NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.6563 8.3449 118.3022 59.8763 29.4798 174.1545 2 C 3.9409 8.3876 121.0449 57.2730 41.5625 173.5287 3 T 3.8557 8.6801 118.9876 63.5235 69.2530 175.3684 *8 P 4.0902 0.0000 0.0000 62.9992 33.1513 175.8142 9 I 4.1092 8.1568 122.9391 61.4002 38.5916 175.2826 10 N 3.9784 8.6374 121.0868 53.8995 35.0225 172.0573 11 M 4.4120 6.9048 117.5617 53.5381 35.9331 173.5949 12 K 4.3278 7.9609 118.4214 56.8317 33.7054 176.4218 13 F 4.8439 9.0044 120.9168 55.8386 42.4884 174.2423 *22 N 4.7249 8.4808 116.7827 52.6315 40.1005 175.2125 *25 Y 4.4994 8.2295 117.8094 57.7500 39.1492 177.7960 26 N 5.2579 8.7756 123.7920 52.3115 40.4692 173.7117 27 I 3.1771 8.8831 116.4575 60.1893 34.4254 172.6071 28 G 2.9944 6.8620 110.5003 44.3891 0.0000 170.1412 29 D 4.5665 7.6170 121.3265 53.9998 45.1996 175.4391 30 T 4.9039 8.5567 120.4827 61.9662 71.7553 173.4844 31 I 4.3528 8.8165 128.3731 59.3638 39.7128 174.9840 32 E 4.4075 8.3944 125.8488 55.0383 31.0877 174.9343 33 Y 5.0862 8.6352 119.6438 56.2953 41.2499 175.0386 34 L 4.8734 9.1410 121.9525 53.3200 44.9718 176.0905 35 C 4.9890 8.9057 121.2780 55.8320 41.7901 173.3201 36 L 4.3541 8.6548 120.2616 54.5397 41.3616 176.1853 37 P 3.6850 0.0000 0.0000 63.7122 32.4415 177.1381 38 G 4.0939 7.6890 111.9811 43.8753 0.0000 170.9709 39 Y 4.7126 7.7586 118.6544 56.6907 42.4776 174.7742 40 R 4.6905 9.2262 121.7080 54.4454 33.9416 174.7232 41 K 4.7252 8.1804 118.8257 55.4983 34.3353 177.6626 42 Q 4.4196 8.0551 122.7586 55.5162 31.1315 174.9349 43 K 4.0364 8.4717 119.6215 58.8986 33.9447 177.4513 44 M 2.9373 8.5457 109.7971 57.4388 28.0149 172.9982 45 G 3.1035 8.1437 110.0643 43.5901 0.0000 169.4658 46 P 4.3905 0.0000 0.0000 64.2212 31.7890 176.9939 47 I 4.1194 7.2249 110.5572 58.4956 39.8228 173.5337 48 Y 4.7161 8.0744 117.8899 57.1951 39.6165 175.2008 49 A 4.3110 8.7684 122.4111 52.5020 19.2432 177.2178 50 K 5.3032 8.5588 120.5472 53.6170 36.4410 174.3656 51 C 5.0932 8.9199 122.7457 55.2304 45.4844 173.0739 52 T 4.7115 7.8195 122.7435 61.6075 72.1028 175.0190 53 G 3.5569 8.2389 112.8260 44.3676 0.0000 173.2284 *55 G 3.6088 7.7770 114.4094 44.9532 0.0000 169.1051 56 W 4.3743 8.4304 118.8626 56.7738 30.0661 177.3574 57 T 4.1038 8.6617 121.0827 61.5336 67.3656 173.6666 *59 F 4.8114 7.7892 123.3740 57.7532 40.5142 173.8350 60 N 4.6272 8.3042 115.5991 52.5727 39.6309 173.6771 61 Q 4.4693 7.7082 117.4925 55.1623 33.3361 173.3045 62 C 5.3318 8.6279 122.4943 55.1095 44.1691 173.0518 63 I 4.4757 8.6808 119.3713 60.2145 40.7443 173.1002 64 K 4.7117 8.3321 123.8028 55.9240 34.4506 177.2750 65 R 4.4062 8.2142 123.4684 55.3787 33.8937 174.4120 66 R 4.6447 8.3053 120.3299 54.3515 33.4450 175.6334 67 C 4.5722 8.6870 121.2363 55.2237 44.5411 171.6618 68 P 4.7841 0.0000 0.0000 61.9264 32.4759 175.7960 69 S 4.3857 8.6864 114.3973 57.5131 63.3235 172.3143 70 P 4.0920 0.0000 0.0000 62.1744 31.6201 176.4343 71 R 3.9852 8.0862 118.9364 56.9214 29.7283 176.0067 72 D 4.9444 8.1298 118.4644 53.4442 41.8101 176.4077 73 I 3.7526 7.7485 118.1268 61.3474 39.1511 176.0682 74 D 4.5075 8.3296 126.6417 53.9282 38.4484 175.8172 *76 G 3.8557 7.6458 104.9717 46.1460 0.0000 171.0393 77 Q 4.6558 8.8320 124.5167 53.7471 32.6304 174.5031 78 L 4.7806 8.0280 123.6053 53.1268 42.0398 176.4063 79 D 5.0257 8.0052 119.2964 53.1564 41.9058 174.0518 80 I 4.6911 7.0076 129.1805 60.4332 40.0947 174.4795 81 G 4.2197 8.7039 120.4628 46.4660 0.0000 175.2966 82 G 4.2494 9.1743 109.6649 43.3130 0.0000 172.5574 83 V 4.5934 8.0127 120.9746 59.5756 34.8982 174.0967 84 D 4.3572 8.2414 120.6299 55.5316 40.4344 177.8960 85 F 4.7622 8.3959 121.3402 59.1445 42.4558 174.6235 86 G 3.9762 7.5618 108.9687 43.1847 0.0000 172.1549 87 S 4.6133 7.6128 117.2300 57.4939 64.8614 176.8575 88 S 4.5799 8.7245 117.9946 56.5564 64.5386 173.0652 89 I 4.2787 8.5777 119.3966 59.7630 39.5254 174.7918 90 T 4.7442 8.3233 123.0122 62.5582 70.4968 173.0311 91 Y 4.7943 8.6372 123.4756 56.5613 39.7592 174.9236 92 S 4.8072 8.8812 119.5483 56.8863 65.2399 172.6557 93 C 5.2534 8.7279 120.3182 55.0528 43.8929 172.8862 94 N 4.8621 8.2915 117.6876 51.2351 39.8450 174.7712 95 S 4.1124 8.4460 116.6924 59.7806 63.6284 175.5574 96 G 4.5782 9.1288 120.8512 45.8603 0.0000 172.2234 97 Y 4.1236 8.7545 114.7587 58.9030 39.4656 175.6367 98 H 5.0537 8.9355 120.3260 53.7904 31.9509 173.6964 99 L 4.3003 8.5563 122.3838 54.9189 42.3184 176.9512 100 I 4.1169 9.8702 125.9069 62.5008 37.2965 175.5593 101 G 4.1779 8.4618 113.6084 42.5978 0.0000 170.5608 102 E 3.9817 8.1673 121.0673 56.3605 29.9563 176.8628 103 S 4.5354 8.9205 119.9411 56.1276 61.3848 171.9294 104 K 4.9547 7.2614 132.9431 55.8346 34.5311 174.2760 105 S 5.0063 8.4962 120.4275 57.0135 65.8399 172.8819 106 Y 5.2729 8.6681 119.9945 56.2279 42.4122 174.7875 107 C 4.7491 8.7508 121.5749 55.6734 44.6435 173.0434 108 E 4.1924 8.5440 125.9711 57.0386 29.6603 176.4658 109 L 4.5845 8.5271 125.5514 55.0799 41.2017 176.7366 110 G 3.8589 9.0055 109.5007 46.8643 0.0000 174.0332 *112 T 4.4045 7.7947 114.7887 63.2631 71.2228 175.9357 113 G 3.0071 6.9342 101.6563 46.8012 0.0000 174.6172 114 S 4.9142 7.4403 116.6299 58.6041 66.7826 176.8268 115 M 4.5381 7.8078 121.2345 55.1004 34.9952 174.1292 116 V 4.0727 8.4089 116.1795 62.2785 33.4305 177.0074 117 W 4.5224 8.8042 124.8610 58.1935 29.9457 176.0647 118 N 4.2080 9.7312 123.5491 54.8136 36.6677 174.8138 119 P 4.3948 0.0000 0.0000 62.9450 32.4518 176.2793 120 E 4.4985 8.5562 120.4519 56.5113 33.5020 175.9501 121 A 4.1150 8.1340 121.2117 54.1144 18.7191 175.8197 122 P 4.5868 0.0000 0.0000 62.5030 32.6872 176.0499 123 I 4.3700 8.1684 122.3552 59.5208 41.2708 174.9491 124 C 4.9693 8.4045 123.6487 56.3207 42.1033 171.9110 125 E 4.7552 9.1883 126.3937 55.6752 33.6366 174.7561 *127 V 4.0985 8.3379 122.4561 62.6671 31.0974 174.2030 128 K 4.2974 7.5830 124.2247 55.3583 36.0329 175.2676 129 C 4.8154 8.3917 118.5386 55.4484 42.6990 173.6675 130 Q 5.1388 8.3731 121.5410 53.9874 31.8375 174.5855 131 S 4.1676 9.0562 114.8272 57.5328 62.6840 171.9959 132 P 3.7254 0.0000 0.0000 62.0830 31.4241 174.1962 133 P 4.3723 0.0000 0.0000 62.2011 31.9075 176.3129 134 S 4.2519 8.5516 117.4624 58.2715 63.4556 174.3951 135 I 4.0438 8.0624 118.3644 59.4706 38.6319 174.7612 136 S 3.9289 7.9185 114.7352 61.7486 63.1965 174.9204 137 N 4.8828 7.3310 118.7926 50.4402 38.8351 173.6615 138 G 4.1806 7.4347 105.0874 45.1949 0.0000 170.3068 139 R 4.9829 8.6962 119.7330 54.2425 34.1777 174.3949 140 H 4.9434 8.3873 115.3743 53.8422 30.5345 172.9109 141 N 4.9788 8.1243 120.7095 51.3291 41.1944 174.1531 142 G 4.6351 8.2558 109.8559 44.9701 0.0000 172.7051 143 Y 4.1781 8.7227 117.5313 60.4781 38.3581 176.5981 144 E 4.8955 8.1635 117.3064 55.3865 33.5236 174.6237 145 D 4.4446 7.9659 118.9906 54.1483 39.5504 180.0764 146 F 4.1080 8.3339 127.0277 59.0655 39.3996 174.9985 147 Y 4.7978 8.5167 124.4762 57.4230 38.1915 176.7916 148 T 3.7833 7.8076 118.9101 62.0474 69.9325 171.3059 149 D 4.7236 7.9642 116.7734 53.3621 40.9225 178.1966 150 G 4.1397 8.7862 109.0530 46.2006 0.0000 171.8308 151 S 4.6616 8.3329 118.5427 57.2148 66.9535 172.7796 152 V 4.4395 8.2115 120.4098 61.5098 32.6038 174.8452 153 V 4.2067 8.7327 127.8217 61.3834 33.4145 174.2797 154 T 5.0035 8.2231 122.9974 62.0109 71.5703 172.6043 155 Y 4.9212 8.7349 121.7778 56.3473 41.6520 174.8067 156 S 4.9910 9.2387 117.0485 57.1322 67.0226 172.2084 157 C 5.2731 8.5269 117.3336 55.1983 44.2683 173.4662 158 N 4.7441 8.4790 117.2223 52.2799 39.0843 174.5947 159 S 4.1500 8.6420 119.4146 61.1559 62.5350 173.7427 160 G 3.7060 7.9330 119.0972 45.0657 0.0000 171.0681 161 Y 4.8938 7.5393 114.4927 56.7126 42.6123 175.6021 162 S 4.8655 9.4001 117.0279 56.9071 68.2355 172.9684 163 L 4.7491 7.9671 121.3487 53.4427 43.6503 175.4967 164 I 4.2136 7.5638 123.9488 59.9440 39.5556 175.5116 165 G 3.9844 7.8552 114.7399 45.5345 0.0000 170.6394 166 N 4.3576 8.9067 119.9875 54.3410 38.5262 176.6952 167 S 4.5956 7.7872 113.3053 55.1523 63.7297 174.2671 168 G 4.2910 7.6547 105.5006 44.6061 0.0000 172.6221 169 V 4.3841 8.3891 122.3666 61.0968 33.5590 174.2791 170 L 5.2599 8.6457 129.1776 53.4632 45.0682 175.1728 171 C 5.6924 8.4086 124.2319 53.1504 46.6617 174.1702 172 S 5.0839 7.9408 119.8531 55.8160 61.9864 172.3196 173 G 3.2323 9.0005 107.0340 45.5367 0.0000 173.6629 174 G 4.0448 8.2854 108.4727 43.9827 0.0000 174.4033 175 E 4.4751 6.9597 113.1775 55.2507 33.8511 175.4232 176 W 5.2933 8.8338 123.7717 55.1101 30.7137 176.7937 177 S 4.6536 9.8594 120.1921 53.9993 61.7123 172.4180 178 D 5.6109 7.8549 134.0536 54.6594 43.4512 173.0691 179 P 4.3119 0.0000 0.0000 61.1850 31.9841 174.4364 180 P 4.7132 0.0000 0.0000 62.1217 32.3877 175.5282 181 T 4.4723 8.1844 114.2649 59.8562 71.9241 172.3364 182 C 4.9680 8.6724 122.4011 55.8874 39.4990 172.7841 183 Q 4.8591 9.2790 122.9499 54.1301 32.9407 175.3612 184 I 4.5275 8.1622 121.9691 60.1969 37.3174 175.5464 185 V 4.2954 7.8444 124.3405 60.2753 33.9521 173.3424 186 K 4.7782 8.4619 123.5136 54.5681 34.9524 176.3657 187 C 4.6195 9.0474 123.1604 56.1147 41.2496 171.8455 188 P 5.1777 0.0000 0.0000 61.5884 33.0740 175.4385 189 H 4.2951 8.9615 117.3623 55.6425 28.9422 173.8532 190 P 3.6974 0.0000 0.0000 62.8289 31.5212 175.7831 191 T 4.2992 7.9686 112.5009 60.2684 69.2890 173.8767 192 I 4.3548 7.7486 125.4602 59.4710 40.8879 174.2887 193 S 4.2900 8.2593 123.4470 60.1779 63.3404 174.9802 194 N 4.7801 7.6981 123.8815 50.6915 38.8987 173.3300 195 G 4.4786 7.3806 111.7148 45.8891 0.0000 169.0622 196 Y 5.2573 7.8790 120.8952 54.7870 41.6028 173.9166 197 L 5.0728 8.8688 122.6290 54.0273 42.2394 176.4147 198 S 4.5322 8.3996 117.6119 55.9587 63.3639 171.7561 199 S 4.3243 9.0037 112.6665 57.8955 63.6710 175.1231 200 G 3.8933 8.7016 118.4090 46.2378 0.0000 171.3633 201 F 4.6376 8.1285 119.4176 57.5903 39.3551 174.6681 202 K 4.4343 7.8903 127.0403 54.3997 34.2797 177.3391 203 R 3.6482 8.1095 120.2142 58.7009 30.3411 176.6062 204 S 4.4928 7.4584 110.8571 56.6187 64.1848 172.5232 205 Y 4.5453 8.2918 124.5659 58.4265 40.0463 175.5063 206 S 4.3814 8.8924 115.0214 59.0984 65.1209 175.3072 207 Y 4.5081 9.1353 120.3450 56.5076 40.5180 174.9340 208 N 4.3170 8.0630 118.4226 52.8032 37.8370 175.4261 209 D 4.8988 8.1877 119.2096 54.0105 43.5976 177.2906 210 N 5.1261 8.7658 134.6988 54.6409 40.5392 174.3338 211 V 3.7947 7.7251 110.2984 63.1658 31.9968 175.2238 212 D 4.7022 8.5541 124.1034 52.9576 43.1603 175.1635 213 F 5.0299 8.5241 120.1960 55.7729 41.3152 174.8411 214 K 4.4602 8.9579 124.6032 55.0174 33.9804 174.8880 215 C 4.8326 8.5626 124.1160 55.7185 41.9288 173.3721 216 K 4.1447 8.7646 120.8191 56.9585 31.8653 177.2699 *218 G 3.7103 7.6925 105.9659 46.0532 0.0000 171.6362 219 Y 5.0738 7.9217 121.6421 56.1150 42.4255 174.6553 220 K 4.8217 9.0872 121.3487 54.9972 36.3603 175.2528 221 L 4.4054 8.4724 121.1911 54.4938 42.5974 177.3874 222 S 4.6874 9.2059 118.0438 54.1941 62.1380 173.6774 223 G 4.1760 7.8445 113.5591 44.7120 0.0000 170.1200 224 S 4.1720 8.3679 114.7141 58.8911 62.7364 174.6453 225 S 4.9200 8.2770 123.0282 56.1276 62.4317 172.7301 226 S 5.0975 7.5595 118.8870 57.9799 64.6477 177.0824 227 S 4.8385 9.0906 119.4102 57.4238 65.6763 173.6277 228 T 4.5824 8.3957 121.1333 61.9076 71.6255 172.7520 229 C 4.3779 8.2016 122.8459 55.4208 45.1382 172.6710 230 S 4.9317 7.8862 119.6569 55.7434 66.6611 172.1502 231 P 4.3759 0.0000 0.0000 63.6157 33.4948 173.9801 232 G 4.0782 9.9286 110.1887 44.4801 0.0000 175.3558 233 N 4.8050 8.8469 111.4795 52.3611 41.1511 172.0627 234 T 4.9415 7.2520 110.4457 60.2134 72.8778 174.1318 235 W 4.9006 8.9771 122.0662 54.9975 32.3903 174.8432 236 K 5.0608 9.0752 122.6939 54.0587 35.5334 174.3630 237 P 4.6269 0.0000 0.0000 61.8409 32.3250 175.4150 238 E 3.9021 8.6118 119.6224 55.6317 30.0385 176.2794 239 L 3.7620 8.6570 125.1314 54.6359 41.6743 175.3744 240 P 4.5689 0.0000 0.0000 62.1499 32.9299 175.3006 241 K 4.3853 8.3267 121.1506 54.6831 35.4292 174.9688 242 C 5.0619 7.7498 128.5205 54.9968 42.7734 174.0230 243 V 3.7803 8.4832 119.3287 61.5112 32.0201 175.4952 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 1 C 8.34 4.66 0.00 2.79 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 2 C 8.39 3.94 0.00 2.73 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.68 3.86 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 1.13 0.00 0.00 *8 P 0.00 4.09 0.00 1.90 1.92 0.00 3.59 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.06 0.00 9 I 8.16 4.11 1.86 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 1.41 0.49 0.92 0.00 0.00 10 N 8.64 3.98 0.00 2.87 2.86 0.00 0.00 6.70 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 11 M 6.90 4.41 0.00 1.52 1.66 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 12 K 7.96 4.33 0.00 1.80 1.69 0.00 1.39 0.00 0.00 1.47 0.00 0.00 2.25 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 0.58 7.81 13 F 9.00 4.84 0.00 2.95 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 *22 N 8.48 4.72 0.00 2.72 2.99 0.00 0.00 6.93 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *25 Y 8.23 4.50 0.00 3.03 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 0.00 0.00 0.00 26 N 8.78 5.26 0.00 2.78 2.84 0.00 0.00 6.10 7.81 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 27 I 8.88 3.18 1.88 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 1.35 0.44 0.92 0.00 0.00 28 G 6.86 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 0.00 0.00 0.00 29 D 7.62 4.57 0.00 2.62 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.56 4.90 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 1.27 0.00 0.00 31 I 8.82 4.35 1.40 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.80 0.68 0.00 0.00 32 E 8.39 4.41 0.00 1.46 1.12 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 1.47 1.89 0.00 33 Y 8.64 5.09 0.00 2.89 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 34 L 9.14 4.87 0.00 1.58 1.60 0.93 1.00 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 35 C 8.91 4.99 0.00 2.92 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 36 L 8.65 4.35 0.00 1.65 1.76 0.94 1.11 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 37 P 0.00 3.68 0.00 2.13 1.97 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.18 0.00 38 G 7.69 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 39 Y 7.76 4.71 0.00 3.05 2.75 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 40 R 9.23 4.69 0.00 1.65 1.70 0.00 3.23 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.87 0.00 41 K 8.18 4.73 0.00 1.64 1.58 0.00 1.58 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.40 1.42 7.81 42 Q 8.06 4.42 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.57 0.00 43 K 8.47 4.04 0.00 1.68 1.74 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.38 7.81 44 M 8.55 2.94 0.00 1.93 2.13 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 45 G 8.14 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.39 0.00 2.18 2.19 0.00 3.39 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.92 0.00 47 I 7.22 4.12 1.91 0.00 0.00 0.92 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.66 4.10 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 1.17 0.00 0.00 *59 F 7.79 4.81 0.00 3.23 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 60 N 8.30 4.63 0.00 2.21 2.56 0.00 0.00 5.77 7.39 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 61 Q 7.71 4.47 0.00 1.88 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 62 C 8.63 5.33 0.00 2.73 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 63 I 8.68 4.48 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.84 0.91 0.00 0.00 64 K 8.33 4.71 0.00 1.36 1.50 0.00 1.55 0.00 0.00 1.51 0.00 0.00 2.60 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.17 1.25 7.81 65 R 8.21 4.41 0.00 1.70 1.66 0.00 3.16 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.54 0.00 66 R 8.31 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0.00 0.00 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 G 7.65 3.86 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 0.00 0.00 0.00 77 Q 8.83 4.66 0.00 1.88 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 78 L 8.03 4.78 0.00 1.33 1.16 0.28 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.01 5.03 0.00 2.52 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 80 I 7.01 4.69 1.86 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 1.30 1.04 0.91 0.00 0.00 81 G 8.70 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 0.00 0.00 0.00 0.00 82 G 9.17 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 0.00 0.00 0.00 0.00 83 V 8.01 4.59 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 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0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 109 L 8.53 4.58 0.00 1.62 1.37 0.83 0.05 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 0.00 110 G 9.01 3.86 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 0.00 0.00 0.00 *112 T 7.79 4.40 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 1.27 0.00 0.00 113 G 6.93 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 0.00 0.00 0.00 114 S 7.44 4.91 0.00 3.98 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 M 7.81 4.54 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 116 V 8.41 4.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.96 0.00 0.00 117 W 8.80 4.52 0.00 3.20 3.19 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 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0.00 0.00 0.00 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 0.91 0.00 0.00 128 K 7.58 4.30 0.00 0.79 0.76 0.00 1.15 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.94 1.21 7.81 129 C 8.39 4.82 0.00 2.99 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 0.00 130 Q 8.37 5.14 0.00 2.10 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.95 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 131 S 9.06 4.17 0.00 3.49 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 0.00 132 P 0.00 3.73 0.00 1.51 1.41 0.00 3.62 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.13 0.00 133 P 0.00 4.37 0.00 2.16 2.12 0.00 2.95 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.09 0.00 134 S 8.55 4.25 0.00 4.02 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 I 8.06 4.04 1.69 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.52 0.53 0.00 0.00 136 S 7.92 3.93 0.00 3.79 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 0.00 137 N 7.33 4.88 0.00 2.30 2.12 0.00 0.00 6.62 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 G 7.43 4.18 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 0.00 139 R 8.70 4.98 0.00 1.77 1.74 0.00 3.07 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.53 0.00 140 H 8.39 4.94 0.00 2.62 2.69 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 N 8.12 4.98 0.00 2.68 2.61 0.00 0.00 6.80 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 0.00 142 G 8.26 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 Y 8.72 4.18 0.00 3.06 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 0.00 144 E 8.16 4.90 0.00 2.12 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 0.00 2.41 2.40 0.00 145 D 7.97 4.44 0.00 2.41 1.54 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 0.00 146 F 8.33 4.11 0.00 3.10 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Y 8.52 4.80 0.00 3.09 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 0.00 148 T 7.81 3.78 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 1.36 0.00 0.00 149 D 7.96 4.72 0.00 2.68 1.92 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 0.00 150 G 8.79 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 0.00 151 S 8.33 4.66 0.00 3.86 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 0.00 152 V 8.21 4.44 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 0.78 0.00 0.00 0.93 0.00 0.00 153 V 8.73 4.21 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 0.92 0.00 0.00 1.28 0.00 0.00 154 T 8.22 5.00 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 1.16 0.00 0.00 155 Y 8.73 4.92 0.00 2.75 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 0.00 156 S 9.24 4.99 0.00 3.68 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 0.00 157 C 8.53 5.27 0.00 2.86 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 0.00 158 N 8.48 4.74 0.00 2.83 2.81 0.00 0.00 6.89 7.57 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 0.00 159 S 8.64 4.15 0.00 3.88 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 0.00 160 G 7.93 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 0.00 0.00 0.00 161 Y 7.54 4.89 0.00 2.93 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 0.00 162 S 9.40 4.87 0.00 3.85 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 0.00 163 L 7.97 4.75 0.00 0.27 0.64 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 164 I 7.56 4.21 1.72 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.94 0.78 0.00 0.00 165 G 7.86 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 0.00 166 N 8.91 4.36 0.00 2.82 2.67 0.00 0.00 6.98 7.24 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 0.00 167 S 7.79 4.60 0.00 3.97 3.86 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 0.00 168 G 7.65 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 V 8.39 4.38 2.28 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 1.16 0.00 0.00 1.13 0.00 0.00 170 L 8.65 5.26 0.00 1.84 1.54 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 171 C 8.41 5.69 0.00 2.88 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 0.00 172 S 7.94 5.08 0.00 3.78 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 G 9.00 3.23 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 0.00 174 G 8.29 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 0.00 175 E 6.96 4.48 0.00 1.86 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 2.18 2.16 0.00 176 W 8.83 5.29 0.00 3.16 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 S 9.86 4.65 0.00 3.82 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 0.00 178 D 7.85 5.61 0.00 2.82 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 P 0.00 4.31 0.00 2.13 2.01 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 180 P 0.00 4.71 0.00 1.61 1.80 0.00 3.30 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 0.80 0.63 0.00 181 T 8.18 4.47 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 182 C 8.67 4.97 0.00 2.52 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 Q 9.28 4.86 0.00 1.85 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.79 0.00 0.00 0.00 0.00 0.00 2.22 2.39 0.00 184 I 8.16 4.53 1.75 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 -0.14 0.78 0.00 0.00 185 V 7.84 4.30 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 1.00 0.00 0.00 186 K 8.46 4.78 0.00 1.61 1.91 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.50 7.81 187 C 9.05 4.62 0.00 2.78 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 0.00 188 P 0.00 5.18 0.00 2.25 2.18 0.00 4.06 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.17 0.00 189 H 8.96 4.30 0.00 3.21 3.39 0.00 5.90 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 P 0.00 3.70 0.00 2.13 1.34 0.00 4.03 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.99 0.00 191 T 7.97 4.30 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 1.18 0.00 0.00 192 I 7.75 4.35 1.40 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.46 0.92 0.00 0.00 193 S 8.26 4.29 0.00 3.76 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 N 7.70 4.78 0.00 2.38 2.26 0.00 0.00 6.70 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 G 7.38 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 Y 7.88 5.26 0.00 2.99 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 0.00 197 L 8.87 5.07 0.00 1.75 1.69 1.36 0.98 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 0.00 198 S 8.40 4.53 0.00 3.96 3.86 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 0.00 199 S 9.00 4.32 0.00 3.83 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 0.00 200 G 8.70 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 0.00 201 F 8.13 4.64 0.00 3.06 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 0.00 202 K 7.89 4.43 0.00 0.97 1.35 0.00 2.02 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.51 7.81 203 R 8.11 3.65 0.00 1.65 1.86 0.00 3.16 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 204 S 7.46 4.49 0.00 3.73 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 0.00 205 Y 8.29 4.55 0.00 3.00 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 0.00 206 S 8.89 4.38 0.00 3.94 3.86 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 0.00 207 Y 9.14 4.51 0.00 2.95 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 0.00 208 N 8.06 4.32 0.00 2.70 2.66 0.00 0.00 6.87 7.94 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 0.00 209 D 8.19 4.90 0.00 2.16 2.34 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 0.00 210 N 8.77 5.13 0.00 2.75 2.77 0.00 0.00 6.90 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 V 7.73 3.79 1.89 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 0.84 0.00 0.00 0.86 0.00 0.00 212 D 8.55 4.70 0.00 2.61 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 0.00 213 F 8.52 5.03 0.00 2.86 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 K 8.96 4.46 0.00 1.65 1.19 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.12 1.31 7.81 215 C 8.56 4.83 0.00 2.91 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 0.00 216 K 8.76 4.14 0.00 1.93 2.10 0.00 1.99 0.00 0.00 1.88 0.00 0.00 3.09 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.49 1.64 7.81 *218 G 7.69 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 0.00 0.00 0.00 219 Y 7.92 5.07 0.00 2.85 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 0.00 220 K 9.09 4.82 0.00 1.72 1.89 0.00 1.35 0.00 0.00 1.67 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.54 7.81 221 L 8.47 4.41 0.00 1.56 1.62 0.90 0.83 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 0.00 222 S 9.21 4.69 0.00 3.67 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 0.00 223 G 7.84 4.18 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 0.00 224 S 8.37 4.17 0.00 3.87 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 0.00 225 S 8.28 4.92 0.00 3.81 3.85 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 0.00 226 S 7.56 5.10 0.00 3.89 3.85 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 0.00 227 S 9.09 4.84 0.00 3.86 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 0.00 228 T 8.40 4.58 4.33 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 1.21 0.00 0.00 229 C 8.20 4.38 0.00 2.30 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 0.00 230 S 7.89 4.93 0.00 3.82 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 P 0.00 4.38 0.00 2.13 1.97 0.00 3.67 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 232 G 9.93 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 0.00 233 N 8.85 4.80 0.00 2.64 2.72 0.00 0.00 6.66 7.70 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 0.00 234 T 7.25 4.94 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 235 W 8.98 4.90 0.00 3.24 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 0.00 236 K 9.08 5.06 0.00 1.66 1.68 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.40 7.81 237 P 0.00 4.63 0.00 2.23 2.09 0.00 3.90 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 238 E 8.61 3.90 0.00 1.97 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 2.32 2.42 0.00 239 L 8.66 3.76 0.00 1.54 1.55 0.18 0.85 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 0.00 240 P 0.00 4.57 0.00 1.98 2.02 0.00 3.63 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.22 0.00 241 K 8.33 4.39 0.00 1.69 1.54 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.68 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.22 1.23 7.81 242 C 7.75 5.06 0.00 2.91 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 0.00 243 V 8.48 3.78 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 0.54 0.00 0.00 0.88 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.