.7553 36.6181 177.4932 32 D 4.3653 8.7498 118.5803 57.7582 40.9551 178.5198 33 I 3.6798 7.9981 120.3391 64.5151 37.0212 178.2056 34 I 3.7062 8.1328 120.7220 64.6107 36.9032 178.2053 35 S 4.2276 8.1028 115.3922 62.2059 62.8574 176.8185 36 Q 3.7621 8.0927 120.1881 59.3838 28.4625 178.7768 37 Y 3.7637 8.0989 120.2668 60.8302 38.9158 177.5437 38 C 3.9979 8.6549 117.9484 62.7922 28.3297 175.8815 39 K 2.0000 8.1552 121.8347 59.3485 31.3885 178.9160 40 T 3.6556 7.3152 108.9254 64.1091 68.7154 175.5257 41 K 4.0111 7.3906 118.6121 54.6582 32.9505 176.6133 42 K 3.3668 7.1532 117.8792 57.4298 30.1085 174.7213 43 I 4.3773 7.5309 117.4478 59.6449 39.8758 176.2128 44 W 5.1457 8.6379 120.0335 57.2046 32.7606 174.8989 45 Y 5.9507 8.1516 115.8980 56.0042 40.6667 175.0561 46 M 5.5037 8.6231 121.1506 53.8466 36.5517 174.8388 47 S 4.6565 9.5695 119.0289 57.8547 64.3199 175.6860 48 V 3.5969 8.2300 115.3284 64.8771 31.4414 177.2510 49 D 5.0275 7.6404 115.5522 53.0295 39.9320 176.8922 50 G 4.1229 9.4028 109.9220 45.3587 0.0000 173.8872 51 T 4.4140 8.8473 117.8866 63.9747 69.7512 173.5822 52 V 4.6525 8.1709 118.9181 60.0961 32.8482 175.6691 53 I 4.4829 8.4097 127.2016 60.3430 38.0556 175.6839 54 N 4.8398 8.3121 124.7958 52.6178 38.7212 175.6378 55 D 4.6228 8.3087 103.9300 53.2340 39.8698 174.1794 56 N 4.3004 7.6454 123.1727 55.3079 40.4935 174.1853 *73 K 4.0983 7.6881 114.9244 56.1582 33.6093 174.4282 74 N 5.3029 8.3326 122.8951 51.8219 41.6090 174.2512 75 L 4.2029 8.3267 126.5530 56.1915 42.4947 176.8472 76 F 4.8055 7.9501 115.2389 57.8110 40.0269 174.1080 77 N 5.4026 7.8390 118.1987 50.9113 39.4811 173.4958 78 N 4.7998 9.1885 126.7967 52.1966 38.9249 175.6588 79 E 3.9479 8.9017 126.0263 59.7533 29.9770 179.2639 80 D 4.3937 8.3121 116.7228 57.4427 40.8688 177.9501 81 I 3.8685 8.6566 117.3235 61.0352 38.0020 175.4068 82 Q 3.4609 7.6345 118.7522 56.4124 26.4511 173.3363 83 R 4.7877 7.7451 115.0698 55.1803 35.8179 176.2927 84 S 5.3348 8.4532 116.3508 57.0800 67.6915 173.4841 85 V 4.1911 8.3778 125.0509 62.2520 31.9478 176.2186 86 S 4.2364 8.6848 122.3618 58.1133 63.4837 174.6871 87 Q 3.8466 8.8929 123.8199 59.4878 28.6091 178.7787 88 V 3.6097 7.8909 118.6346 66.2805 31.3191 177.4743 89 F 5.0911 8.1693 120.9913 61.0760 39.2431 176.7505 90 I 2.6025 7.5989 119.7870 64.4695 36.8868 177.7908 91 D 4.6024 8.4954 119.5419 57.5923 40.6594 178.8459 92 E 4.0072 7.8826 118.5592 59.3559 29.4644 179.2171 93 I 3.3390 7.4929 120.1374 64.3924 37.0085 178.0459 94 W 4.3664 8.0941 119.9782 59.7557 28.6455 178.2974 95 S 4.3293 8.4148 113.8331 61.9667 62.2712 176.2380 96 Q 4.2855 8.2205 123.5873 59.1210 28.7768 178.4184 97 M 4.1458 8.5070 119.1162 58.7205 32.0838 178.4174 98 T 4.0124 8.7054 117.0559 66.4371 68.5477 176.5606 99 K 3.8913 8.9138 121.3302 59.7299 32.2672 178.0026 100 E 4.2654 8.2563 116.3834 56.7504 29.6021 177.8915 101 G 3.9864 8.1423 107.3283 45.5594 0.0000 174.6842 102 K 4.5656 8.1542 120.2993 58.3820 33.0249 176.3379 103 C 5.4079 7.9929 112.9677 56.5746 33.4397 173.0893 104 L 4.7553 9.9663 121.5079 52.5924 44.4044 173.6743 105 P 4.2777 0.0000 0.0000 62.3324 32.5068 175.5469 106 I 4.8691 8.2302 117.3750 59.6013 41.6834 174.3870 107 D 5.2782 7.8323 122.9630 51.6971 41.8976 175.4589 108 Q 4.1606 8.8243 117.2465 59.5226 30.2310 177.6269 109 S 4.6396 8.1789 111.3408 58.3718 62.2973 178.1919 110 G 4.3625 8.6309 115.1489 44.6138 0.0000 174.8719 111 R 4.6723 8.3468 123.6559 54.7784 33.1435 172.8254 112 R 4.4438 7.5683 123.8036 55.9918 34.3283 173.3155 113 S 4.0736 8.6625 115.6265 57.6470 63.9400 174.1763 114 S 4.0316 9.0321 114.9442 61.5900 62.5538 175.5172 115 N 4.2534 8.3628 116.4383 56.9519 38.7175 177.8213 116 T 3.8224 7.0834 101.9719 62.3203 68.8635 173.8495 117 T 3.2513 9.8758 118.8406 64.9447 65.5016 169.8323 118 T 4.1218 8.1747 115.9855 61.3945 68.6018 174.1090 119 T 4.3375 8.4671 124.0615 63.6602 69.3156 173.9016 120 R 5.0131 7.2327 115.8229 55.2052 33.7025 173.2183 121 Y 5.1220 9.3397 115.8218 56.1372 41.5378 174.9875 122 F 5.2908 9.5611 125.9095 56.9803 40.9716 174.7708 123 I 4.3665 8.8793 128.4755 61.3110 37.5378 177.0590 124 L 4.4898 9.2104 129.7971 53.1310 40.2400 177.1996 125 W 4.4357 8.1489 117.1608 56.9953 29.2501 177.2325 126 K 4.2583 7.2734 120.7812 53.4775 34.3658 176.1283 127 S 4.2202 8.6074 120.0994 58.5086 64.1070 175.1240 128 L 4.1171 8.3904 125.2654 58.2609 41.5489 179.2117 129 D 4.3039 8.2575 118.2681 57.6529 40.7101 178.9594 130 S 4.0365 7.7601 113.1724 61.3717 62.3895 176.2299 131 W 4.3023 8.6099 121.6740 59.6499 28.7932 178.0966 132 A 4.2108 8.7471 122.9795 54.7009 17.5993 179.8029 133 S 4.0696 8.2023 113.2874 61.8384 63.0056 176.4792 134 L 4.1132 8.1895 122.8727 58.5878 41.7257 179.2812 135 I 3.8830 8.5131 119.8823 64.3087 37.2361 177.7140 136 L 4.0320 8.4691 121.6439 58.9898 41.8327 178.2607 137 Q 4.0219 9.4113 119.6160 59.4229 28.6271 178.5086 138 W 4.4110 8.5252 129.3282 60.7645 31.0106 177.5540 139 F 3.7397 8.7587 117.4880 60.7928 38.4007 177.8721 140 E 4.0385 8.2876 117.2492 59.5588 29.1849 178.9910 141 D 4.7883 8.3961 114.0158 55.5489 40.8310 177.0424 142 S 4.3454 7.1931 113.9341 57.1680 65.2667 176.7676 143 G 4.0073 8.9704 110.2087 47.0972 0.0000 176.3437 144 K 4.8090 8.0532 115.7125 57.1652 31.6738 178.0609 145 L 4.1921 8.1707 119.2284 56.4204 41.8158 176.9568 146 N 4.9293 8.7056 113.2704 53.3064 40.6647 174.3432 147 Q 4.2864 7.9555 116.6265 55.5598 30.1948 174.2889 148 V 4.4639 8.1664 118.2681 61.7729 33.0075 174.5381 149 I 4.7485 8.5021 128.1101 59.1860 40.8106 174.9474 150 T 4.6282 8.3681 117.5309 61.1835 70.0760 175.6521 151 L 3.9636 8.6736 123.5624 57.8172 41.7796 178.9857 152 Y 4.1951 7.9024 120.5353 60.2297 38.6278 177.8073 153 E 4.0772 7.9450 118.0775 58.8522 29.8172 178.0342 154 L 3.8585 7.5362 119.7646 56.4527 43.2164 177.6441 155 S 4.4267 7.4170 112.3682 57.2505 63.6461 173.7771 *159 E 4.2284 7.9424 131.9794 57.0822 30.9461 177.1361 160 T 4.2190 8.2618 116.1118 65.9266 69.1027 175.8203 161 V 3.9989 7.4360 113.5030 60.5666 32.6935 175.3127 162 N 4.4876 8.9642 119.0392 53.2594 40.0573 174.3700 163 W 4.5888 8.0218 117.3783 54.3660 30.9207 176.8700 164 E 4.2931 9.1369 118.7099 60.1721 29.0685 178.8388 165 F 4.6181 8.3604 111.0923 57.6642 38.4498 174.6197 166 H 4.3079 8.2563 122.6364 58.0558 29.9755 175.2516 167 R 3.8257 8.4138 123.0421 56.5201 27.4578 175.9363 168 M 2.5978 7.3097 118.2076 53.6732 32.7872 174.9343 169 P 4.1343 0.0000 0.0000 62.8479 33.0836 177.5128 170 E 3.8112 8.4196 119.9385 59.4396 29.3240 179.6674 171 S 4.0947 7.8888 112.8283 61.6380 63.0529 176.1253 172 L 3.9430 7.3882 121.7052 56.5172 41.1881 178.8867 173 L 3.5995 7.4564 120.6074 58.1119 41.9990 177.9950 174 Y 4.0092 8.4315 119.8360 61.3691 38.3722 178.1588 175 Y 3.8298 7.5574 115.5071 60.7609 37.7661 177.7732 176 C 4.3570 8.3358 118.3207 62.2568 28.1930 175.8658 177 L 3.9730 7.6501 120.3241 56.9373 41.2689 178.7591 178 K 3.6320 7.4453 119.9250 59.3331 31.8891 176.4730 179 P 4.2258 0.0000 0.0000 65.8076 31.0920 178.5006 180 L 4.0911 8.7652 118.7438 57.6761 41.2122 179.2706 181 C 4.4742 7.9086 118.0853 61.1625 28.6559 174.1458 182 D 4.5134 7.0540 118.2773 54.8803 41.2482 177.1575 183 R 3.7368 8.3239 117.6428 56.6660 27.7299 176.7355 184 N 4.0640 7.0761 113.4557 54.6083 36.6035 174.6972 185 R 4.6232 8.1866 117.5003 56.1950 32.3993 176.8321 186 A 5.0219 7.5508 119.6735 50.9578 23.1573 175.0499 187 T 4.6139 9.0131 115.7494 62.0816 72.2508 173.3798 188 M 4.8904 8.6789 124.9216 53.8979 34.4465 175.3063 189 L 4.8400 8.8419 122.0709 52.8820 44.5829 176.1747 190 K 4.9916 8.7030 123.1169 55.5400 35.4604 175.5876 191 D 4.7872 8.4839 121.2560 51.4740 41.6890 176.4949 192 E 3.8423 8.7847 116.1042 59.6267 29.5392 177.7236 193 N 4.5064 7.9893 117.4027 57.2790 38.3009 176.0466 194 D 4.1767 7.0392 115.2570 55.7800 38.9256 175.7302 195 K 4.3485 7.4572 123.9752 53.9131 34.5543 174.9709 196 V 3.9775 8.2638 126.3579 63.5185 32.0030 175.0676 197 I 4.5406 8.8672 126.6900 61.9608 40.5875 174.8787 198 A 5.0522 7.6937 121.3732 51.0782 23.3972 174.3973 199 I 4.9854 8.9239 118.0249 59.9521 42.2907 173.4765 200 K 5.0743 8.9295 124.9205 53.9644 35.5900 176.9141 201 V 4.6143 8.1156 116.0914 60.5213 31.9359 175.4180 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 3 A 8.26 4.20 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 4 L 7.22 4.51 0.00 1.53 1.21 0.17 0.25 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 5 P 0.00 4.51 0.00 2.18 1.96 0.00 3.60 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 2.07 2.07 0.00 6 P 0.00 4.39 0.00 2.13 2.09 0.00 3.58 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 7 V 7.75 3.81 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 0.78 0.00 0.00 0.96 0.00 0.00 8 Y 7.68 4.01 0.00 2.93 3.25 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 9 S 7.79 4.47 0.00 4.13 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 10 F 8.46 4.77 0.00 2.98 3.20 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 11 P 0.00 3.96 0.00 1.99 1.91 0.00 3.51 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 12 P 0.00 4.10 0.00 1.25 1.87 0.00 2.20 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.72 0.00 13 L 7.96 4.20 0.00 1.74 1.94 0.87 0.22 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 14 Y 8.78 4.27 0.00 3.09 3.13 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 0.00 0.00 0.00 15 T 7.33 4.30 4.22 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 1.15 0.00 0.00 16 R 8.23 3.37 0.00 0.99 1.41 0.00 2.70 0.00 0.00 2.90 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.50 0.00 17 Q 7.80 4.39 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.53 2.43 0.00 18 P 0.00 4.29 0.00 2.14 2.03 0.00 3.85 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 19 N 8.64 4.80 0.00 2.84 2.83 0.00 0.00 6.72 7.63 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 20 S 8.49 4.11 0.00 3.93 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 21 L 7.85 3.93 0.00 1.87 1.70 0.93 0.71 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 22 T 8.15 3.95 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 1.24 0.00 0.00 23 R 8.40 3.92 0.00 2.08 2.05 0.00 3.18 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.70 0.00 24 R 8.00 3.94 0.00 2.14 2.28 0.00 3.23 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 25 Q 8.37 3.96 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.47 0.00 0.00 0.00 0.00 0.00 2.56 2.53 0.00 26 Q 8.28 4.05 0.00 2.24 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.90 0.00 0.00 0.00 0.00 0.00 2.93 2.75 0.00 27 I 8.52 3.71 2.07 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.19 0.83 0.00 0.00 28 S 7.82 4.17 0.00 4.02 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 29 T 8.20 3.82 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 0.98 0.00 0.00 30 W 8.04 3.92 0.00 3.39 3.07 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 31 I 8.52 3.68 2.04 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 1.59 1.29 0.96 0.00 0.00 32 D 8.75 4.37 0.00 2.73 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 33 I 8.00 3.68 1.96 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.49 0.91 0.00 0.00 34 I 8.13 3.71 2.10 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 1.96 0.77 1.05 0.00 0.00 35 S 8.10 4.23 0.00 3.95 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 36 Q 8.09 3.76 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 37 Y 8.10 3.76 0.00 2.98 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 38 C 8.65 4.00 0.00 3.10 3.20 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 39 K 8.16 2.00 0.00 0.91 1.50 0.00 1.49 0.00 0.00 1.48 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.89 0.40 7.81 40 T 7.32 3.66 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 1.08 0.00 0.00 41 K 7.39 4.01 0.00 1.35 1.61 0.00 1.44 0.00 0.00 1.51 0.00 0.00 2.69 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.03 0.50 7.81 42 K 7.15 3.37 0.00 1.78 1.80 0.00 1.90 0.00 0.00 1.62 0.00 0.00 3.10 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.25 1.54 7.81 43 I 7.53 4.38 1.84 0.00 0.00 1.00 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 0.66 1.11 0.00 0.00 44 W 8.64 5.15 0.00 2.94 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 45 Y 8.15 5.95 0.00 3.02 2.80 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 46 M 8.62 5.50 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.71 0.00 47 S 9.57 4.66 0.00 3.90 4.04 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 48 V 8.23 3.60 2.29 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 0.70 0.00 0.00 1.03 0.00 0.00 49 D 7.64 5.03 0.00 2.90 2.89 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 50 G 9.40 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 8.85 4.41 4.31 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 1.31 0.00 0.00 52 V 8.17 4.65 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 0.69 0.00 0.00 1.04 0.00 0.00 53 I 8.41 4.48 2.11 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.40 1.03 0.00 0.00 54 N 8.31 4.84 0.00 2.86 2.75 0.00 0.00 5.97 8.06 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 55 D 8.31 4.62 0.00 2.79 2.74 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 56 N 7.65 4.30 0.00 2.73 2.72 0.00 0.00 7.21 6.68 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 *73 K 7.69 4.10 0.00 2.00 1.76 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.77 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.01 7.81 74 N 8.33 5.30 0.00 2.78 2.65 0.00 0.00 6.87 6.66 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 75 L 8.33 4.20 0.00 1.21 1.09 0.06 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 76 F 7.95 4.81 0.00 3.06 2.63 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 0.00 0.00 0.00 77 N 7.84 5.40 0.00 2.79 2.81 0.00 0.00 7.05 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 78 N 9.19 4.80 0.00 2.71 2.43 0.00 0.00 6.92 7.46 0.00 0.00 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 E 8.90 3.95 0.00 2.08 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 2.47 2.33 0.00 80 D 8.31 4.39 0.00 2.82 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 81 I 8.66 3.87 1.56 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 1.28 0.51 0.56 0.00 0.00 82 Q 7.63 3.46 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.64 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 83 R 7.75 4.79 0.00 1.09 1.56 0.00 3.23 0.00 0.00 3.10 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 84 S 8.45 5.33 0.00 3.77 3.75 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 85 V 8.38 4.19 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.15 0.00 0.00 86 S 8.68 4.24 0.00 4.02 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 87 Q 8.89 3.85 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.82 0.00 0.00 0.00 0.00 0.00 2.47 2.70 0.00 88 V 7.89 3.61 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 0.98 0.00 0.00 0.93 0.00 0.00 89 F 8.17 5.09 0.00 2.89 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 90 I 7.60 2.60 1.78 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.07 0.48 0.00 0.00 91 D 8.50 4.60 0.00 2.86 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 92 E 7.88 4.01 0.00 2.27 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 0.00 2.39 2.60 0.00 93 I 7.49 3.34 1.17 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 -0.36 0.40 0.00 0.00 94 W 8.09 4.37 0.00 3.41 2.76 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 95 S 8.41 4.33 0.00 4.13 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 0.00 96 Q 8.22 4.29 0.00 2.26 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 97 M 8.51 4.15 0.00 2.36 2.14 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.83 0.00 98 T 8.71 4.01 4.50 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 1.33 0.00 0.00 99 K 8.91 3.89 0.00 1.64 2.06 0.00 1.83 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.53 7.81 100 E 8.26 4.27 0.00 2.18 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 0.00 2.38 2.58 0.00 101 G 8.14 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 0.00 102 K 8.15 4.57 0.00 1.91 1.97 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.59 7.81 103 C 7.99 5.41 0.00 3.14 3.11 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 0.00 0.00 0.00 104 L 9.97 4.76 0.00 1.64 1.64 0.83 0.82 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 0.00 105 P 0.00 4.28 0.00 2.03 1.78 0.00 3.60 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.31 0.00 106 I 8.23 4.87 2.07 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.82 0.89 0.00 0.00 107 D 7.83 5.28 0.00 2.67 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 0.00 108 Q 8.82 4.16 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.06 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 109 S 8.18 4.64 0.00 3.93 3.20 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 0.00 110 G 8.63 4.36 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 0.00 111 R 8.35 4.67 0.00 1.67 1.87 0.00 3.11 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 112 R 7.57 4.44 0.00 1.84 1.74 0.00 3.38 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.55 0.00 113 S 8.66 4.07 0.00 3.94 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 0.00 114 S 9.03 4.03 0.00 3.93 3.76 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 0.00 115 N 8.36 4.25 0.00 2.87 2.88 0.00 0.00 6.60 7.05 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 0.00 116 T 7.08 3.82 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 1.21 0.00 0.00 117 T 9.88 3.25 4.21 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 0.00 0.00 0.00 1.17 0.00 0.00 118 T 8.17 4.12 4.04 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 1.21 0.00 0.00 119 T 8.47 4.34 4.15 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 120 R 7.23 5.01 0.00 2.03 1.89 0.00 2.47 0.00 0.00 2.90 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.60 0.00 121 Y 9.34 5.12 0.00 2.44 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 0.00 122 F 9.56 5.29 0.00 2.92 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 0.00 123 I 8.88 4.37 2.32 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.24 1.28 0.00 0.00 124 L 9.21 4.49 0.00 1.65 1.57 -0.15 0.79 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 0.00 125 W 8.15 4.44 0.00 3.63 3.18 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 0.00 0.00 0.00 126 K 7.27 4.26 0.00 0.90 0.74 0.00 1.20 0.00 0.00 0.61 0.00 0.00 2.75 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.30 0.84 7.81 127 S 8.61 4.22 0.00 3.90 3.70 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 0.00 128 L 8.39 4.12 0.00 1.77 1.76 0.98 1.00 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 0.00 129 D 8.26 4.30 0.00 2.72 2.76 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 0.00 130 S 7.76 4.04 0.00 3.74 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 0.00 131 W 8.61 4.30 0.00 3.54 3.13 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 0.00 0.00 0.00 132 A 8.75 4.21 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 0.00 133 S 8.20 4.07 0.00 4.10 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 0.00 134 L 8.19 4.11 0.00 1.93 2.14 1.41 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 135 I 8.51 3.88 1.97 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.63 0.73 0.00 0.00 136 L 8.47 4.03 0.00 1.75 2.04 0.94 0.62 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 0.00 137 Q 9.41 4.02 0.00 2.47 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.39 0.00 0.00 0.00 0.00 0.00 2.53 2.72 0.00 138 W 8.53 4.41 0.00 2.84 3.44 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 0.00 139 F 8.76 3.74 0.00 3.52 3.17 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 0.00 0.00 0.00 140 E 8.29 4.04 0.00 2.23 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 2.39 2.64 0.00 141 D 8.40 4.79 0.00 2.89 2.90 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 0.00 142 S 7.19 4.35 0.00 2.73 3.08 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 0.00 143 G 8.97 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 0.00 144 K 8.05 4.81 0.00 1.49 1.82 0.00 1.04 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.44 1.19 7.81 145 L 8.17 4.19 0.00 1.58 1.71 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 146 N 8.71 4.93 0.00 2.59 2.74 0.00 0.00 7.12 6.94 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 0.00 147 Q 7.96 4.29 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.62 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 148 V 8.17 4.46 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 0.81 0.00 0.00 0.96 0.00 0.00 149 I 8.50 4.75 2.04 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.59 1.27 0.00 0.00 150 T 8.37 4.63 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 1.26 0.00 0.00 151 L 8.67 3.96 0.00 1.75 1.69 0.96 0.70 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 0.00 152 Y 7.90 4.20 0.00 3.18 2.90 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 0.00 153 E 7.94 4.08 0.00 2.15 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 0.00 2.39 2.42 0.00 154 L 7.54 3.86 0.00 1.70 1.51 0.32 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 155 S 7.42 4.43 0.00 3.82 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 *159 E 7.94 4.23 0.00 2.01 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 2.22 2.44 0.00 160 T 8.26 4.22 4.51 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 1.42 0.00 0.00 161 V 7.44 4.00 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 0.03 0.00 0.00 1.03 0.00 0.00 162 N 8.96 4.49 0.00 2.71 2.86 0.00 0.00 7.04 7.95 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 0.00 163 W 8.02 4.59 0.00 2.30 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 0.00 164 E 9.14 4.29 0.00 2.36 2.62 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 0.00 2.52 2.49 0.00 165 F 8.36 4.62 0.00 2.92 3.60 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 0.00 166 H 8.26 4.31 0.00 3.11 3.42 0.00 6.03 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 R 8.41 3.83 0.00 2.11 2.24 0.00 3.43 0.00 0.00 3.04 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.57 0.00 168 M 7.31 2.60 0.00 1.34 0.68 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.49 0.00 169 P 0.00 4.13 0.00 1.62 1.85 0.00 2.43 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.97 0.00 170 E 8.42 3.81 0.00 1.93 1.91 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 2.27 2.27 0.00 171 S 7.89 4.09 0.00 4.07 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 0.00 172 L 7.39 3.94 0.00 0.53 0.13 -0.56 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 173 L 7.46 3.60 0.00 1.71 1.67 0.44 0.31 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 0.00 174 Y 8.43 4.01 0.00 2.89 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 0.00 175 Y 7.56 3.83 0.00 3.30 3.11 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 0.00 0.00 0.00 176 C 8.34 4.36 0.00 2.93 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 0.00 177 L 7.65 3.97 0.00 1.58 1.54 0.80 0.72 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 0.00 178 K 7.45 3.63 0.00 1.43 1.64 0.00 1.27 0.00 0.00 1.17 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.44 7.81 179 P 0.00 4.23 0.00 2.17 2.25 0.00 3.79 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.18 0.00 180 L 8.77 4.09 0.00 1.80 1.59 0.89 0.73 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 0.00 181 C 7.91 4.47 0.00 2.98 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 0.00 182 D 7.05 4.51 0.00 2.94 2.56 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 0.00 0.00 0.00 0.00 183 R 8.32 3.74 0.00 2.03 2.07 0.00 3.29 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 184 N 7.08 4.06 0.00 2.86 2.95 0.00 0.00 6.76 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 0.00 185 R 8.19 4.62 0.00 1.61 1.85 0.00 3.26 0.00 0.00 3.16 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.67 0.00 186 A 7.55 5.02 1.05 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 0.00 0.00 187 T 9.01 4.61 4.21 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 0.00 0.00 0.00 1.19 0.00 0.00 188 M 8.68 4.89 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 189 L 8.84 4.84 0.00 1.54 1.53 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 190 K 8.70 4.99 0.00 1.73 1.75 0.00 1.52 0.00 0.00 1.73 0.00 0.00 3.14 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.38 7.81 191 D 8.48 4.79 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 0.00 192 E 8.78 3.84 0.00 2.07 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 0.00 2.26 2.34 0.00 193 N 7.99 4.51 0.00 2.67 2.80 0.00 0.00 7.25 7.62 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 0.00 194 D 7.04 4.18 0.00 2.64 2.97 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 0.00 195 K 7.46 4.35 0.00 1.78 1.74 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.27 7.81 196 V 8.26 3.98 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 0.92 0.00 0.00 0.93 0.00 0.00 197 I 8.87 4.54 1.86 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 1.39 0.94 0.90 0.00 0.00 198 A 7.69 5.05 1.25 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 0.00 199 I 8.92 4.99 1.86 0.00 0.00 0.72 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 1.16 0.99 0.00 0.00 200 K 8.93 5.07 0.00 1.87 1.86 0.00 1.57 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.20 7.81 201 V 8.12 4.61 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.22 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.