NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2876 7.8827 121.4557 61.2204 38.7098 173.7600 17 V 4.3340 8.7634 126.0599 61.8752 32.7187 174.6324 18 G 3.8274 8.5922 114.1438 46.6959 0.0000 173.3630 19 G 4.2832 7.6838 109.5948 44.3642 0.0000 172.5477 20 Y 4.9799 7.9351 117.3341 55.1513 42.2150 175.1059 21 T 4.2267 8.6047 117.2827 64.2253 68.4021 175.1156 22 C 4.2119 8.6280 125.3500 60.0968 35.0245 175.2546 23 G 4.0850 8.4712 105.8319 44.4615 0.0000 172.7709 24 A 4.2894 8.4861 125.3052 53.5545 18.7295 176.9531 25 N 4.2571 8.8832 118.9195 54.4495 36.2360 175.4455 26 T 4.1634 7.6309 107.5566 62.9791 69.6683 175.1849 27 V 4.0587 7.0518 122.2174 60.1211 31.5107 173.5055 28 P 4.4539 0.0000 0.0000 64.2073 32.0895 178.2742 29 Y 4.8913 6.9336 115.7477 56.8024 38.8240 174.6886 30 Q 4.5703 7.4623 123.5714 56.3056 29.5479 175.4932 31 V 4.8594 9.0084 118.9627 59.6896 36.0952 174.1327 32 S 4.8221 8.7035 116.9000 56.6781 64.7991 172.6185 33 L 4.7472 8.3766 127.1706 53.0876 43.5207 174.9258 34 N 5.9117 8.8980 122.4689 49.9552 42.0973 174.9401 *37 S 4.3514 8.4308 120.6028 58.2924 64.1367 174.5413 38 G 3.9304 9.5318 107.2805 45.8404 0.0000 172.7676 39 Y 4.5082 6.5671 114.8714 56.2825 39.7930 172.4291 40 H 4.6197 8.8973 122.0027 56.1623 30.4724 174.8372 41 F 5.0423 7.7232 119.3919 56.8279 39.6288 173.7429 42 C 4.6658 6.7955 114.9235 56.2199 44.7986 173.2889 43 G 4.1742 8.5890 109.2713 45.7894 0.0000 172.0582 44 G 4.6168 8.0325 105.7955 46.4291 0.0000 172.6217 45 S 5.3589 8.9248 115.4286 56.4762 67.0007 173.6990 46 L 4.6979 9.2885 128.0263 54.8647 42.4324 177.0691 47 I 4.3871 8.6155 119.5126 60.8280 38.9036 174.3397 48 N 4.7393 7.5575 117.6054 52.2114 39.5429 174.9874 49 S 4.2695 8.6481 111.7677 60.4722 63.2781 175.1883 50 Q 4.5205 8.9911 118.9118 55.1304 30.1533 174.6317 51 W 5.5539 8.2448 118.1890 54.7929 33.5463 174.3923 52 V 4.9520 9.1854 123.1050 61.1820 34.6254 174.1106 53 V 4.8165 8.9112 127.3100 61.8732 33.1555 174.7582 54 S 4.8397 8.9317 121.2325 57.5600 66.2399 171.8237 55 A 4.7034 8.4523 120.4160 50.4694 20.6416 178.3389 56 A 3.8276 8.2996 124.5154 55.2955 18.4564 179.2620 57 H 4.5203 8.2102 109.5086 57.4932 28.6805 175.4400 58 C 4.6635 7.7236 117.0933 57.4433 40.5370 173.3546 59 Y 4.2033 7.7270 122.0806 57.8173 38.7873 175.1720 60 K 3.6142 6.6002 122.7087 55.9168 34.7154 174.8834 61 S 4.1386 8.0907 116.0877 59.2507 63.4208 173.9913 62 G 3.7825 8.4592 107.8501 46.6983 0.0000 173.7854 63 I 4.0230 7.5432 120.1853 60.6742 38.7852 174.6720 64 Q 4.6779 8.7205 127.9503 54.3564 31.0883 174.2541 65 V 4.3701 8.6954 127.3382 61.9426 33.6085 174.7335 66 R 5.0019 8.9194 127.1231 54.7518 32.3179 175.1650 67 L 4.6705 9.0540 125.0050 52.9276 44.4332 177.8830 *69 G 4.0708 8.2670 107.4689 45.3708 0.0000 172.8557 70 E 4.3495 8.1783 118.5389 55.6748 29.7812 174.1026 71 D 4.8461 7.9411 117.6568 55.2567 44.4608 174.5207 72 N 4.9513 8.9220 122.1473 52.8693 38.9516 176.1428 73 I 3.9350 8.4386 119.7982 62.2009 37.7409 176.2830 74 N 4.8296 8.6219 118.0253 53.0108 39.2425 174.6396 75 V 4.3177 7.4335 117.7935 60.7298 34.4202 175.1381 76 V 4.0624 8.4274 126.6344 62.6454 30.9103 175.0239 77 E 4.3567 9.6524 127.8567 55.8870 30.5393 177.0595 78 G 4.0094 8.1520 105.3757 45.3430 0.0000 173.8020 79 N 5.0274 8.1164 115.4741 52.6229 40.8036 173.9430 80 E 4.6693 8.1593 118.9347 56.4506 30.6428 176.3238 81 Q 4.4303 8.9620 121.9067 54.2445 32.3224 174.2906 82 F 5.4998 8.7949 123.4941 56.1247 40.5601 175.4882 83 I 4.6678 8.6795 124.7752 59.2034 40.8297 175.5913 84 S 4.5594 8.7215 122.4958 58.3260 64.1217 173.4354 85 A 4.4859 8.5959 126.0827 52.2369 18.1678 177.6694 86 S 4.5364 9.0457 116.7197 59.1172 64.9319 174.9437 87 K 4.6635 7.6737 119.0784 54.6806 36.3916 175.5994 88 S 4.9824 8.9440 119.7784 57.0954 65.9345 173.7373 89 I 4.4535 9.3397 127.7442 59.4011 38.8592 175.5968 90 V 4.1670 8.3002 127.4693 62.1819 32.6995 175.2367 91 H 4.1298 8.6958 126.9245 55.9052 30.1116 174.6412 92 P 4.3440 0.0000 0.0000 65.2359 31.3955 177.2906 93 S 4.6894 8.0553 111.8625 58.0535 63.0548 173.2657 94 Y 4.3199 8.0026 122.8215 57.9376 38.9311 174.9511 95 N 4.4884 8.3621 126.1882 51.5122 39.8791 175.2350 96 S 3.8156 7.9854 120.2962 59.7587 63.7470 174.7044 97 N 4.4822 8.3057 118.8826 55.3227 39.0436 176.4341 98 T 3.8264 7.8167 105.7004 61.7691 69.5053 175.2681 99 L 3.7622 7.7574 120.4464 55.2148 39.8489 173.9335 100 N 4.4687 7.7698 117.8680 54.6997 39.4229 174.5912 101 N 4.5814 8.7033 119.8582 54.3948 35.8044 175.4572 102 D 4.7214 7.9957 117.5597 53.1683 39.5379 174.3719 103 I 4.7782 7.1635 120.8867 59.1874 42.2855 172.8677 104 M 5.4036 9.1855 127.4489 53.9016 36.2251 173.4551 105 L 5.3763 9.2005 124.7071 53.1397 44.8817 175.2966 106 I 4.9086 9.1313 124.5400 59.4160 40.1585 174.3925 107 K 3.6569 8.5351 129.0775 54.6512 33.4810 175.6629 108 L 4.3181 8.1429 128.0630 54.1646 41.8430 177.2092 109 K 4.1387 8.7296 124.8747 58.9236 32.6126 176.9591 110 S 4.6633 7.7370 111.3181 55.7928 66.1977 173.1198 111 A 4.4112 8.3339 122.8566 51.7758 18.8048 177.4785 112 A 4.2922 8.8099 123.5199 52.0462 19.6124 177.4370 113 S 4.5640 9.2635 117.0086 57.4022 63.6210 174.2506 114 L 4.8301 8.4179 125.4254 53.7304 42.3949 176.4994 115 N 4.6706 8.4774 118.5468 52.8560 39.9429 175.4216 116 S 4.4484 8.8358 110.7939 61.3648 63.5186 175.3426 117 R 4.1947 8.0640 118.6022 56.6197 30.6012 176.3495 118 V 4.4628 7.6231 117.6216 60.9650 33.4008 173.7609 119 A 5.1131 8.5361 127.8329 50.6012 22.9319 175.2470 120 S 4.9458 8.6873 114.1780 57.8804 64.8203 173.0800 121 I 4.3952 8.0670 121.3181 59.1372 39.2262 175.6228 122 S 4.4091 8.4229 124.3638 58.4353 64.0806 173.7673 123 L 4.2767 8.2927 122.2451 53.3316 42.5276 175.4316 124 P 4.4465 0.0000 0.0000 63.1223 31.4753 176.5715 125 T 4.2795 8.2364 109.0429 61.9392 70.2154 174.2515 *127 S 4.2595 7.5703 115.1276 58.0630 64.0431 174.0426 128 C 4.3695 8.3873 117.8280 56.7387 40.5839 173.5158 129 A 4.4031 7.9564 124.7488 51.4809 20.0193 176.8019 130 S 4.5504 7.9977 114.2619 56.6642 65.5431 173.6813 *132 A 4.3078 8.2717 124.4067 53.5885 19.2118 177.4383 133 G 3.9810 9.0047 111.6700 45.1550 0.0000 174.0782 134 T 4.0747 7.5658 117.3497 63.4692 69.5727 173.6149 135 Q 4.6026 8.5857 127.1692 56.0284 30.1165 175.3220 136 C 5.2777 9.1993 122.3457 55.0973 46.5576 172.3152 137 L 5.1498 8.9766 122.6025 53.5886 43.9448 175.0175 138 I 5.2876 8.9289 127.2826 58.9514 39.9788 174.8746 139 S 4.8638 8.3904 119.0699 56.4864 66.5781 173.0405 140 G 3.8089 7.2328 108.2339 46.0934 0.0000 172.7749 141 W 4.7674 8.4781 117.1296 56.2679 29.4022 177.0632 142 G 4.0893 8.5489 108.9719 44.2791 0.0000 173.5180 143 N 4.1732 9.0005 118.1072 54.6885 38.9527 174.4173 144 T 5.2345 8.3045 112.9902 60.5434 69.4180 174.2721 145 K 4.6322 7.8567 121.2589 54.8879 34.5629 176.2925 146 S 4.4014 8.5382 116.0263 59.3204 63.8006 174.1316 147 S 4.3302 7.6690 115.5351 57.9030 64.7375 174.0158 148 G 3.8655 9.4433 116.1094 44.4790 0.0000 171.5468 149 T 4.7115 7.8186 107.1095 60.0699 71.9939 173.8690 150 S 4.2915 9.0313 119.5688 57.6551 65.9127 172.0383 151 Y 5.2026 8.4529 125.6585 55.6816 39.2071 174.2856 152 P 4.6338 0.0000 0.0000 62.6416 32.8138 176.0348 153 D 4.5775 8.8004 119.3201 56.6416 41.3965 177.1302 154 V 5.2906 7.3913 109.7866 58.5760 34.2542 175.8389 155 L 3.1947 8.3304 123.6817 54.9743 43.0409 175.8948 156 K 4.9098 8.0951 124.5338 54.8164 35.2409 174.5411 157 C 5.2597 8.5182 119.9018 55.2105 44.9589 172.8869 158 L 4.9453 8.4669 121.8567 53.9554 45.5747 174.4293 159 K 5.0505 9.0135 125.6090 55.5161 33.4578 175.9737 160 A 4.8123 9.0536 126.1356 49.9016 23.0065 173.6795 161 P 5.0387 0.0000 0.0000 61.8234 34.0291 175.1462 162 I 4.2478 8.2867 122.3754 61.4643 37.9504 175.8666 163 L 4.8624 8.6653 127.5111 53.1515 43.4437 176.9732 164 S 4.3520 8.4468 115.0096 58.2153 63.8535 175.2055 165 D 4.4748 8.7012 122.0272 57.4823 40.4717 179.2738 166 S 4.1367 8.0251 114.6408 61.4381 63.1366 176.3567 167 S 4.0665 8.0341 116.4332 61.1290 62.1076 175.3039 168 C 4.3338 8.2534 121.2701 59.7862 43.2130 175.8096 169 K 4.0234 8.2592 119.2018 59.4795 31.6885 179.3310 170 S 4.2626 8.2001 114.7740 61.3112 62.7374 176.2082 171 A 4.0641 7.7357 123.0439 53.7785 19.7155 177.3622 172 Y 4.8157 7.8418 114.2776 55.0738 38.3761 172.2984 173 P 4.5118 0.0000 0.0000 63.9757 32.2133 177.3644 174 G 4.0079 9.1113 110.5906 45.8787 0.0000 173.5337 175 Q 4.4856 8.1066 116.5247 55.3526 30.4516 175.4875 176 I 4.3381 7.8626 119.6839 60.1502 37.7602 175.6405 177 T 4.4874 8.2669 116.4761 59.9804 70.5158 175.4852 178 S 4.3681 8.5230 114.9134 60.2793 63.3105 174.3770 179 N 5.0206 8.2178 118.6581 53.3272 38.5217 173.8392 180 M 5.6118 7.9423 116.7081 53.7568 36.0702 174.6082 181 F 5.1451 8.8499 115.1784 55.7426 42.2441 172.5474 182 C 5.8001 9.1961 116.1851 55.1487 40.8989 172.6756 183 A 4.9786 8.9405 122.3129 51.2171 22.3454 174.1639 184A G 3.7397 7.8932 104.6141 44.5737 0.0000 173.2746 184 Y 4.7930 8.4442 120.2167 56.3432 41.7393 175.1942 185 L 4.6119 8.4261 120.1016 54.9629 43.1686 178.0491 186 E 4.1628 8.2828 115.4350 56.6628 30.2224 177.8430 187 G 3.9932 7.7620 103.8470 46.3563 0.0000 173.3752 188A G 3.9943 9.5980 107.7446 44.5444 0.0000 173.5017 188 K 4.8637 7.3705 117.5987 55.2190 35.5657 175.0698 189 D 4.6311 8.7086 123.7349 53.9230 45.6670 174.7661 190 S 4.9995 8.8115 115.9253 58.0753 65.0986 173.4620 191 C 4.7813 9.2381 119.0754 55.5505 42.7035 172.4969 192 Q 4.3484 8.6436 119.0716 57.6554 28.4770 177.7082 193 G 4.4220 9.2604 110.8336 45.6320 0.0000 173.8962 194 D 4.6913 8.5098 118.8687 55.1776 41.7776 176.7640 195 S 4.4785 8.1090 115.5150 60.5921 63.5618 175.0088 196 G 4.1549 8.8762 112.8002 46.5213 0.0000 173.7476 197 G 4.4612 7.8397 107.1915 45.1033 0.0000 171.0939 198 P 5.0397 0.0000 0.0000 62.2469 33.5904 175.7541 199 V 4.4753 8.4860 120.8947 61.4171 34.0719 173.9807 200 V 4.8814 8.6988 128.9130 61.2616 33.8587 173.6877 201 C 5.1358 8.8628 125.0003 55.7528 43.7772 174.5538 202 S 3.7194 9.8653 119.3821 59.6644 60.1884 173.2230 203 G 3.9112 8.5044 104.4059 45.7379 0.0000 174.0628 204 K 4.7001 7.6346 117.9775 53.1496 34.8007 175.5202 *209 L 4.2270 8.2213 123.0553 55.4266 41.9281 175.6664 210 Q 4.4594 8.8081 125.8240 56.6274 30.8422 175.8980 211 G 5.2734 8.0771 104.4213 45.4593 0.0000 171.4194 212 I 5.2380 8.1813 120.0302 58.8294 40.9398 175.2781 213 V 3.8919 8.8351 127.5169 63.9334 31.8285 174.1680 214 S 4.8009 8.5080 120.7625 58.6631 64.2516 173.9341 215 W 5.0267 7.3008 113.7796 55.7223 32.0554 172.2996 216 G 4.0394 8.3621 106.3969 46.4258 0.0000 173.0735 217 S 4.5982 8.5811 115.3351 56.9087 62.1329 172.9016 *219 G 4.4008 8.0022 117.7761 45.5775 0.0000 170.7721 220 C 4.9918 8.0995 114.9550 56.2516 44.0881 173.9753 221A A 3.7876 9.2672 125.8792 53.2384 16.7388 176.7977 221 Q 4.6140 7.3011 115.7054 55.9478 29.9721 176.0947 222 K 4.1672 8.5025 120.6659 58.3580 32.4858 176.7074 223 N 4.2668 9.1589 118.9143 53.8380 36.7809 175.2649 224 K 4.2023 7.6614 118.3535 53.5137 32.4489 174.0785 225 P 4.6403 0.0000 0.0000 61.7635 33.0551 176.6849 226 G 3.5913 8.3920 106.5823 46.2261 0.0000 172.6456 227 V 4.3378 7.4056 121.8799 60.6613 33.9943 174.1381 228 Y 4.8969 8.0695 124.2401 55.9791 42.2748 174.9507 229 T 4.4504 8.5965 119.7083 63.6317 70.0436 174.2568 230 K 4.9565 9.3224 128.2216 55.4463 31.6721 177.2890 231 V 3.9290 8.8551 127.1764 65.8095 31.3869 174.9707 232 C 4.3931 8.2935 112.6776 58.1449 41.4974 174.8534 233 N 4.2243 8.0612 117.4855 54.5511 38.5087 175.0782 234 Y 4.6790 7.9762 117.5166 57.5011 39.2756 177.5462 235 V 3.6797 8.0528 121.5134 66.4343 31.5714 178.1200 236 S 4.1805 8.0992 114.3215 61.2873 62.6964 176.3353 237 W 4.1530 8.3069 130.7440 60.2737 30.5459 177.9858 238 I 3.3315 8.4972 120.2936 64.3070 36.6440 178.4657 239 K 3.7576 7.9076 119.1971 59.5453 31.9367 179.2532 240 Q 3.8532 8.0449 119.7350 59.2830 28.7072 178.3047 241 T 3.5149 7.1617 116.0920 66.2906 68.7113 176.5289 242 I 2.6718 7.1202 121.4446 63.9369 36.8065 178.3867 243 A 4.0035 7.5942 120.4571 54.3544 18.2206 178.7515 244 S 4.5703 7.5360 109.8814 58.4863 63.6461 174.1307 245 N 4.6778 7.9476 125.1767 53.7964 39.2485 173.9839 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 I 7.88 4.29 1.81 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 1.37 0.55 0.88 0.00 0.00 17 V 8.76 4.33 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 1.04 0.00 0.00 1.00 0.00 0.00 18 G 8.59 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 19 G 7.68 4.28 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 0.00 20 Y 7.94 4.98 0.00 2.95 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 21 T 8.60 4.23 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 1.22 0.00 0.00 22 C 8.63 4.21 0.00 2.72 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 23 G 8.47 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 24 A 8.49 4.29 1.32 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 0.00 0.00 25 N 8.88 4.26 0.00 2.86 2.90 0.00 0.00 7.12 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 26 T 7.63 4.16 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 27 V 7.05 4.06 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 0.31 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.45 0.00 2.37 2.38 0.00 3.65 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.00 0.00 29 Y 6.93 4.89 0.00 3.27 3.41 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 30 Q 7.46 4.57 0.00 1.78 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.73 0.00 0.00 0.00 0.00 0.00 1.86 2.49 0.00 31 V 9.01 4.86 2.22 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 0.86 0.00 0.00 0.99 0.00 0.00 32 S 8.70 4.82 0.00 3.06 3.31 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 33 L 8.38 4.75 0.00 0.60 0.99 0.78 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.90 5.91 0.00 2.42 2.44 0.00 0.00 6.78 7.15 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 *37 S 8.43 4.35 0.00 3.70 3.62 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 0.00 0.00 0.00 38 G 9.53 3.93 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 0.00 0.00 0.00 39 Y 6.57 4.51 0.00 3.04 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 40 H 8.90 4.62 0.00 2.89 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.72 5.04 0.00 3.10 3.12 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 42 C 6.80 4.67 0.00 2.21 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 43 G 8.59 4.17 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 0.00 0.00 0.00 44 G 8.03 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.92 5.36 0.00 3.81 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 46 L 9.29 4.70 0.00 1.87 1.68 1.08 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.62 4.39 1.91 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 1.53 1.00 0.96 0.00 0.00 48 N 7.56 4.74 0.00 3.00 3.01 0.00 0.00 6.01 8.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.65 4.27 0.00 4.23 4.20 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 50 Q 8.99 4.52 0.00 2.11 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.79 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 51 W 8.24 5.55 0.00 3.32 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 9.19 4.95 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 1.11 0.00 0.00 0.98 0.00 0.00 53 V 8.91 4.82 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 1.03 0.00 0.00 1.03 0.00 0.00 54 S 8.93 4.84 0.00 3.91 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 55 A 8.45 4.70 1.19 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 0.00 0.00 0.00 56 A 8.30 3.83 0.30 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 57 H 8.21 4.52 0.00 3.41 3.59 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.72 4.66 0.00 3.22 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 59 Y 7.73 4.20 0.00 2.96 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 60 K 6.60 3.61 0.00 1.48 1.34 0.00 0.81 0.00 0.00 1.20 0.00 0.00 2.34 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.77 1.00 7.81 61 S 8.09 4.14 0.00 3.78 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 62 G 8.46 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 63 I 7.54 4.02 1.84 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 1.43 0.60 0.91 0.00 0.00 64 Q 8.72 4.68 0.00 2.01 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.89 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 65 V 8.70 4.37 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 0.96 0.00 0.00 0.89 0.00 0.00 66 R 8.92 5.00 0.00 1.53 1.78 0.00 2.66 0.00 0.00 2.50 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.15 0.00 67 L 9.05 4.67 0.00 1.67 1.64 1.04 0.66 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 *69 G 8.27 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 0.00 0.00 0.00 70 E 8.18 4.35 0.00 2.13 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 2.35 2.01 0.00 71 D 7.94 4.85 0.00 2.78 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 72 N 8.92 4.95 0.00 2.84 2.82 0.00 0.00 7.17 7.14 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 73 I 8.44 3.93 1.41 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.50 -0.48 0.00 0.00 74 N 8.62 4.83 0.00 2.84 2.87 0.00 0.00 6.61 7.77 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 75 V 7.43 4.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.95 0.00 0.00 76 V 8.43 4.06 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 0.78 0.00 0.00 0.94 0.00 0.00 77 E 9.65 4.36 0.00 1.95 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 2.44 0.00 78 G 8.15 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 79 N 8.12 5.03 0.00 2.69 2.79 0.00 0.00 7.11 7.66 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 80 E 8.16 4.67 0.00 1.52 1.60 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 2.40 2.51 0.00 81 Q 8.96 4.43 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 82 F 8.79 5.50 0.00 2.82 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 83 I 8.68 4.67 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 1.24 0.88 0.93 0.00 0.00 84 S 8.72 4.56 0.00 3.75 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 85 A 8.60 4.49 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 9.05 4.54 0.00 3.76 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 87 K 7.67 4.66 0.00 1.54 1.71 0.00 1.61 0.00 0.00 1.90 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.37 7.81 88 S 8.94 4.98 0.00 3.95 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 0.00 89 I 9.34 4.45 2.06 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 1.23 0.95 1.04 0.00 0.00 90 V 8.30 4.17 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 0.67 0.00 0.00 0.82 0.00 0.00 91 H 8.70 4.13 0.00 2.97 3.00 0.00 5.65 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 92 P 0.00 4.34 0.00 2.09 2.15 0.00 3.24 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 2.16 2.24 0.00 93 S 8.06 4.69 0.00 3.92 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 94 Y 8.00 4.32 0.00 2.89 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 95 N 8.36 4.49 0.00 2.61 2.47 0.00 0.00 6.57 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 96 S 7.99 3.82 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 97 N 8.31 4.48 0.00 2.71 2.78 0.00 0.00 6.95 8.12 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 98 T 7.82 3.83 4.13 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 1.11 0.00 0.00 99 L 7.76 3.76 0.00 1.50 1.87 0.39 0.91 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 0.00 100 N 7.77 4.47 0.00 2.83 2.65 0.00 0.00 7.25 5.99 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 0.00 101 N 8.70 4.58 0.00 2.93 2.63 0.00 0.00 7.24 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 0.00 102 D 8.00 4.72 0.00 3.09 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 0.00 103 I 7.16 4.78 1.41 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.16 0.10 0.00 0.00 104 M 9.19 5.40 0.00 2.13 1.84 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.63 0.00 105 L 9.20 5.38 0.00 1.84 1.94 1.13 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.13 4.91 1.92 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 1.18 0.95 0.92 0.00 0.00 107 K 8.54 3.66 0.00 0.79 1.09 0.00 1.33 0.00 0.00 1.38 0.00 0.00 2.66 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.79 0.21 7.81 108 L 8.14 4.32 0.00 1.43 1.59 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.73 4.14 0.00 1.80 1.80 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.35 7.81 110 S 7.74 4.66 0.00 3.93 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.33 4.41 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.81 4.29 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.26 4.56 0.00 3.72 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 0.00 114 L 8.42 4.83 0.00 1.63 1.61 0.96 1.07 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 0.00 115 N 8.48 4.67 0.00 2.91 2.88 0.00 0.00 6.68 7.20 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 0.00 116 S 8.84 4.45 0.00 4.02 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 0.00 117 R 8.06 4.19 0.00 1.86 2.03 0.00 3.30 0.00 0.00 3.33 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.57 4.26 0.00 4.00 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 0.00 128 C 8.39 4.37 0.00 2.93 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 0.00 129 A 7.96 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.00 4.55 0.00 3.82 3.72 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 0.00 0.00 0.00 0.00 *132 A 8.27 4.31 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.00 3.98 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 0.00 0.00 0.00 134 T 7.57 4.07 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 135 Q 8.59 4.60 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 136 C 9.20 5.28 0.00 2.92 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 0.00 137 L 8.98 5.15 0.00 1.76 1.57 0.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.93 5.29 1.87 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.73 0.98 0.00 0.00 139 S 8.39 4.86 0.00 3.56 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 0.00 140 G 7.23 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 0.00 141 W 8.48 4.77 0.00 3.13 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 0.00 142 G 8.55 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 0.00 143 N 9.00 4.17 0.00 2.70 2.78 0.00 0.00 7.11 7.60 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 0.00 144 T 8.30 5.23 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 1.31 0.00 0.00 145 K 7.86 4.63 0.00 1.66 1.87 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.30 1.33 7.81 146 S 8.54 4.40 0.00 4.14 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 0.00 147 S 7.67 4.33 0.00 3.78 3.72 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 0.00 0.00 0.00 0.00 148 G 9.44 3.87 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 0.00 0.00 0.00 149 T 7.82 4.71 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 1.17 0.00 0.00 150 S 9.03 4.29 0.00 3.79 3.62 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 0.00 0.00 0.00 151 Y 8.45 5.20 0.00 2.97 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 0.00 152 P 0.00 4.63 0.00 2.47 2.11 0.00 4.16 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.08 0.00 153 D 8.80 4.58 0.00 2.80 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 0.00 154 V 7.39 5.29 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 1.06 0.00 0.00 0.96 0.00 0.00 155 L 8.33 3.19 0.00 1.26 1.23 -0.64 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.10 4.91 0.00 1.69 1.51 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.48 7.81 157 C 8.52 5.26 0.00 1.39 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.47 4.95 0.00 1.74 1.47 1.02 0.97 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 0.00 159 K 9.01 5.05 0.00 1.79 1.83 0.00 1.93 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.62 7.81 160 A 9.05 4.81 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.04 0.00 2.03 2.10 0.00 3.10 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.75 0.00 162 I 8.29 4.25 1.95 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.47 0.80 0.00 0.00 163 L 8.67 4.86 0.00 1.57 1.60 0.92 0.97 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 0.00 164 S 8.45 4.35 0.00 4.01 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 0.00 165 D 8.70 4.47 0.00 2.81 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 0.00 166 S 8.03 4.14 0.00 4.06 4.13 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 0.00 167 S 8.03 4.07 0.00 3.96 4.06 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 0.00 0.00 0.00 0.00 168 C 8.25 4.33 0.00 3.25 3.30 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 0.00 169 K 8.26 4.02 0.00 1.80 1.91 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.70 7.81 170 S 8.20 4.26 0.00 3.97 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 0.00 171 A 7.74 4.06 1.16 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 0.00 0.00 0.00 0.00 0.00 172 Y 7.84 4.82 0.00 3.11 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 0.00 173 P 0.00 4.51 0.00 2.08 2.04 0.00 3.80 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 2.05 2.11 0.00 174 G 9.11 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 0.00 175 Q 8.11 4.49 0.00 2.44 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.71 0.00 0.00 0.00 0.00 0.00 2.23 2.50 0.00 176 I 7.86 4.34 1.99 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.94 1.01 0.00 0.00 177 T 8.27 4.49 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 1.25 0.00 0.00 178 S 8.52 4.37 0.00 4.01 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 0.00 179 N 8.22 5.02 0.00 3.12 3.11 0.00 0.00 6.61 7.06 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 0.00 180 M 7.94 5.61 0.00 1.87 2.11 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 181 F 8.85 5.15 0.00 3.03 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 0.00 182 C 9.20 5.80 0.00 2.98 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 0.00 183 A 8.94 4.98 1.18 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 0.00 0.00 184A G 7.89 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 0.00 0.00 0.00 184 Y 8.44 4.79 0.00 2.95 3.06 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 0.00 0.00 0.00 0.00 185 L 8.43 4.61 0.00 1.72 1.69 0.92 0.80 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 0.00 186 E 8.28 4.16 0.00 2.09 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 2.28 2.25 0.00 187 G 7.76 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 188A G 9.60 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 0.00 188 K 7.37 4.86 0.00 1.47 1.73 0.00 1.48 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.20 7.81 189 D 8.71 4.63 0.00 2.76 2.52 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 0.00 190 S 8.81 5.00 0.00 4.00 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 0.00 191 C 9.24 4.78 0.00 2.95 3.16 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 0.00 0.00 0.00 192 Q 8.64 4.35 0.00 2.34 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.33 0.00 0.00 0.00 0.00 0.00 2.55 2.53 0.00 193 G 9.26 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.51 4.69 0.00 2.92 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 0.00 195 S 8.11 4.48 0.00 4.00 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 0.00 196 G 8.88 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 0.00 0.00 0.00 0.00 197 G 7.84 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.04 0.00 2.35 2.40 0.00 3.77 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 2.15 2.17 0.00 199 V 8.49 4.48 2.19 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 0.82 0.00 0.00 0.44 0.00 0.00 200 V 8.70 4.88 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 0.85 0.00 0.00 0.67 0.00 0.00 201 C 8.86 5.14 0.00 2.80 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 0.00 202 S 9.87 3.72 0.00 3.95 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 0.00 203 G 8.50 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 0.00 204 K 7.63 4.70 0.00 1.72 1.64 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.40 7.81 *209 L 8.22 4.23 0.00 1.50 1.65 1.02 0.76 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 0.00 210 Q 8.81 4.46 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.44 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 211 G 8.08 5.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.18 5.24 1.92 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 1.29 1.07 0.93 0.00 0.00 213 V 8.84 3.89 2.37 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 1.01 0.00 0.00 1.14 0.00 0.00 214 S 8.51 4.80 0.00 3.90 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.30 5.03 0.00 3.37 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 0.00 216 G 8.36 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 0.00 0.00 0.00 217 S 8.58 4.60 0.00 4.25 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 *219 G 8.00 4.40 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 0.00 220 C 8.10 4.99 0.00 2.96 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 221A A 9.27 3.79 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 0.00 221 Q 7.30 4.61 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.43 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 222 K 8.50 4.17 0.00 1.74 1.77 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.49 7.81 223 N 9.16 4.27 0.00 2.78 2.86 0.00 0.00 6.78 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 K 7.66 4.20 0.00 1.88 1.77 0.00 1.38 0.00 0.00 1.36 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.48 7.81 225 P 0.00 4.64 0.00 2.12 2.21 0.00 3.62 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 2.10 1.99 0.00 226 G 8.39 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.41 4.34 0.67 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 0.29 0.00 0.00 -0.63 0.00 0.00 228 Y 8.07 4.90 0.00 1.46 2.32 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 0.00 229 T 8.60 4.45 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 1.15 0.00 0.00 230 K 9.32 4.96 0.00 2.18 1.88 0.00 1.77 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.51 7.81 231 V 8.86 3.93 2.42 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 1.20 0.00 0.00 1.09 0.00 0.00 232 C 8.29 4.39 0.00 3.15 3.37 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 0.00 233 N 8.06 4.22 0.00 2.36 2.41 0.00 0.00 6.81 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 7.98 4.68 0.00 3.23 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 0.00 235 V 8.05 3.68 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 1.09 0.00 0.00 1.08 0.00 0.00 236 S 8.10 4.18 0.00 3.97 3.93 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 0.00 237 W 8.31 4.15 0.00 3.49 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.50 3.33 2.06 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.12 0.79 0.00 0.00 239 K 7.91 3.76 0.00 1.87 1.78 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.63 7.81 240 Q 8.04 3.85 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 241 T 7.16 3.51 3.26 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 0.77 0.00 0.00 242 I 7.12 2.67 1.48 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.01 0.43 0.00 0.00 243 A 7.59 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 S 7.54 4.57 0.00 4.03 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 0.00 245 N 7.95 4.68 0.00 3.08 3.06 0.00 0.00 6.76 6.90 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 * Residues marked with a * may have inaccurate shift predictions.