NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 S 4.3485 8.1933 116.6488 58.5619 64.1520 172.3403 8 F 5.1259 8.3901 122.9425 54.6550 41.6760 173.4787 9 L 4.6651 9.4677 124.3025 54.8111 43.9661 174.9478 10 H 5.4820 9.3664 121.9751 53.5610 33.3780 173.1974 11 I 4.0414 8.4252 121.9457 62.9187 37.4082 177.5198 12 G 4.0054 9.4278 114.3712 45.2499 0.0000 173.3326 13 D 4.7559 8.1929 119.5904 54.5095 42.4179 175.3879 14 I 5.0386 8.7979 122.3321 60.1024 39.7816 174.7677 15 C 5.7583 9.4953 124.3121 58.2797 33.3723 172.7726 16 S 5.5817 9.2520 113.6790 55.9225 66.3744 173.3000 17 L 5.3127 8.7459 120.1520 53.4492 44.5486 174.8660 18 Y 4.5426 9.1660 126.9146 55.7919 40.2673 174.5177 19 A 3.6383 8.4674 129.9636 51.2792 20.1683 175.9478 20 E 4.5066 8.0326 120.9119 54.7089 30.9424 174.0639 21 G 3.7851 8.5203 119.0077 45.0161 0.0000 174.8125 22 S 4.3546 8.7832 115.6363 60.5704 63.3924 174.9674 23 T 4.5238 7.1016 115.9488 61.5117 71.5230 172.8521 24 N 4.6898 9.5497 122.7838 50.5620 41.0896 174.3353 25 G 4.4015 6.1453 111.0921 44.6152 0.0000 171.5547 26 F 5.2167 8.1980 118.5615 56.6955 40.3653 175.5899 27 I 4.5015 8.7194 123.8778 61.8359 38.3945 175.5476 28 S 4.9752 9.3658 120.6162 57.6949 67.0712 171.7155 29 T 5.0273 8.6456 109.4982 59.4701 71.8615 173.5833 30 L 4.6647 8.1934 118.3730 54.4707 42.1770 175.9019 31 G 3.8947 8.1475 103.4440 44.5871 0.0000 173.8380 32 L 4.1675 8.2291 117.4988 55.9815 42.1014 178.2610 33 V 4.0421 7.5566 117.0620 63.9321 32.9190 175.5178 34 D 4.3835 7.9647 119.5507 54.3622 41.4277 174.8680 35 D 4.7394 8.6491 125.2730 53.4232 39.8743 175.8123 36 R 4.5203 7.8960 119.0055 56.4618 31.2733 175.6123 37 C 5.0402 8.5987 119.6727 58.3811 31.3738 173.3049 38 V 5.1563 8.6350 114.8027 60.1388 36.8324 173.8533 39 V 4.9132 8.6391 120.0314 60.4302 34.7650 174.3184 40 Q 5.0076 8.9923 126.7029 52.5790 29.2218 174.1584 41 P 4.9879 0.0000 0.0000 65.1604 31.3840 178.7885 42 E 3.8004 8.1426 116.1756 57.9260 30.0563 177.7152 43 A 4.1256 8.1643 122.5390 52.7263 18.5909 177.6258 44 G 4.6110 6.2641 105.4532 45.7607 0.0000 170.7925 45 D 5.0437 8.3344 118.0180 52.1113 42.0554 175.6571 46 L 3.9364 8.0377 117.3334 58.3394 41.6138 178.2088 47 N 4.6036 8.0892 113.9063 54.7639 39.4866 175.0933 48 N 5.0204 8.7776 115.8969 49.9466 38.9594 171.6660 49 P 4.8889 0.0000 0.0000 61.0927 32.2646 175.6479 50 P 5.2387 0.0000 0.0000 62.2240 31.8578 176.4257 51 K 4.0522 8.7575 120.9339 59.4607 32.8358 178.1718 52 K 4.3446 7.7078 119.7137 55.5674 31.3789 177.0503 53 F 3.9028 7.8318 124.7025 61.0049 40.6201 176.8431 54 R 3.6480 7.9887 120.7089 59.2825 29.8703 177.0225 55 D 4.4772 7.6189 114.6702 55.5410 41.4091 175.8524 56 C 4.8137 7.4935 115.3502 59.3176 29.6622 172.9436 57 L 4.5639 7.0007 119.6299 53.9085 42.7443 175.8888 58 F 5.1356 9.5844 121.7886 55.4858 43.3975 173.6556 59 K 5.0502 9.0787 123.5169 54.6884 34.7743 175.0789 60 L 4.7122 8.8017 127.5091 54.8015 42.7451 175.8652 61 C 5.2734 9.1492 121.0632 57.2319 32.6427 172.1819 62 P 4.7113 0.0000 0.0000 62.0787 32.7963 175.2587 63 M 4.2637 8.2816 120.7937 55.1858 32.2625 175.8596 64 N 4.6501 8.9011 124.0290 52.7244 39.6901 175.2637 65 R 4.3405 8.7523 121.4291 56.4778 30.9660 176.3787 66 Y 4.7327 8.4135 115.8719 56.7397 40.6364 177.4023 67 S 4.0720 8.4721 116.8222 61.8943 62.9298 176.3535 68 A 3.9476 8.8557 123.3855 55.1033 18.0998 179.7088 69 Q 3.4618 8.2699 116.7361 58.7101 28.6225 178.8719 70 K 3.7835 7.8829 120.9389 59.4454 31.9810 178.5729 71 Q 3.9403 7.6668 118.8088 59.0162 29.1533 177.8687 72 F 4.4301 8.0884 121.6607 61.1646 39.2974 177.1046 73 W 4.1350 8.1657 117.5885 59.8432 28.9388 178.1313 74 K 4.1901 8.3227 118.1350 57.2516 31.6033 176.2292 75 A 4.5956 7.4717 122.3509 50.0004 22.0065 175.0531 *82 S 4.4594 8.9668 117.4891 58.3168 63.6976 176.0209 83 T 4.7347 8.9353 106.1010 60.3136 70.8779 171.8726 84 T 4.3624 8.2712 120.2850 64.1172 70.8520 174.9635 85 D 4.4163 7.8400 121.3193 54.0159 41.8438 176.5994 86 A 4.0830 8.6098 130.0229 55.0117 18.4449 179.1992 87 V 3.5379 7.8817 116.5704 65.9445 31.5951 177.9204 88 L 3.9271 8.6704 120.4995 58.2148 42.0700 178.6099 89 L 4.0711 7.9430 120.2106 58.4044 41.9055 178.6393 90 N 4.5131 8.3011 116.2826 55.7561 38.5220 177.6467 91 K 4.0435 7.8431 120.1022 59.3768 32.1520 179.4132 92 L 4.0520 8.3012 119.5769 57.7868 41.5461 179.0191 93 H 2.7648 8.1690 118.3483 58.9487 29.7447 176.7839 94 H 4.1526 8.1607 119.8023 59.3249 29.7470 176.9885 95 A 3.8586 8.0441 122.2718 55.2002 18.1084 179.5091 96 A 3.8472 7.9512 119.1775 55.1866 18.3555 179.6671 97 D 4.2304 7.7943 117.5981 57.4097 40.8928 178.9350 98 L 3.9377 7.9287 119.6529 57.4944 41.5544 179.2287 99 E 3.8538 8.0385 119.3972 59.2521 29.6223 179.0455 100 K 3.9566 8.1568 118.6825 59.2454 31.9958 179.3092 101 K 3.9595 8.1720 120.1049 59.4294 32.0347 178.7424 102 Q 3.9263 8.1304 119.9859 59.0501 28.9389 177.9307 103 N 4.2659 8.2142 117.6383 56.1293 38.6159 176.8287 104 E 3.9104 8.1185 120.6511 59.6507 29.6053 179.0347 105 T 3.8382 8.0131 115.5447 66.8609 68.7059 176.6514 106 E 3.9842 8.4976 120.8031 59.5175 29.2498 179.2558 107 N 4.4081 8.5911 115.9580 56.1118 38.8969 177.1575 108 R 4.0575 7.9033 119.9853 59.3163 29.9661 178.7362 109 K 4.0736 7.7302 117.2367 58.9499 32.3553 178.5185 110 L 4.3017 7.7035 117.3507 54.3143 41.8129 176.7840 111 L 4.1776 6.9978 119.8861 56.2940 41.8627 177.7130 112 G 3.5484 8.9050 112.0803 45.2927 0.0000 173.3992 113 T 4.3218 7.6894 110.7702 60.8156 70.4752 174.5154 114 V 4.1120 8.2615 124.1889 63.0685 32.5637 175.2437 115 I 4.1780 8.6551 128.8458 60.9377 38.5801 174.9181 116 Q 4.9835 8.7564 125.3690 53.9184 31.7962 175.0229 117 Y 4.4680 8.7449 120.8736 59.6393 38.3749 177.4977 118 G 4.0708 9.2129 113.1859 45.3525 0.0000 173.8699 119 N 4.6624 8.2515 117.2849 53.3505 39.9614 174.1078 120 V 4.8717 8.2335 121.3219 61.6839 32.9921 174.8520 121 I 4.9979 9.1022 120.4830 59.4765 41.7619 173.7383 122 Q 5.3718 9.2532 120.5701 54.1535 33.1315 174.9996 123 L 5.1537 8.7883 120.6324 53.1853 44.7442 175.3448 124 L 4.7263 8.9394 127.9266 53.6897 43.6290 175.1292 125 H 3.8334 9.1954 128.4862 55.6597 29.9690 175.9518 126 L 3.7998 7.9118 127.4481 57.6965 41.8103 178.8943 127 K 3.8895 7.5623 118.3718 59.0922 32.0840 177.5075 128 S 4.3335 7.7286 110.0373 57.6461 63.9247 172.9320 129 N 4.0629 7.8312 118.7301 54.8058 37.5948 173.4003 130 K 4.6516 7.3963 113.9192 54.5994 37.1354 175.7758 131 Y 5.1539 8.8821 120.6875 56.8274 39.5878 174.9243 132 L 4.4859 8.9573 126.0942 55.7680 43.4781 175.9171 133 T 5.0245 9.3045 122.6361 62.0087 73.0720 172.9862 134 V 4.4755 8.7389 126.5062 62.0079 33.7489 174.6220 135 N 4.9743 9.0686 126.1731 51.0330 38.7742 175.4665 136 K 3.9988 8.9632 123.7127 58.3498 32.6576 178.2359 137 R 4.4719 7.8400 113.3468 55.5042 30.0530 175.3479 138 L 4.9214 7.9059 119.3927 52.4203 45.0450 174.4816 139 P 4.8819 0.0000 0.0000 62.2182 32.3552 176.0374 140 A 4.1608 8.5735 123.6918 52.0847 18.6062 178.0592 141 L 4.0611 8.7222 119.5274 57.3026 42.1149 178.2203 142 L 4.3379 8.3186 115.9350 56.2090 43.2976 176.7873 143 E 3.8538 8.5171 124.5739 55.1724 28.8205 176.8211 144 K 3.7887 8.5810 125.7968 60.7406 32.4058 177.2433 145 N 4.5914 8.0565 114.7336 52.6510 38.8318 174.7579 146 A 4.8141 7.7152 120.9238 50.9774 21.7298 176.5792 147 M 4.8743 8.9780 119.1308 53.7896 34.7552 175.9097 148 R 4.3633 9.0260 122.6426 56.3419 31.5834 175.2098 149 V 5.0194 8.3759 125.6490 61.4514 33.7626 174.4212 150 T 4.9917 9.1137 117.0075 60.3292 73.0903 172.1362 151 L 5.0764 8.3265 121.9982 53.4462 43.2499 176.0871 152 D 4.6429 9.1049 123.2469 52.4536 43.8566 175.2473 153 E 3.8388 9.3894 127.1973 59.5521 29.8307 177.9029 154 A 4.2533 8.0917 120.1123 52.9591 18.8518 178.4780 155 G 4.0257 10.2167 103.3741 45.6267 0.0000 171.4466 156 N 3.1400 7.5046 112.9098 51.8413 39.8594 174.7988 157 E 2.5400 7.8696 116.0128 58.8459 29.6647 178.7934 158 G 3.7530 8.2596 106.6770 46.3118 0.0000 174.8868 159 S 4.6637 7.4042 114.8072 57.8349 63.6123 173.9660 160 W 4.9105 7.4738 122.2399 56.0710 30.1738 175.4173 161 F 5.3096 9.2438 123.4189 55.7653 42.5499 173.9576 162 Y 4.9039 9.3267 121.3281 57.7171 39.5533 174.4473 163 I 4.8179 8.7986 124.6911 60.0811 39.3478 174.2362 164 Q 5.3782 9.2122 129.3777 53.2080 32.1980 173.4422 165 P 4.3242 0.0000 0.0000 62.7863 31.4145 176.1642 166 F 4.2220 8.8131 126.7504 60.4585 39.9043 174.4801 167 Y 4.9412 7.7193 113.6284 56.1461 40.7259 175.1509 168 K 4.4089 8.5125 117.8282 56.6244 32.2753 178.1981 169 L 4.1719 8.0905 120.8960 57.1340 41.7354 177.5013 170 R 4.8538 7.6652 114.3829 54.3784 33.8427 174.0004 171 S 4.7016 9.2044 115.4764 56.0085 66.6284 173.6339 172 I 3.9998 8.1313 121.5279 63.7054 37.0725 175.6345 173 G 4.1460 9.0733 112.5047 45.5559 0.0000 173.9070 174 D 4.7304 8.2286 118.8966 53.8577 42.2231 176.5457 175 S 4.5996 8.4932 117.3758 58.5657 63.8395 174.2531 176 V 3.5925 8.5342 124.4964 62.7727 32.6283 174.8806 177 V 4.7560 8.7833 127.7210 61.0291 33.5792 175.3204 178 I 4.0089 8.2832 128.6778 63.1434 37.3699 176.8097 179 G 4.0650 9.0489 113.7316 45.0888 0.0000 173.5883 180 D 4.7152 8.1198 120.0578 54.4341 42.5553 175.3970 181 K 5.0271 8.7369 120.9211 55.4789 34.0996 176.1369 182 V 5.2264 9.1656 117.4051 59.6877 36.6071 174.2541 183 V 4.7961 9.3148 121.7114 61.4447 33.9785 174.5101 184 L 4.9727 8.8044 127.6463 53.3821 43.2573 174.5086 185 N 5.3021 9.1089 124.2591 50.9740 40.5842 172.2169 186 P 4.2708 0.0000 0.0000 63.2633 31.5528 176.8607 187 V 3.5860 8.2696 124.6137 65.6111 31.3805 176.7444 188 N 5.0173 8.0784 111.5325 52.0930 38.9364 175.0748 189 A 4.0662 8.2037 122.5332 52.9094 19.2717 177.5732 190 G 4.3885 7.1704 101.3717 46.5757 0.0000 171.5295 191 Q 4.4912 7.4776 120.7785 54.3189 30.3783 174.3922 192 P 4.7676 0.0000 0.0000 62.9759 32.7176 175.7670 193 L 4.5821 8.7535 125.1168 55.8414 42.7136 175.7063 194 H 5.1365 9.8507 125.9721 54.4294 33.0539 172.3205 195 A 4.5936 8.3379 127.9982 50.6758 18.8385 176.9420 196 S 4.2658 8.3461 116.7462 58.5357 64.9931 174.4026 197 S 4.6822 8.3949 112.4896 58.6397 63.9474 174.6286 198 H 4.4156 8.3060 119.4338 54.6820 27.8576 174.6583 199 Q 4.6345 8.3429 126.1643 55.3514 28.6031 175.6679 200 L 4.2038 8.7159 125.5357 54.5324 42.4649 178.3427 201 V 3.5812 8.5393 123.9487 66.0849 31.8044 176.9540 202 D 4.4335 8.1937 117.5196 55.5786 39.3091 175.8577 203 N 5.0377 7.2058 115.8947 49.9439 42.3661 174.9762 204 P 4.1377 0.0000 0.0000 63.9013 29.8389 178.0670 205 G 4.1406 9.5675 109.6839 45.0270 0.0000 172.8761 206 C 5.1765 8.0687 116.7436 57.8861 31.8179 172.7898 207 N 5.4743 8.9118 120.0730 50.9810 41.8104 173.7225 208 E 4.3448 9.0392 124.2699 56.5198 31.0083 175.4434 209 V 4.9089 8.2017 126.7006 61.6070 33.3585 174.5117 210 N 5.0304 8.8719 124.5313 51.8859 41.2334 172.0222 211 S 5.3493 8.4417 113.7128 57.3945 64.7409 174.2745 212 V 4.6043 8.4127 124.4596 60.5581 34.4443 172.4815 213 N 4.4866 8.8717 119.7074 54.4104 38.8258 174.0654 214 C 4.6205 8.4358 116.7930 58.1900 32.2122 173.0928 215 N 5.1582 8.4775 114.0162 53.2661 38.7979 175.1112 216 T 4.0605 7.9641 115.1801 63.7062 69.2198 173.8007 217 S 4.1600 7.8920 119.3947 55.9173 66.3997 172.9167 218 W 4.9647 8.5744 121.1560 54.8292 32.0346 174.2962 219 K 4.8376 9.1172 127.6892 55.4758 33.4620 175.4793 220 I 4.4997 8.6949 129.0632 60.6589 38.3836 174.9809 221 V 4.6218 8.7038 128.7478 60.7879 33.1919 174.7259 222 L 4.4399 8.7685 130.9016 55.4625 42.1536 175.7133 223 F 4.3802 9.2760 127.7398 59.2098 41.9563 175.4235 224 L 4.6181 7.7128 119.3235 53.6274 45.6801 175.1374 225 E 4.5505 8.9962 125.8215 56.2206 30.3191 177.3038 226 H 4.4751 9.5384 118.1753 58.3527 28.3141 176.6226 227 H 4.2314 7.2943 113.3682 57.3499 28.5269 174.7661 228 H 4.5156 7.6307 122.0545 56.1085 28.5771 174.8775 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 7 S 8.19 4.35 0.00 3.65 3.84 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 8 F 8.39 5.13 0.00 2.93 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 L 9.47 4.67 0.00 1.80 1.51 0.99 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 10 H 9.37 5.48 0.00 3.22 3.20 0.00 5.67 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.43 4.04 2.06 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 1.24 0.98 0.97 0.00 0.00 12 G 9.43 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 13 D 8.19 4.76 0.00 2.85 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 14 I 8.80 5.04 1.99 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 1.27 0.86 1.02 0.00 0.00 15 C 9.50 5.76 0.00 2.93 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 16 S 9.25 5.58 0.00 3.99 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 17 L 8.75 5.31 0.00 1.48 1.65 0.10 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 9.17 4.54 0.00 2.64 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 19 A 8.47 3.64 0.20 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 20 E 8.03 4.51 0.00 1.59 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.04 0.00 21 G 8.52 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.78 4.35 0.00 3.96 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 23 T 7.10 4.52 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 1.13 0.00 0.00 24 N 9.55 4.69 0.00 2.62 2.40 0.00 0.00 6.97 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 25 G 6.15 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 26 F 8.20 5.22 0.00 3.18 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 27 I 8.72 4.50 1.90 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.35 0.96 0.00 0.00 28 S 9.37 4.98 0.00 4.01 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 29 T 8.65 5.03 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 0.89 0.00 0.00 30 L 8.19 4.66 0.00 1.71 1.64 0.98 0.95 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 31 G 8.15 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 32 L 8.23 4.17 0.00 1.63 1.71 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.56 4.04 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 0.77 0.00 0.00 0.91 0.00 0.00 34 D 7.96 4.38 0.00 2.66 2.70 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 35 D 8.65 4.74 0.00 3.12 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 36 R 7.90 4.52 0.00 1.84 1.90 0.00 3.12 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 37 C 8.60 5.04 0.00 2.86 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 38 V 8.64 5.16 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 0.71 0.00 0.00 0.96 0.00 0.00 39 V 8.64 4.91 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.10 0.00 0.00 40 Q 8.99 5.01 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.64 0.00 0.00 0.00 0.00 0.00 2.56 2.20 0.00 41 P 0.00 4.99 0.00 2.21 2.38 0.00 4.03 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.95 0.00 42 E 8.14 3.80 0.00 2.02 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 2.33 2.32 0.00 43 A 8.16 4.13 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 6.26 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.33 5.04 0.00 2.85 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 8.04 3.94 0.00 1.39 1.59 0.76 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.09 4.60 0.00 2.70 2.86 0.00 0.00 6.66 8.00 0.00 0.00 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 N 8.78 5.02 0.00 2.76 2.72 0.00 0.00 6.58 8.02 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 49 P 0.00 4.89 0.00 1.69 1.77 0.00 3.43 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.73 0.00 50 P 0.00 5.24 0.00 2.30 2.32 0.00 3.46 0.00 0.00 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.07 0.00 51 K 8.76 4.05 0.00 1.76 1.90 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.44 7.81 52 K 7.71 4.34 0.00 1.95 1.96 0.00 1.53 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.42 7.81 53 F 7.83 3.90 0.00 2.88 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 54 R 7.99 3.65 0.00 1.82 1.84 0.00 3.18 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 55 D 7.62 4.48 0.00 2.58 2.70 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 56 C 7.49 4.81 0.00 1.69 2.46 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 57 L 7.00 4.56 0.00 1.37 1.40 0.71 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 58 F 9.58 5.14 0.00 2.94 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 59 K 9.08 5.05 0.00 1.81 1.68 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.61 7.81 60 L 8.80 4.71 0.00 1.70 1.64 0.95 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 61 C 9.15 5.27 0.00 3.05 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 P 0.00 4.71 0.00 2.09 2.00 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.10 0.00 63 M 8.28 4.26 0.00 1.74 1.63 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.95 0.00 64 N 8.90 4.65 0.00 2.41 2.01 0.00 0.00 7.22 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 65 R 8.75 4.34 0.00 1.64 1.81 0.00 3.17 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.52 0.00 66 Y 8.41 4.73 0.00 2.94 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 67 S 8.47 4.07 0.00 3.87 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 68 A 8.86 3.95 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 69 Q 8.27 3.46 0.00 1.60 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.19 2.32 0.00 70 K 7.88 3.78 0.00 1.77 1.86 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.51 7.81 71 Q 7.67 3.94 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 72 F 8.09 4.43 0.00 3.20 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 73 W 8.17 4.14 0.00 3.46 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 74 K 8.32 4.19 0.00 2.00 2.09 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.48 7.81 75 A 7.47 4.60 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *82 S 8.97 4.46 0.00 4.05 3.56 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 83 T 8.94 4.73 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 1.23 0.00 0.00 84 T 8.27 4.36 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 1.22 0.00 0.00 85 D 7.84 4.42 0.00 2.70 2.59 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 86 A 8.61 4.08 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 V 7.88 3.54 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 1.03 0.00 0.00 0.94 0.00 0.00 88 L 8.67 3.93 0.00 1.79 1.83 0.95 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 89 L 7.94 4.07 0.00 1.96 1.90 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 90 N 8.30 4.51 0.00 2.96 2.84 0.00 0.00 6.94 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 91 K 7.84 4.04 0.00 1.96 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.76 7.81 92 L 8.30 4.05 0.00 2.05 1.89 1.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.17 2.76 0.00 3.17 3.24 0.00 5.59 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 H 8.16 4.15 0.00 3.33 3.44 0.00 5.84 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.04 3.86 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.95 3.85 1.11 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 97 D 7.79 4.23 0.00 2.80 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 98 L 7.93 3.94 0.00 1.73 1.63 0.81 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.04 3.85 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 100 K 8.16 3.96 0.00 1.94 1.85 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.63 7.81 101 K 8.17 3.96 0.00 1.93 1.94 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.47 7.81 102 Q 8.13 3.93 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 103 N 8.21 4.27 0.00 2.91 2.91 0.00 0.00 6.61 6.98 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 0.00 104 E 8.12 3.91 0.00 2.06 2.15 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 2.32 2.38 0.00 105 T 8.01 3.84 4.35 0.00 0.00 0.00 0.00 0.00 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 0.00 106 E 8.50 3.98 0.00 2.00 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 0.00 2.45 2.46 0.00 107 N 8.59 4.41 0.00 2.72 2.92 0.00 0.00 7.01 7.53 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 0.00 108 R 7.90 4.06 0.00 2.01 2.10 0.00 3.10 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 109 K 7.73 4.07 0.00 1.88 1.85 0.00 1.74 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.58 7.81 110 L 7.70 4.30 0.00 1.85 1.69 0.90 0.40 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 0.00 111 L 7.00 4.18 0.00 1.79 1.65 0.95 0.94 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 0.00 112 G 8.91 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 T 7.69 4.32 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 1.20 0.00 0.00 114 V 8.26 4.11 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 0.64 0.00 0.00 0.88 0.00 0.00 115 I 8.66 4.18 1.80 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 1.22 0.47 0.85 0.00 0.00 116 Q 8.76 4.98 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.99 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 117 Y 8.74 4.47 0.00 3.29 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 0.00 118 G 9.21 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 0.00 119 N 8.25 4.66 0.00 2.84 2.77 0.00 0.00 6.38 7.26 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 0.00 120 V 8.23 4.87 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 0.45 0.00 0.00 0.66 0.00 0.00 121 I 9.10 5.00 2.04 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.91 0.94 0.00 0.00 122 Q 9.25 5.37 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.77 0.00 0.00 0.00 0.00 0.00 2.71 2.59 0.00 123 L 8.79 5.15 0.00 1.54 1.56 0.31 0.36 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 0.00 124 L 8.94 4.73 0.00 1.75 1.57 0.17 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 125 H 9.20 3.83 0.00 2.99 3.16 0.00 5.84 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 7.91 3.80 0.00 1.44 1.56 0.86 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 127 K 7.56 3.89 0.00 1.47 1.59 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.34 7.81 128 S 7.73 4.33 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 0.00 129 N 7.83 4.06 0.00 2.80 2.83 0.00 0.00 6.92 5.98 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 0.00 130 K 7.40 4.65 0.00 1.66 1.72 0.00 1.68 0.00 0.00 1.80 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.53 7.81 131 Y 8.88 5.15 0.00 3.02 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 0.00 132 L 8.96 4.49 0.00 1.92 1.67 0.93 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 133 T 9.30 5.02 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 1.13 0.00 0.00 134 V 8.74 4.48 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.04 0.00 0.00 135 N 9.07 4.97 0.00 2.59 2.69 0.00 0.00 6.54 7.04 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 0.00 136 K 8.96 4.00 0.00 1.79 2.00 0.00 1.12 0.00 0.00 1.34 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.36 7.81 137 R 7.84 4.47 0.00 1.90 2.02 0.00 2.94 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 138 L 7.91 4.92 0.00 1.56 1.53 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 139 P 0.00 4.88 0.00 2.06 2.04 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 140 A 8.57 4.16 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 8.72 4.06 0.00 1.80 1.74 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 142 L 8.32 4.34 0.00 1.75 1.71 1.03 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 143 E 8.52 3.85 0.00 1.73 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 2.14 0.00 144 K 8.58 3.79 0.00 1.89 1.95 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.52 7.81 145 N 8.06 4.59 0.00 2.72 2.89 0.00 0.00 6.77 7.35 0.00 0.00 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 A 7.72 4.81 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 0.00 147 M 8.98 4.87 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 148 R 9.03 4.36 0.00 2.02 1.77 0.00 3.02 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 149 V 8.38 5.02 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 0.92 0.00 0.00 0.98 0.00 0.00 150 T 9.11 4.99 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 1.19 0.00 0.00 151 L 8.33 5.08 0.00 1.56 1.63 0.82 0.99 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 0.00 152 D 9.10 4.64 0.00 2.63 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 E 9.39 3.84 0.00 1.96 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 2.35 2.33 0.00 154 A 8.09 4.25 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 G 10.22 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 0.00 156 N 7.50 3.14 0.00 2.55 2.67 0.00 0.00 7.44 7.09 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 0.00 157 E 7.87 2.54 0.00 1.51 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 158 G 8.26 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 0.00 159 S 7.40 4.66 0.00 3.77 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 0.00 160 W 7.47 4.91 0.00 3.23 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 0.00 161 F 9.24 5.31 0.00 3.00 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 0.00 162 Y 9.33 4.90 0.00 3.09 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 0.00 163 I 8.80 4.82 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.78 1.00 0.00 0.00 164 Q 9.21 5.38 0.00 2.14 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 165 P 0.00 4.32 0.00 1.98 0.69 0.00 3.71 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.58 0.00 166 F 8.81 4.22 0.00 2.94 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 0.00 167 Y 7.72 4.94 0.00 3.05 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 0.00 168 K 8.51 4.41 0.00 1.74 1.82 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.45 7.81 169 L 8.09 4.17 0.00 1.72 1.80 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 170 R 7.67 4.85 0.00 1.79 1.89 0.00 3.62 0.00 0.00 3.44 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.72 0.00 171 S 9.20 4.70 0.00 3.78 3.71 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 0.00 172 I 8.13 4.00 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.71 0.98 0.00 0.00 173 G 9.07 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 0.00 174 D 8.23 4.73 0.00 2.98 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 0.00 175 S 8.49 4.60 0.00 3.51 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 V 8.53 3.59 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 0.75 0.00 0.00 0.09 0.00 0.00 177 V 8.78 4.76 2.54 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 0.93 0.00 0.00 1.09 0.00 0.00 178 I 8.28 4.01 1.87 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 1.42 0.95 0.96 0.00 0.00 179 G 9.05 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 0.00 180 D 8.12 4.72 0.00 3.01 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 0.00 181 K 8.74 5.03 0.00 1.68 1.43 0.00 1.85 0.00 0.00 1.65 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.53 7.81 182 V 9.17 5.23 2.44 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 0.96 0.00 0.00 1.07 0.00 0.00 183 V 9.31 4.80 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 1.24 0.00 0.00 1.19 0.00 0.00 184 L 8.80 4.97 0.00 1.27 1.06 0.10 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 185 N 9.11 5.30 0.00 3.10 3.01 0.00 0.00 6.95 7.00 0.00 0.00 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 P 0.00 4.27 0.00 2.20 1.73 0.00 3.96 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.16 0.00 187 V 8.27 3.59 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.16 0.00 0.00 188 N 8.08 5.02 0.00 2.81 2.91 0.00 0.00 5.97 7.26 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 0.00 189 A 8.20 4.07 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 0.00 190 G 7.17 4.39 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 0.00 191 Q 7.48 4.49 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 192 P 0.00 4.77 0.00 2.21 2.17 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 193 L 8.75 4.58 0.00 1.62 1.56 0.84 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 194 H 9.85 5.14 0.00 3.23 3.34 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 A 8.34 4.59 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 0.00 196 S 8.35 4.27 0.00 4.11 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 0.00 197 S 8.39 4.68 0.00 3.71 3.84 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 0.00 198 H 8.31 4.42 0.00 3.21 3.28 0.00 5.61 0.00 0.00 0.00 0.00 6.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 Q 8.34 4.63 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 200 L 8.72 4.20 0.00 1.74 1.73 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 201 V 8.54 3.58 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.94 0.00 0.00 202 D 8.19 4.43 0.00 2.82 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 0.00 203 N 7.21 5.04 0.00 2.87 2.79 0.00 0.00 7.01 7.90 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 0.00 204 P 0.00 4.14 0.00 2.18 1.46 0.00 3.75 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.03 0.00 205 G 9.57 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 C 8.07 5.18 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 0.00 207 N 8.91 5.47 0.00 2.70 2.83 0.00 0.00 6.44 8.51 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 0.00 208 E 9.04 4.34 0.00 2.07 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 2.33 2.28 0.00 209 V 8.20 4.91 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.06 0.00 0.00 210 N 8.87 5.03 0.00 3.02 2.92 0.00 0.00 5.99 7.74 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 0.00 211 S 8.44 5.35 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 0.00 212 V 8.41 4.60 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.92 0.00 0.00 213 N 8.87 4.49 0.00 2.64 2.85 0.00 0.00 6.76 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 0.00 214 C 8.44 4.62 0.00 3.04 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 0.00 215 N 8.48 5.16 0.00 2.76 2.98 0.00 0.00 6.88 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 0.00 216 T 7.96 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 0.21 0.00 0.00 217 S 7.89 4.16 0.00 2.72 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 0.00 218 W 8.57 4.96 0.00 3.32 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 0.00 219 K 9.12 4.84 0.00 1.88 1.83 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.67 7.81 220 I 8.69 4.50 1.97 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.49 1.00 0.00 0.00 221 V 8.70 4.62 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 1.24 0.00 0.00 222 L 8.77 4.44 0.00 1.78 1.61 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 223 F 9.28 4.38 0.00 3.24 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 0.00 224 L 7.71 4.62 0.00 1.91 1.55 0.85 1.05 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 0.00 225 E 9.00 4.55 0.00 1.83 1.66 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 2.44 2.32 0.00 226 H 9.54 4.48 0.00 3.27 3.60 0.00 5.56 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 H 7.29 4.23 0.00 3.17 3.32 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 H 7.63 4.52 0.00 3.30 3.21 0.00 5.69 0.00 0.00 0.00 0.00 6.91 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.