NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7491 8.2133 109.7296 45.7443 0.0000 174.9586 *2 Y 4.7092 7.5318 118.6391 56.3619 40.1346 175.1108 3 A 4.6325 7.2678 122.6996 50.6651 20.8011 176.6208 4 V 4.3003 8.0482 120.7026 60.7608 33.0749 173.5693 5 P 4.6721 0.0000 0.0000 62.9010 32.4507 175.5453 6 I 4.2932 8.5151 123.4944 59.7717 39.2220 174.3593 7 L 5.1113 8.3863 128.5531 53.3932 44.4460 174.5039 8 N 5.2352 9.0962 123.8618 51.2451 42.3395 173.8943 9 V 4.4358 8.4396 123.0149 61.4715 34.0892 173.6194 10 Y 5.2712 8.9345 126.9274 56.6501 40.2322 174.8065 11 D 5.7260 9.2690 122.1013 51.2310 43.3903 174.1157 12 F 5.0657 7.6363 112.9731 55.9514 41.3093 172.2183 13 E 4.5083 8.6037 121.5756 55.7986 30.7636 175.3461 14 V 4.5953 8.4043 127.5492 61.4230 32.7043 175.8685 15 K 3.9120 9.0486 129.6826 57.3015 32.7792 178.1131 16 K 3.7835 9.1394 126.9485 58.6491 31.6556 178.9283 17 D 5.0674 7.8000 116.3348 53.2824 40.4759 179.0069 18 K 4.8106 7.8497 117.8553 56.3932 33.5987 178.5443 19 E 4.1692 8.5112 120.9587 59.9602 29.3162 178.6722 20 T 3.8869 7.9664 116.1177 66.7103 68.6526 176.5957 21 S 4.2093 8.1228 116.4198 61.6092 62.8668 175.9614 22 Y 4.3480 8.4060 122.4919 60.7879 38.4900 178.3946 23 K 3.5054 8.2965 119.5772 59.1893 32.1506 179.3640 24 S 4.0316 8.0619 113.2169 61.4408 62.3678 176.1590 25 A 4.1613 8.1775 123.4680 55.4570 18.1223 179.7991 26 T 3.7710 8.0464 114.4498 66.4426 68.3862 176.9398 27 E 3.8476 8.3552 120.7928 59.5386 29.4875 178.8036 28 D 4.3782 8.0617 118.7645 57.7530 40.9703 178.5138 29 Y 4.1073 7.9077 119.5980 60.8365 38.5033 178.4540 30 V 3.2559 7.3840 117.7097 65.9657 31.6875 177.4768 31 N 4.4124 8.1718 115.6124 55.7779 38.7645 176.9461 32 K 4.1629 8.3673 121.4604 59.1504 32.2763 178.5344 33 T 4.0874 7.6876 112.7076 64.8731 67.7023 176.0069 *35 G 3.8156 7.9163 110.9763 44.7539 0.0000 174.2151 36 V 4.2186 7.3820 115.7773 63.0092 33.6810 175.5095 37 E 4.5239 8.1575 118.1869 55.1165 30.4406 175.6822 38 Q 4.3197 8.4074 120.1915 56.2082 30.2385 176.9257 39 G 3.8661 8.7408 108.4012 45.8899 0.0000 172.9788 40 V 4.3361 7.1263 120.1189 60.0203 32.4649 176.1568 41 L 4.2067 8.6116 125.6665 54.7455 42.4080 176.9621 42 G 4.5307 6.6112 110.4901 45.9969 0.0000 171.5987 43 L 5.2848 7.4491 121.6990 52.6506 46.1397 176.0902 44 F 4.6442 9.3835 120.7505 56.0214 42.6638 173.1313 45 A 5.1618 9.1462 126.9193 50.6427 20.8894 175.8403 46 A 5.4044 9.1407 123.4139 50.9534 23.7733 174.5116 47 T 5.1594 9.0009 113.5380 62.3700 73.6472 173.2174 48 D 5.1588 9.3065 125.3409 52.9235 42.9696 176.1661 49 E 4.5202 8.8814 124.7101 56.1480 30.2856 176.8001 50 R 3.9126 7.9639 121.7132 57.8958 30.1076 174.9705 51 D 4.6550 8.6753 124.6750 54.0121 38.6244 172.7783 52 K 4.6673 7.4174 118.8984 52.4620 36.0343 178.2831 53 T 4.1905 8.6217 120.3847 63.6657 69.5142 173.0796 54 T 4.7616 9.1615 123.8341 61.5404 71.5981 173.4272 55 S 4.5382 8.5023 121.9116 57.7690 63.8315 172.3219 56 Y 5.1507 8.7640 123.7810 56.3447 41.6805 174.9284 57 I 5.0157 8.8322 123.3994 60.0169 41.5212 174.1913 58 V 4.4124 8.8398 128.5644 61.7289 33.1532 174.5263 59 E 5.0436 9.3517 126.9548 54.5819 33.3569 174.5951 60 I 5.0487 8.3920 123.8067 59.4824 41.4494 173.5925 61 Y 5.1513 9.1657 126.0213 56.0307 41.6533 176.1116 62 N 4.4643 9.3069 120.7737 56.7177 39.9326 174.2012 63 D 4.8448 7.9938 115.6555 52.0405 41.9732 175.6213 64 Y 4.3397 8.2759 117.4628 59.8740 37.7413 177.9608 65 L 3.9565 7.4683 122.0285 57.8648 42.3324 178.4333 66 A 4.0015 8.8436 121.2753 54.9968 18.3158 179.4430 67 F 3.3785 8.1844 119.3690 61.2527 39.2669 177.6038 68 S 3.9288 8.1272 112.7626 61.4564 63.0230 175.9124 69 N 4.4140 8.2908 120.1797 56.1244 38.3697 176.8163 70 H 4.2157 7.8865 119.9262 59.4498 29.7779 177.3095 71 T 3.8135 7.3420 109.5616 63.5465 68.6257 175.5526 72 K 4.3017 7.4318 119.8055 56.2269 33.3138 176.4729 73 N 4.6507 7.3630 117.6760 52.4755 41.2181 175.2853 74 Q 3.9392 8.4825 122.3024 58.9287 29.0754 177.4783 75 A 4.0720 8.0617 121.4037 55.6037 18.4192 179.4660 76 S 4.2599 8.0755 110.8307 61.4129 62.2210 175.9884 77 K 3.9817 7.9397 122.0181 59.5727 31.6505 178.5953 78 D 4.3684 8.0439 118.4401 57.1010 41.0095 178.2597 79 F 4.4184 8.4060 123.6442 61.9873 38.3706 178.0061 80 K 3.5715 8.4476 123.3913 59.5706 31.1364 180.3638 81 A 4.1987 7.4213 118.6351 54.2543 18.6381 178.8188 82 V 3.9203 7.6295 116.4911 64.0313 32.2217 177.6178 83 I 3.1456 6.4572 120.3301 64.1177 36.7040 176.2571 84 P 4.1059 0.0000 0.0000 65.0479 31.2165 177.7204 85 Q 4.3131 7.7426 114.1372 56.5226 29.3333 176.0727 86 I 4.3322 7.4129 112.6821 60.3048 39.2341 174.3919 87 A 5.0820 7.7970 125.0513 50.5964 20.5261 176.4195 88 E 4.1078 9.3191 125.3900 58.1668 30.3421 176.3618 89 G 3.8937 7.8571 105.7839 46.6530 0.0000 170.8558 90 N 4.2807 9.2876 117.4142 50.2221 37.3640 173.5847 91 L 3.6824 8.2643 122.3915 56.6439 41.0385 173.5218 92 N 4.9859 7.9763 115.9831 53.1535 41.0249 176.1005 93 S 4.9352 8.2878 112.2248 57.8290 65.4907 174.0592 94 A 4.5789 8.8488 127.9383 50.5503 20.7935 175.3080 95 E 4.9343 8.5450 121.5588 53.9043 31.9918 174.9974 96 I 4.9414 8.3303 125.0386 59.3914 40.4568 175.1010 97 D 4.5225 8.9726 127.4613 53.7349 41.5302 175.9575 98 V 3.9944 8.3874 124.8383 63.3961 31.9479 175.1303 99 Q 4.5977 9.4938 126.9553 57.3993 30.8109 175.7530 100 I 5.1947 7.7599 118.2616 59.4819 41.7635 174.2326 101 A 5.1709 9.1937 127.7523 50.4152 22.1907 174.9859 102 K 5.0221 9.1594 121.6391 55.1797 36.4664 175.6131 103 D 5.4337 9.1019 125.1828 53.2475 43.4080 174.5802 104 K 4.8537 8.7053 122.5200 52.8927 35.2974 175.4701 105 K 4.3605 8.5690 120.1311 57.5377 32.8137 176.0364 106 I 4.2935 8.8656 128.9238 59.9004 38.2133 175.6027 107 E 4.4769 8.4709 126.1532 54.0192 28.9665 175.5236 108 Q 4.1772 8.2710 121.6282 56.2350 29.3949 175.9371 109 N 4.9957 8.6995 116.0446 51.7829 40.4618 174.6356 110 D 4.3720 8.7149 116.8582 57.5573 41.0819 177.5008 111 N 4.6483 8.6579 115.3785 54.3733 39.0852 175.0410 112 T 4.4893 7.6064 116.2921 63.9587 69.2068 173.4171 113 F 4.8212 9.2511 128.0266 56.3125 42.4156 173.3253 114 A 4.9766 7.9909 127.2362 50.0229 22.1538 174.9342 115 V 4.6331 8.2155 120.0385 61.1304 35.6868 173.6757 116 Y 5.3190 9.0879 127.9022 56.3352 41.6833 173.9719 117 T 5.0908 8.6537 123.4270 61.6203 72.2805 173.3234 118 V 4.7841 8.3654 124.8490 61.1038 34.8036 174.2277 119 I 4.9081 9.1704 127.9725 59.7620 40.8666 174.2993 120 D 5.0730 9.0354 130.7054 53.7739 41.3048 177.0505 121 V 4.0840 8.4356 123.4959 60.0970 33.1046 173.7786 122 K 4.1217 8.3901 122.4555 55.5998 32.7387 176.4620 123 P 4.3058 0.0000 0.0000 65.9767 30.9659 178.4302 124 E 4.0344 8.2504 115.8906 59.0498 29.7079 178.1273 125 N 4.8903 7.9818 113.6461 52.9585 39.0032 176.2869 126 D 4.5756 8.0745 124.6396 58.1527 41.2947 178.5771 127 K 4.0842 8.3069 123.5958 60.2325 31.3642 179.9521 128 E 4.2531 8.2471 119.6584 59.1606 29.5835 178.6998 129 F 3.9686 8.5094 120.3924 60.9502 39.3921 176.7482 130 A 3.5605 8.4208 120.6140 55.4368 18.1774 179.5374 131 E 3.9065 7.8052 115.3748 59.3948 29.4704 179.8533 132 I 3.5312 7.1340 119.6723 64.4205 37.1509 178.3671 133 I 3.2194 7.2598 119.7690 63.5225 37.7657 177.8092 134 K 3.8461 7.8426 119.5349 59.6399 31.8824 178.8788 135 N 4.2796 7.7739 116.0604 56.4591 38.4500 177.4942 136 I 3.6969 7.4608 121.0402 64.4631 37.1839 178.7077 137 V 3.6534 8.0052 119.2501 65.9757 31.1984 178.0090 138 E 4.0281 8.1293 118.0496 59.6346 29.0790 179.3220 139 T 3.7662 7.8336 114.8745 66.9138 68.7709 176.2870 140 T 4.1513 8.1655 117.6629 66.8541 68.3049 176.4093 141 F 4.1331 8.0209 121.0504 61.1146 39.4884 176.2724 142 N 4.4273 7.8072 114.1901 53.4992 39.2693 175.2036 143 E 4.0589 7.5313 122.5303 55.5368 30.4543 175.2842 144 E 3.9235 8.4671 125.8910 57.0740 30.4238 176.4069 145 G 4.1063 8.9202 114.0269 45.9281 0.0000 173.4734 146 T 3.9288 7.1414 115.8100 63.5977 68.7526 174.1025 147 L 4.4897 8.2532 126.2370 55.3517 44.1085 176.1678 148 L 4.8821 7.1255 117.7593 54.2257 45.6984 173.9592 149 V 4.7519 8.6182 118.5854 60.1466 35.9913 173.6450 150 Y 5.5046 9.3526 124.2435 56.1571 40.6293 174.6096 151 L 5.3887 9.4814 126.8690 53.5272 45.6170 175.5927 152 G 4.5426 8.9159 111.8271 46.1435 0.0000 171.4311 153 T 4.8427 7.9833 109.4867 59.1812 71.5640 173.5162 154 D 4.8012 8.7073 124.1839 54.7528 41.8963 177.2561 155 R 4.1221 8.7172 124.0213 58.6091 30.0833 178.3150 156 R 3.9512 9.1885 118.2491 58.4741 30.4855 176.2639 157 N 4.2804 7.6342 115.5671 52.7250 40.1442 174.4632 158 F 4.4160 8.1630 120.5350 58.1375 38.2780 175.6939 159 N 4.9389 8.4154 119.0639 53.6341 39.7904 174.5317 160 K 4.7930 8.2145 122.0212 54.8330 32.7926 174.8248 161 W 5.0187 9.3443 127.9168 56.0003 31.2380 175.2603 162 C 5.3000 9.5956 121.4930 57.8658 31.2267 172.6831 163 L 5.2319 9.1726 126.0139 53.3602 44.7456 174.5284 164 F 5.7008 9.3695 129.5555 56.5216 41.7986 174.1192 165 E 4.7447 8.2642 123.1992 54.5407 33.2004 174.2254 166 V 4.7033 7.9797 122.1018 61.2608 34.7434 173.8073 167 Y 5.1116 9.0503 126.1796 56.5547 41.5676 177.4245 168 K 4.2974 9.2399 125.8319 58.3027 32.0234 177.8319 169 D 5.5246 7.8123 116.5096 51.4974 42.2721 175.9000 170 I 2.8909 8.1981 119.2008 63.9517 37.6922 177.6722 171 D 4.2175 7.8592 119.4975 57.2748 40.8029 178.4749 172 S 4.1007 8.3100 115.6801 61.7468 62.8773 176.2457 173 Y 3.0343 7.2426 120.9235 60.4052 38.4919 178.1017 174 L 3.4976 7.4532 119.7634 57.6689 41.4303 179.3079 175 N 4.3636 8.1053 117.3521 55.5846 38.1754 176.7726 176 H 4.2520 7.6730 119.7034 58.9900 29.8494 177.0174 177 R 3.1976 6.8314 114.8157 56.7287 29.3845 177.3793 178 S 4.4336 7.5439 114.6520 57.6306 63.7402 173.3064 179 A 4.4041 6.9571 126.6367 51.7622 20.7717 179.0883 180 K 3.8486 8.7282 128.3980 60.4217 31.5522 178.7120 181 Y 4.5454 8.2573 118.5754 59.8167 37.5647 178.2938 182 F 3.9610 7.1880 121.5855 60.6386 39.7366 177.2819 183 K 3.8780 8.0628 118.1158 59.7640 31.8190 178.8909 184 D 4.3568 8.5488 119.3518 57.5018 40.6549 178.3842 185 Y 3.9780 7.5716 119.8616 60.6171 38.5664 177.9591 186 I 2.9574 7.1666 119.5006 64.4286 37.2564 178.1528 187 T 3.8981 7.6642 116.2605 66.7628 68.1104 176.3070 188 Q 3.9541 8.0568 120.4393 58.9144 29.1470 177.6093 189 T 4.4502 7.5204 109.7700 61.9906 69.2481 176.6051 190 K 3.9921 7.4592 130.1102 60.4726 32.7417 182.9563 191 D 4.7850 7.7117 118.1826 51.9806 39.1793 178.2514 *193 I 3.8422 7.2939 120.5441 61.5083 38.7631 176.2830 194 A 4.3643 8.7712 126.3199 53.8131 20.0026 177.4494 195 G 4.0702 7.7423 99.3060 46.0470 0.0000 172.6942 196 K 5.2102 8.6107 123.3772 55.6110 35.6691 175.8581 197 K 4.5722 8.9292 129.6542 53.6165 35.3083 172.7945 198 R 4.8469 8.7517 126.4080 53.7562 31.8148 175.3614 199 A 4.6502 8.7313 127.6340 49.8770 21.4806 174.8645 200 E 4.0951 8.8253 121.5047 57.0940 30.2143 176.8475 201 L 4.8470 8.2754 124.0634 52.7541 45.2298 176.1316 202 Q 4.2186 8.9767 124.8610 55.0919 29.8357 175.2720 203 V 3.8230 8.4620 127.3841 63.5599 31.8626 173.8746 204 L 4.6057 8.8862 128.0784 55.7415 43.6730 176.0604 205 K 4.7856 7.6000 117.9311 55.2758 35.8210 173.7871 206 I 4.9295 9.0141 128.0436 59.5774 40.5335 174.9000 207 E 4.7316 8.4523 125.2567 54.7360 33.6753 174.1688 208 N 5.0153 8.4163 120.1293 51.3581 39.9643 174.6010 209 K 3.8913 8.5670 121.9285 57.7332 32.4944 178.6404 210 G 4.0326 8.1984 102.1061 46.5929 0.0000 173.0824 211 G 3.9282 8.4283 105.8454 45.5809 0.0000 173.8293 212 L 4.1034 8.8263 122.4931 55.3269 43.2822 176.1489 213 D 5.2165 8.4358 123.6394 53.2878 42.2925 172.6150 214 Y 4.8602 9.5959 126.6225 55.7622 42.5849 174.7823 215 K 4.7324 7.2512 127.4463 53.1045 35.7810 174.8494 216 K 3.5145 8.9048 129.7053 57.3154 32.3826 177.4475 217 L 4.0015 7.5841 126.5303 53.9820 40.7575 172.7371 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 0 G 8.21 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 0.00 0.00 0.00 *2 Y 7.53 4.71 0.00 3.06 2.99 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 3 A 7.27 4.63 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 V 8.05 4.30 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 1.00 0.00 0.00 1.00 0.00 0.00 5 P 0.00 4.67 0.00 1.75 1.61 0.00 3.40 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.44 0.00 6 I 8.52 4.29 1.94 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.87 0.57 0.00 0.00 7 L 8.39 5.11 0.00 1.56 1.40 0.94 0.58 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 8 N 9.10 5.24 0.00 2.61 2.01 0.00 0.00 6.01 7.29 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 9 V 8.44 4.44 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 0.76 0.00 0.00 0.81 0.00 0.00 10 Y 8.93 5.27 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 11 D 9.27 5.73 0.00 1.96 2.26 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 12 F 7.64 5.07 0.00 3.19 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 13 E 8.60 4.51 0.00 2.06 1.87 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 2.27 2.21 0.00 14 V 8.40 4.60 1.84 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 0.75 0.00 0.00 -0.00 0.00 0.00 15 K 9.05 3.91 0.00 1.76 1.73 0.00 1.90 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.67 1.36 7.81 16 K 9.14 3.78 0.00 1.77 1.73 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.05 7.81 17 D 7.80 5.07 0.00 2.68 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 18 K 7.85 4.81 0.00 1.72 1.83 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.64 7.81 19 E 8.51 4.17 0.00 2.32 2.30 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 2.44 2.42 0.00 20 T 7.97 3.89 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 1.24 0.00 0.00 21 S 8.12 4.21 0.00 3.94 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 22 Y 8.41 4.35 0.00 3.10 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 23 K 8.30 3.51 0.00 1.78 1.73 0.00 1.75 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.25 1.52 7.81 24 S 8.06 4.03 0.00 4.12 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 25 A 8.18 4.16 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 0.00 0.00 0.00 0.00 0.00 26 T 8.05 3.77 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 27 E 8.36 3.85 0.00 2.16 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 28 D 8.06 4.38 0.00 2.98 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Y 7.91 4.11 0.00 2.70 2.72 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 30 V 7.38 3.26 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.87 0.00 0.00 31 N 8.17 4.41 0.00 2.74 2.82 0.00 0.00 7.01 8.32 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 32 K 8.37 4.16 0.00 1.93 1.82 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.34 7.81 33 T 7.69 4.09 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 1.19 0.00 0.00 *35 G 7.92 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 36 V 7.38 4.22 2.25 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 0.84 0.00 0.00 0.92 0.00 0.00 37 E 8.16 4.52 0.00 2.13 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 2.31 2.34 0.00 38 Q 8.41 4.32 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.97 0.00 0.00 0.00 0.00 0.00 2.41 2.29 0.00 39 G 8.74 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 40 V 7.13 4.34 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 0.74 0.00 0.00 0.66 0.00 0.00 41 L 8.61 4.21 0.00 1.80 1.73 0.82 0.61 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 42 G 6.61 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.45 5.28 0.00 1.30 1.31 0.59 0.56 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 44 F 9.38 4.64 0.00 2.81 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 45 A 9.15 5.16 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 9.14 5.40 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 9.00 5.16 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 1.37 0.00 0.00 48 D 9.31 5.16 0.00 3.00 2.73 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 49 E 8.88 4.52 0.00 2.02 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 2.29 2.36 0.00 50 R 7.96 3.91 0.00 1.88 1.90 0.00 3.34 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.61 0.00 51 D 8.68 4.66 0.00 2.86 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 7.42 4.67 0.00 1.70 1.53 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.25 1.01 7.81 53 T 8.62 4.19 4.16 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 1.08 0.00 0.00 54 T 9.16 4.76 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 0.76 0.00 0.00 55 S 8.50 4.54 0.00 2.80 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 56 Y 8.76 5.15 0.00 2.94 2.64 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 57 I 8.83 5.02 2.21 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.99 1.13 0.00 0.00 58 V 8.84 4.41 1.63 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 0.87 0.00 0.00 -0.17 0.00 0.00 59 E 9.35 5.04 0.00 2.35 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 0.00 2.42 2.61 0.00 60 I 8.39 5.05 1.74 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.69 1.10 0.00 0.00 61 Y 9.17 5.15 0.00 2.98 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 62 N 9.31 4.46 0.00 2.88 2.85 0.00 0.00 6.98 9.05 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 63 D 7.99 4.84 0.00 2.74 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 8.28 4.34 0.00 3.27 3.27 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 65 L 7.47 3.96 0.00 1.49 1.65 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.84 4.00 1.46 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 67 F 8.18 3.38 0.00 2.85 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 68 S 8.13 3.93 0.00 4.11 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 0.00 69 N 8.29 4.41 0.00 2.81 2.88 0.00 0.00 6.58 7.75 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 70 H 7.89 4.22 0.00 3.22 3.11 0.00 5.78 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 71 T 7.34 3.81 4.03 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 0.42 0.00 0.00 72 K 7.43 4.30 0.00 1.84 1.84 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.50 7.81 73 N 7.36 4.65 0.00 2.95 2.83 0.00 0.00 6.66 5.97 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 74 Q 8.48 3.94 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.63 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 75 A 8.06 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.08 4.26 0.00 3.83 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 77 K 7.94 3.98 0.00 2.06 1.79 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.45 7.81 78 D 8.04 4.37 0.00 2.95 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 79 F 8.41 4.42 0.00 2.90 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 80 K 8.45 3.57 0.00 1.75 1.82 0.00 1.86 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.34 7.81 81 A 7.42 4.20 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 82 V 7.63 3.92 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 1.02 0.00 0.00 0.92 0.00 0.00 83 I 6.46 3.15 1.42 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 -0.36 0.36 0.00 0.00 84 P 0.00 4.11 0.00 1.91 2.02 0.00 3.41 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 1.90 2.00 0.00 85 Q 7.74 4.31 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.69 0.00 0.00 0.00 0.00 0.00 2.50 2.33 0.00 86 I 7.41 4.33 2.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.87 0.96 0.00 0.00 87 A 7.80 5.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 E 9.32 4.11 0.00 1.90 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 2.31 2.29 0.00 89 G 7.86 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 90 N 9.29 4.28 0.00 2.91 2.80 0.00 0.00 6.70 7.85 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 91 L 8.26 3.68 0.00 1.73 1.71 0.80 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 92 N 7.98 4.99 0.00 2.98 2.77 0.00 0.00 6.63 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 93 S 8.29 4.94 0.00 3.64 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 94 A 8.85 4.58 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.54 4.93 0.00 1.86 1.77 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 2.32 2.09 0.00 96 I 8.33 4.94 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.60 0.99 0.00 0.00 97 D 8.97 4.52 0.00 2.52 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 98 V 8.39 3.99 2.05 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 0.86 0.00 0.00 0.80 0.00 0.00 99 Q 9.49 4.60 0.00 2.36 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.55 0.00 0.00 0.00 0.00 0.00 2.31 2.65 0.00 100 I 7.76 5.19 1.95 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 1.29 1.01 0.90 0.00 0.00 101 A 9.19 5.17 1.07 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 0.00 102 K 9.16 5.02 0.00 0.79 0.74 0.00 1.52 0.00 0.00 1.39 0.00 0.00 2.85 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.19 1.16 7.81 103 D 9.10 5.43 0.00 2.98 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 0.00 104 K 8.71 4.85 0.00 1.53 1.61 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.60 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.28 1.21 7.81 105 K 8.57 4.36 0.00 1.79 1.76 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.65 1.43 7.81 106 I 8.87 4.29 1.95 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.97 0.98 0.00 0.00 107 E 8.47 4.48 0.00 1.94 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 2.23 2.21 0.00 108 Q 8.27 4.18 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.72 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 109 N 8.70 5.00 0.00 2.94 2.95 0.00 0.00 7.02 7.38 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 0.00 110 D 8.71 4.37 0.00 2.71 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 0.00 111 N 8.66 4.65 0.00 2.99 3.00 0.00 0.00 6.90 7.38 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 0.00 112 T 7.61 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 1.26 0.00 0.00 113 F 9.25 4.82 0.00 3.11 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 0.00 114 A 7.99 4.98 1.08 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 0.00 115 V 8.22 4.63 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 0.96 0.00 0.00 0.33 0.00 0.00 116 Y 9.09 5.32 0.00 3.03 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.65 5.09 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 1.29 0.00 0.00 118 V 8.37 4.78 2.05 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 1.06 0.00 0.00 0.75 0.00 0.00 119 I 9.17 4.91 2.01 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.73 0.90 0.00 0.00 120 D 9.04 5.07 0.00 2.60 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 0.00 0.00 0.00 121 V 8.44 4.08 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 0.69 0.00 0.00 0.93 0.00 0.00 122 K 8.39 4.12 0.00 1.80 1.92 0.00 1.87 0.00 0.00 1.81 0.00 0.00 2.86 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.51 1.42 7.81 123 P 0.00 4.31 0.00 2.16 2.11 0.00 3.60 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.31 0.00 124 E 8.25 4.03 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 125 N 7.98 4.89 0.00 2.78 2.87 0.00 0.00 6.65 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 0.00 126 D 8.07 4.58 0.00 2.92 2.88 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 0.00 127 K 8.31 4.08 0.00 1.80 1.82 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.45 1.09 7.81 128 E 8.25 4.25 0.00 2.07 2.05 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 2.41 2.39 0.00 129 F 8.51 3.97 0.00 3.18 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 0.00 130 A 8.42 3.56 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 E 7.81 3.91 0.00 2.02 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 2.36 2.51 0.00 132 I 7.13 3.53 1.65 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 1.34 0.95 0.84 0.00 0.00 133 I 7.26 3.22 0.77 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 1.32 1.27 0.12 0.00 0.00 134 K 7.84 3.85 0.00 1.96 1.84 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.57 1.67 7.81 135 N 7.77 4.28 0.00 2.83 2.80 0.00 0.00 7.09 8.68 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 0.00 136 I 7.46 3.70 1.58 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.22 0.80 0.00 0.00 137 V 8.01 3.65 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 1.09 0.00 0.00 1.00 0.00 0.00 138 E 8.13 4.03 0.00 2.21 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 2.32 2.46 0.00 139 T 7.83 3.77 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 0.53 0.00 0.00 140 T 8.17 4.15 4.54 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 1.21 0.00 0.00 141 F 8.02 4.13 0.00 2.97 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 N 7.81 4.43 0.00 2.75 2.81 0.00 0.00 6.97 7.58 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 0.00 143 E 7.53 4.06 0.00 2.20 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.12 0.00 144 E 8.47 3.92 0.00 1.91 1.82 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 2.27 2.35 0.00 145 G 8.92 4.11 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 0.00 0.00 0.00 146 T 7.14 3.93 3.94 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 0.93 0.00 0.00 147 L 8.25 4.49 0.00 1.58 1.67 0.93 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 148 L 7.13 4.88 0.00 1.54 1.11 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 149 V 8.62 4.75 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 0.78 0.00 0.00 0.90 0.00 0.00 150 Y 9.35 5.50 0.00 2.92 2.73 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 0.00 151 L 9.48 5.39 0.00 1.85 1.65 1.28 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 152 G 8.92 4.54 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 0.00 0.00 0.00 153 T 7.98 4.84 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 -0.56 0.00 0.00 154 D 8.71 4.80 0.00 2.74 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 0.00 155 R 8.72 4.12 0.00 1.72 1.96 0.00 3.16 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.72 0.00 156 R 9.19 3.95 0.00 1.93 1.96 0.00 3.20 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.55 0.00 157 N 7.63 4.28 0.00 2.60 2.58 0.00 0.00 6.80 8.07 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 0.00 158 F 8.16 4.42 0.00 2.87 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 0.00 159 N 8.42 4.94 0.00 2.76 3.09 0.00 0.00 6.75 7.64 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 0.00 160 K 8.21 4.79 0.00 1.81 1.82 0.00 1.62 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.65 7.81 161 W 9.34 5.02 0.00 3.45 3.36 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 0.00 162 C 9.60 5.30 0.00 2.95 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 0.00 163 L 9.17 5.23 0.00 1.85 1.60 1.09 0.82 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 0.00 164 F 9.37 5.70 0.00 3.28 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 0.00 165 E 8.26 4.74 0.00 1.75 1.85 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 2.31 2.40 0.00 166 V 7.98 4.70 1.82 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 1.03 0.00 0.00 0.44 0.00 0.00 167 Y 9.05 5.11 0.00 3.05 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 0.00 168 K 9.24 4.30 0.00 1.51 1.73 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.39 1.26 7.81 169 D 7.81 5.52 0.00 2.83 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 0.00 170 I 8.20 2.89 1.59 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.18 0.79 0.00 0.00 171 D 7.86 4.22 0.00 2.74 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 0.00 0.00 0.00 172 S 8.31 4.10 0.00 4.12 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 0.00 173 Y 7.24 3.03 0.00 2.23 2.50 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 0.00 174 L 7.45 3.50 0.00 1.69 1.50 0.81 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 175 N 8.11 4.36 0.00 2.57 2.83 0.00 0.00 6.90 7.83 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 0.00 176 H 7.67 4.25 0.00 3.23 3.17 0.00 5.77 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 R 6.83 3.20 0.00 1.37 0.83 0.00 2.21 0.00 0.00 2.92 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.30 0.00 178 S 7.54 4.43 0.00 3.99 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 0.00 179 A 6.96 4.40 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 0.00 180 K 8.73 3.85 0.00 1.77 1.86 0.00 1.81 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.10 7.81 181 Y 8.26 4.55 0.00 3.16 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 0.00 182 F 7.19 3.96 0.00 2.37 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 0.00 183 K 8.06 3.88 0.00 1.83 1.83 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.60 7.81 184 D 8.55 4.36 0.00 2.86 2.73 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 0.00 185 Y 7.57 3.98 0.00 2.87 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 I 7.17 2.96 1.80 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.80 0.76 0.00 0.00 187 T 7.66 3.90 4.32 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 1.16 0.00 0.00 188 Q 8.06 3.95 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 189 T 7.52 4.45 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 190 K 7.46 3.99 0.00 1.86 1.79 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.40 1.35 7.81 191 D 7.71 4.78 0.00 2.69 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *193 I 7.29 3.84 1.82 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 1.18 1.03 0.94 0.00 0.00 194 A 8.77 4.36 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 G 7.74 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 0.00 196 K 8.61 5.21 0.00 1.75 1.66 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.50 7.81 197 K 8.93 4.57 0.00 1.47 1.63 0.00 1.84 0.00 0.00 1.57 0.00 0.00 2.72 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.25 1.22 7.81 198 R 8.75 4.85 0.00 1.89 1.92 0.00 3.41 0.00 0.00 3.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 199 A 8.73 4.65 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 0.00 200 E 8.83 4.10 0.00 1.84 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 0.00 2.30 2.39 0.00 201 L 8.28 4.85 0.00 1.43 1.49 0.74 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 202 Q 8.98 4.22 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.99 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 203 V 8.46 3.82 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 0.84 0.00 0.00 0.95 0.00 0.00 204 L 8.89 4.61 0.00 1.69 1.70 0.54 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 205 K 7.60 4.79 0.00 1.83 1.53 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.47 7.81 206 I 9.01 4.93 1.91 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.89 0.89 0.00 0.00 207 E 8.45 4.73 0.00 1.67 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 2.11 2.28 0.00 208 N 8.42 5.02 0.00 2.91 2.53 0.00 0.00 6.16 7.13 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 0.00 209 K 8.57 3.89 0.00 1.76 1.89 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.38 7.81 210 G 8.20 4.03 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 0.00 0.00 0.00 211 G 8.43 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 0.00 212 L 8.83 4.10 0.00 1.87 1.76 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 213 D 8.44 5.22 0.00 2.66 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 Y 9.60 4.86 0.00 3.00 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 0.00 215 K 7.25 4.73 0.00 1.52 1.50 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.25 1.00 7.81 216 K 8.90 3.51 0.00 2.01 1.79 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.47 7.81 217 L 7.58 4.00 0.00 1.77 1.72 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.