NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 D 4.6718 8.3644 120.5376 54.1054 42.3161 174.2180 7 E 4.3733 8.6354 123.2897 53.8087 32.0326 173.3276 8 I 3.9052 7.9575 127.3981 59.8096 39.4983 174.5332 9 S 4.7625 8.0337 118.2562 56.0681 66.2733 174.5864 10 E 4.0443 8.7103 119.1157 59.4584 29.1806 178.7223 11 T 4.2468 7.8622 113.9073 64.5523 69.1633 174.7586 12 N 4.9939 7.8873 117.2855 52.3115 38.5887 174.2346 13 T 4.7595 7.7370 110.5378 61.6335 69.8879 174.7535 14 I 4.2332 9.0215 127.9838 63.8946 37.7000 176.2271 15 F 4.9537 7.8046 113.9306 55.8654 40.7424 172.5452 16 K 4.7782 8.7837 121.1654 54.6128 35.1122 174.6999 17 L 4.9156 8.8675 129.7482 53.4566 44.1998 174.8656 18 E 4.6653 10.3949 127.9140 55.7681 30.7364 176.7054 19 G 3.8693 9.7427 112.5543 46.7815 0.0000 174.3952 20 V 3.8576 7.9851 112.1352 61.0694 33.4482 176.9054 21 S 4.7084 8.2938 118.8614 57.0231 62.1095 172.8837 22 V 4.0251 8.4107 127.2575 62.4542 32.1348 176.3687 23 L 4.1671 9.0111 128.3248 56.4284 42.5219 176.7392 24 S 4.8459 7.4303 111.4792 55.9473 65.4310 171.3587 25 P 4.8765 0.0000 0.0000 62.1785 31.4388 175.3952 26 L 4.2882 6.9647 116.7066 55.5541 42.9832 174.7166 27 R 5.1139 8.2936 121.8747 54.5911 30.0312 174.7320 28 K 4.6383 7.9858 125.7037 54.3894 36.1127 174.3575 29 K 4.6207 8.6139 127.9456 56.6831 32.9206 175.6925 30 L 4.9944 9.2082 126.4745 53.6404 47.2367 174.2655 31 D 5.3380 9.1599 119.4348 52.7357 43.4931 175.7076 32 L 4.8536 8.7750 125.7010 54.0015 43.7474 175.2582 33 V 4.6995 9.1193 126.4020 61.1437 34.6621 173.8824 34 F 5.2964 8.9419 127.1775 56.3612 40.7575 174.6037 35 Y 5.3301 8.9374 121.0944 55.6641 42.0919 173.7830 36 L 4.7268 8.5974 120.9309 53.3801 42.7078 176.9909 37 S 4.4744 9.0045 120.3414 58.8239 62.7287 175.2368 38 N 4.4509 9.1490 124.5635 56.0286 38.8178 177.0078 39 V 3.7636 8.0761 118.1289 65.4540 31.5209 176.3410 40 D 4.7074 7.7332 113.4531 52.1997 40.4773 175.8214 41 G 3.8858 8.6361 108.0014 45.9135 0.0000 173.3580 42 S 4.8925 7.7676 113.5708 55.2532 66.0823 171.8070 43 P 4.7449 0.0000 0.0000 62.9066 32.0406 176.1496 44 V 4.2893 8.7218 122.7507 61.2452 35.0723 173.9070 45 I 4.4443 7.6970 127.9783 60.2756 39.1703 174.6521 46 T 4.9383 8.8392 119.7078 60.8126 71.5497 171.9776 47 L 5.8144 8.8449 127.0295 52.2884 44.5829 175.4935 48 L 5.7068 8.4063 124.4233 52.3841 46.0322 175.9326 49 K 4.5320 8.7653 126.1984 55.2768 33.7384 175.8366 50 G 3.9103 9.3680 116.8374 46.5112 0.0000 174.3362 51 N 5.0327 9.1035 113.8847 51.7353 39.7153 175.1173 52 D 4.6800 8.8105 120.8387 53.7877 41.8446 176.5443 53 R 4.1512 8.4223 123.9082 55.6385 29.6394 175.8012 54 E 4.1964 8.7427 125.9158 58.6892 30.5485 176.7428 55 L 4.4882 7.4867 118.5147 54.1832 45.5117 173.8799 56 S 4.9443 8.5124 120.6594 56.9483 67.1976 173.2138 57 I 3.9767 8.1370 124.3551 59.3386 40.0331 174.2462 58 Y 4.8229 7.3965 122.8858 55.0534 41.7491 175.7283 59 Q 3.1452 8.5374 112.4820 57.0212 27.3298 174.7209 60 L 3.6407 7.6720 126.2196 58.4987 42.5271 179.7522 61 N 4.9403 8.1365 114.1010 55.3260 37.4452 176.3261 62 K 4.1582 8.0942 117.0683 58.3925 32.6841 177.4815 63 N 4.6260 8.8271 115.3628 53.4293 39.4926 174.5676 64 I 4.3509 7.4692 119.8739 60.3767 37.1321 175.8174 65 K 4.2465 9.1503 125.4267 57.6754 32.7677 177.1953 *67 A 4.4855 7.7997 121.9100 52.1433 20.2735 175.4149 68 S 5.0156 8.9884 114.0328 57.3420 66.6303 173.2887 69 F 5.2356 8.7271 124.7611 56.8488 39.6490 175.3155 70 L 4.9577 9.1544 123.4882 52.1155 45.4199 174.4896 71 P 4.6420 0.0000 0.0000 62.5529 32.6256 176.1841 72 V 4.2956 8.0431 123.1800 60.6273 32.5944 173.5538 73 P 4.4763 0.0000 0.0000 64.1264 31.5630 176.3830 74 E 3.9770 9.1663 121.2214 56.3409 28.9795 174.6230 75 K 4.5423 7.8982 117.0079 54.5376 32.4816 174.8150 76 P 4.3499 0.0000 0.0000 64.5502 32.0793 177.7839 77 N 4.5872 7.9583 115.8221 53.7053 38.2082 174.1878 78 L 5.1271 7.5514 118.2709 53.6382 46.2588 175.1931 79 I 4.3605 7.9677 118.2446 60.2617 42.0421 172.5995 80 Y 5.0726 9.3421 124.9515 56.3343 39.9493 174.3324 81 L 4.8712 8.6167 125.4241 53.4997 44.3579 174.8429 82 F 5.3519 9.2367 127.8724 55.3101 43.7031 173.3943 *84 T 4.5363 8.1813 110.0312 61.6793 69.8756 172.5488 85 Y 5.8714 8.7665 122.1385 54.6028 41.8664 174.6383 86 T 4.2080 8.3536 110.5474 59.9556 70.1035 174.1601 87 S 4.5978 8.2067 122.1189 57.6787 65.2844 173.0218 88 C 4.8459 8.3761 116.4361 58.8783 31.1015 174.5523 *94 S 3.9734 7.9198 112.5478 57.4480 64.7995 174.1349 95 E 4.0578 7.9429 120.5098 55.6058 29.8025 174.6500 96 P 4.3629 0.0000 0.0000 63.2131 32.3489 175.5719 97 V 4.2241 7.9102 120.9068 61.9153 32.9977 174.8939 98 V 4.9188 8.2643 126.8044 60.0299 36.0378 174.0402 *100 T 4.5396 8.1798 118.1992 63.4917 70.0242 173.1091 101 L 4.8980 8.6654 126.6094 52.8702 44.6578 175.4343 102 N 4.6919 8.4818 121.3379 52.5532 39.8741 175.7406 103 K 3.1952 8.6462 126.6609 59.3175 32.0268 179.1775 104 E 4.0013 8.0451 117.2814 59.2074 29.8408 178.2420 105 N 4.2561 8.8108 118.4286 56.6412 38.9238 176.9479 106 T 3.7090 8.1558 117.3058 66.5026 68.5919 176.0105 107 L 3.8492 7.7969 122.1798 58.5020 41.9063 178.6142 108 N 4.2689 8.2833 115.9594 56.5015 38.5629 176.9855 109 Q 4.0765 8.2744 119.2171 59.5652 28.9155 179.6712 110 F 4.2592 8.7814 118.6617 60.4158 38.8326 178.0692 111 K 3.9576 8.0683 118.1803 59.6916 31.8197 179.1805 112 N 4.6513 8.2972 115.4105 55.7804 38.4613 176.3609 113 L 4.4920 7.7606 118.5054 53.3639 41.9573 176.4885 114 G 3.9900 8.2011 106.9526 46.6058 0.0000 174.8981 115 L 4.1797 7.8360 119.6348 54.8617 42.6314 177.2271 116 L 4.6827 7.5403 120.3069 53.8222 46.1012 176.4737 117 D 5.3121 8.5108 122.1542 52.3213 39.8524 177.3263 118 S 5.0156 7.9280 110.8883 59.7820 66.0451 176.1461 119 N 4.9783 7.9985 116.7746 53.2170 37.3616 175.1208 120 V 3.6708 7.8581 118.8385 62.9996 31.5897 175.6273 121 T 4.2401 8.3786 113.6332 62.1832 70.5405 173.9194 122 D 4.4865 7.8852 121.9850 53.2780 41.0078 176.0427 123 F 4.0667 8.9390 129.9902 61.1747 39.0911 176.2589 124 E 3.8007 8.7391 118.8501 58.7452 29.2620 178.9079 125 K 4.0110 8.0028 118.9670 59.4420 32.0851 178.6563 126 C 4.0172 7.6706 116.5282 62.9092 27.9085 176.0182 127 V 3.0597 6.4984 118.9879 66.0208 30.9225 177.2958 128 E 3.8612 8.2255 119.0895 59.5996 29.2546 178.2241 129 Y 3.8303 8.0817 119.1000 60.9146 38.8359 178.1631 130 I 3.3436 7.8271 120.5854 64.4333 37.2692 178.7454 131 R 3.9018 8.5061 119.3415 58.9488 29.8651 179.2350 132 K 3.8197 7.9293 118.5006 59.4261 31.9440 179.2643 133 Q 3.7599 7.7886 118.3730 58.8219 28.5103 178.6246 134 A 3.3865 7.8930 121.8953 55.1354 18.1012 179.7095 135 I 3.7090 7.2449 118.9484 64.1192 37.0265 178.6824 136 L 3.9732 7.5922 118.2149 57.9651 41.5511 179.0038 137 T 4.3970 8.0015 113.0261 63.8338 68.9956 175.5151 138 G 4.0748 8.9696 110.8876 45.1528 0.0000 173.1816 139 F 5.3492 8.5011 115.5447 55.2301 40.4546 173.5424 140 K 4.4292 8.6291 117.1775 55.8307 35.3252 175.1308 141 I 4.7283 8.0201 120.5075 59.5427 40.0190 175.9082 142 S 4.6030 8.7949 120.2830 58.0872 64.5532 173.4425 143 N 5.4208 8.1969 118.1929 52.1312 38.6804 172.2197 144 P 4.5975 0.0000 0.0000 62.9741 32.3418 177.1564 145 F 4.8807 7.9764 116.5070 57.4262 39.5000 175.4391 146 V 3.8814 7.9196 123.0096 63.1387 31.8810 177.4464 147 N 4.5727 8.6400 126.6097 52.9732 35.2340 172.5820 *159 N 4.6460 7.9805 119.9692 51.7409 39.4536 174.0304 160 S 5.1882 8.3027 116.1509 57.8042 64.9629 173.2326 161 F 5.5177 8.3326 114.1033 56.3796 41.4049 172.5570 162 H 5.6134 8.8205 114.8225 54.3527 32.0849 171.8634 163 L 4.5746 8.2806 116.7428 54.7471 43.7991 174.5180 164 Q 4.7791 8.6226 120.1272 56.1959 29.9413 174.7437 165 C 4.7634 8.8854 116.5515 58.2869 33.8925 171.8682 166 H 5.4541 9.4454 116.3917 54.1129 31.4979 174.0079 167 R 4.5090 8.9655 122.6485 54.2478 32.0829 176.6330 168 G 3.8532 8.7977 116.5732 47.3061 0.0000 175.6488 169 T 4.1935 8.9378 121.4405 62.8012 67.9792 174.5334 170 K 4.5370 7.8584 123.6613 52.8459 32.9735 181.2786 171 E 4.3678 8.6425 124.6539 55.7034 30.4781 175.2257 172 G 3.8046 8.5220 109.1523 45.9490 0.0000 171.5274 173 T 4.9564 8.0772 114.5853 59.7882 70.3843 172.2950 174 L 4.9687 8.5505 130.4155 53.4943 44.5760 174.2671 175 Y 4.7917 9.1440 124.8460 56.4744 40.6233 175.1817 176 F 4.4610 9.0520 124.4594 55.7548 37.5271 175.8684 177 L 4.3760 8.4995 124.1815 53.0470 42.6109 176.8043 178 P 4.6281 0.0000 0.0000 65.5782 31.5148 177.3993 179 D 4.9833 7.9943 113.6339 54.0043 44.1938 174.6268 180 H 5.4224 8.3019 114.6939 54.8250 33.8577 172.1515 181 I 4.7582 8.9227 121.3028 59.5819 40.1596 174.5939 182 I 4.7644 8.2910 127.7105 59.3063 40.0612 174.2158 183 F 4.9287 8.9936 129.6903 56.5133 41.7186 174.5092 184 G 3.3952 7.5624 112.3798 44.8479 0.0000 172.8464 185 F 5.0576 8.1121 116.7776 56.9659 40.0404 175.6879 186 K 4.4037 7.8210 119.4519 55.2439 32.9217 177.0768 187 K 4.1556 8.4482 121.5041 55.9887 32.5710 175.4295 188 P 4.6802 0.0000 0.0000 61.9571 32.6068 175.8737 189 I 4.2133 8.1226 120.3726 61.5045 38.0541 175.3571 190 L 4.6937 9.1615 125.0185 52.7625 45.2640 175.2978 191 L 4.9163 7.7749 123.2457 53.2510 44.9947 175.4017 192 F 5.0301 9.0669 124.2963 55.7381 43.1431 174.0117 193 D 4.9226 8.8172 122.0791 53.1658 42.1324 177.1447 194 A 4.1257 8.6200 127.3208 55.7156 18.6383 179.7142 195 S 4.1441 8.3222 110.2315 62.0226 63.0028 175.3030 196 D 4.6212 8.7704 118.0685 54.4238 40.9847 175.8316 197 I 4.3050 7.4970 114.6351 60.0299 37.9967 175.3441 198 E 4.1986 9.2826 128.0088 58.6680 29.9710 176.4348 199 S 4.6846 7.8306 112.0313 56.9824 66.3021 171.8584 200 I 5.0844 8.2970 124.8187 59.3759 39.7028 174.6393 201 T 4.3566 8.6613 119.1591 59.9529 72.1138 172.2188 202 Y 5.4157 8.5165 123.7965 57.9367 39.4775 175.7634 203 S 4.6562 9.0446 125.6929 60.1183 66.9584 172.3873 204 S 3.8231 8.1523 107.1534 61.3214 58.9615 169.9366 205 I 4.5101 7.4607 127.3459 61.9170 36.5601 176.7196 206 T 4.4399 7.7591 119.8035 61.0674 70.5219 174.8575 207 R 4.1639 8.6027 119.0208 58.2927 30.7881 177.9858 208 L 4.6108 7.9768 116.8307 55.0379 43.8306 175.1452 209 T 5.4906 7.5968 108.4392 60.9096 72.2161 172.5654 210 F 5.2175 7.9383 114.9718 57.8552 41.4847 172.8750 211 N 5.3302 9.0568 115.4327 51.3699 42.2266 173.7721 212 A 5.4195 9.1586 123.3509 50.3858 22.7089 175.2924 213 S 5.1100 8.7977 116.7385 56.7925 66.5371 173.1926 214 L 5.0480 9.0957 125.1730 53.3602 44.1169 175.9819 215 V 4.9495 8.3547 115.8600 59.5310 34.8238 175.2839 216 T 4.5867 9.2255 117.2506 61.5343 69.5163 175.4127 217 K 3.9929 9.0461 127.7524 59.8674 32.7993 179.0786 218 D 4.6459 7.9229 119.0567 52.9248 38.6054 179.5912 219 G 4.1494 8.1847 117.4120 47.2720 0.0000 174.1536 220 E 4.0832 8.3775 119.0111 56.2888 30.8776 176.3439 221 K 4.9641 7.8848 122.0972 54.9335 35.1636 174.8566 222 Y 4.5960 9.5085 124.8118 55.9493 41.7854 174.0686 223 E 4.7975 8.2356 123.3719 54.3308 32.2682 174.6181 224 F 4.8739 9.3980 126.5485 55.8212 41.7636 174.9364 225 S 5.4110 9.1353 120.0773 55.6538 63.3448 171.4569 *227 T 4.2780 7.9024 122.6029 63.6446 70.1220 172.8651 228 D 4.7212 8.5957 125.9311 54.0690 42.2595 177.0399 229 Q 4.4290 8.7188 124.4615 59.2001 28.4564 179.1178 230 T 3.9747 8.1198 109.9276 64.3043 68.9946 175.8727 231 E 4.1000 8.5769 121.8405 58.7254 29.4085 178.0420 232 Y 3.9208 8.2548 120.1639 60.9109 38.7323 177.6892 233 A 3.6843 8.0026 120.3821 55.5281 18.3282 179.3053 234 K 3.3776 7.5768 114.9989 59.6631 32.2650 179.5918 235 I 3.4849 7.1848 119.4240 64.2499 36.8094 177.9339 236 D 4.1679 7.9190 119.5320 57.0572 41.0372 177.5444 237 D 4.4303 7.7702 119.1599 57.7669 40.8752 178.5660 238 Y 4.0257 8.0954 119.7675 60.9982 38.6007 178.8126 239 V 3.9962 7.8407 120.1100 65.3979 32.0976 178.2529 240 K 4.0083 9.0388 125.9583 59.4040 31.1892 182.8576 241 R 4.0957 8.4547 120.0462 59.5455 30.4286 179.3079 242 K 4.0334 8.0378 116.4549 58.5801 33.3044 178.6424 243 Q 4.3020 7.7066 122.4335 54.9998 25.4391 176.6588 *245 K 4.1198 7.6802 124.4250 54.7826 32.5355 177.4375 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 6 D 8.36 4.67 0.00 2.80 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 7 E 8.64 4.37 0.00 1.94 1.78 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 2.12 2.31 0.00 8 I 7.96 3.91 1.59 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.10 0.65 0.00 0.00 9 S 8.03 4.76 0.00 3.92 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 10 E 8.71 4.04 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 11 T 7.86 4.25 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 12 N 7.89 4.99 0.00 3.09 3.08 0.00 0.00 6.56 8.43 0.00 0.00 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 T 7.74 4.76 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 1.24 0.00 0.00 14 I 9.02 4.23 2.29 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 1.41 0.68 1.10 0.00 0.00 15 F 7.80 4.95 0.00 3.06 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 16 K 8.78 4.78 0.00 1.71 1.70 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.46 7.81 17 L 8.87 4.92 0.00 1.96 1.64 1.10 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 18 E 10.39 4.67 0.00 2.03 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 0.00 2.33 2.47 0.00 19 G 9.74 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 20 V 7.99 3.86 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.01 0.00 0.00 21 S 8.29 4.71 0.00 3.90 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 V 8.41 4.03 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 0.99 0.00 0.00 0.94 0.00 0.00 23 L 9.01 4.17 0.00 1.80 1.61 1.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 7.43 4.85 0.00 3.76 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.88 0.00 2.22 2.12 0.00 3.82 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 1.99 2.04 0.00 26 L 6.96 4.29 0.00 1.73 1.62 0.93 0.76 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 27 R 8.29 5.11 0.00 1.84 1.91 0.00 3.08 0.00 0.00 3.82 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.45 0.00 28 K 7.99 4.64 0.00 1.92 1.56 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.71 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.41 1.01 7.81 29 K 8.61 4.62 0.00 1.81 1.70 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.47 7.81 30 L 9.21 4.99 0.00 1.52 1.59 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 31 D 9.16 5.34 0.00 2.51 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 0.00 0.00 0.00 0.00 32 L 8.78 4.85 0.00 1.77 1.55 1.22 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 33 V 9.12 4.70 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 1.09 0.00 0.00 0.89 0.00 0.00 34 F 8.94 5.30 0.00 2.99 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 35 Y 8.94 5.33 0.00 3.26 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 36 L 8.60 4.73 0.00 1.64 1.70 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 37 S 9.00 4.47 0.00 3.77 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 38 N 9.15 4.45 0.00 2.85 2.90 0.00 0.00 6.97 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 39 V 8.08 3.76 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 0.76 0.00 0.00 1.01 0.00 0.00 40 D 7.73 4.71 0.00 2.75 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 41 G 8.64 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 42 S 7.77 4.89 0.00 3.91 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 4.74 0.00 1.93 2.05 0.00 3.61 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.11 0.00 44 V 8.72 4.29 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 0.00 0.00 0.98 0.00 0.00 0.80 0.00 0.00 45 I 7.70 4.44 1.34 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 1.11 0.54 0.55 0.00 0.00 46 T 8.84 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 1.42 0.00 0.00 47 L 8.84 5.81 0.00 1.51 1.48 0.80 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.41 5.71 0.00 1.52 1.57 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.77 4.53 0.00 1.44 1.68 0.00 1.94 0.00 0.00 1.82 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.00 7.81 50 G 9.37 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 N 9.10 5.03 0.00 2.70 2.63 0.00 0.00 6.53 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.81 4.68 0.00 2.80 2.61 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 53 R 8.42 4.15 0.00 1.81 1.92 0.00 3.22 0.00 0.00 3.19 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 54 E 8.74 4.20 0.00 1.96 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 0.00 2.30 2.29 0.00 55 L 7.49 4.49 0.00 1.65 1.30 0.81 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.51 4.94 0.00 3.75 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 57 I 8.14 3.98 1.37 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 0.59 0.77 0.64 0.00 0.00 58 Y 7.40 4.82 0.00 2.87 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 8.54 3.15 0.00 2.31 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 60 L 7.67 3.64 0.00 1.74 1.42 0.79 0.22 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 61 N 8.14 4.94 0.00 2.87 3.10 0.00 0.00 6.44 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 62 K 8.09 4.16 0.00 2.15 1.91 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.03 7.81 63 N 8.83 4.63 0.00 2.94 2.95 0.00 0.00 7.01 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 I 7.47 4.35 1.63 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.09 0.79 0.00 0.00 65 K 9.15 4.25 0.00 1.95 1.88 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.44 1.26 7.81 *67 A 7.80 4.49 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 68 S 8.99 5.02 0.00 3.90 3.68 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 69 F 8.73 5.24 0.00 3.28 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 70 L 9.15 4.96 0.00 1.41 0.92 0.18 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 4.64 0.00 1.83 1.95 0.00 3.21 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 2.01 0.00 72 V 8.04 4.30 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 0.92 0.00 0.00 -0.12 0.00 0.00 73 P 0.00 4.48 0.00 2.24 2.10 0.00 4.10 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 74 E 9.17 3.98 0.00 2.13 2.17 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *84 T 8.18 4.54 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 85 Y 8.77 5.87 0.00 2.80 2.67 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 86 T 8.35 4.21 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 1.10 0.00 0.00 87 S 8.21 4.60 0.00 4.20 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 0.00 88 C 8.38 4.85 0.00 3.11 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 *94 S 7.92 3.97 0.00 3.81 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 95 E 7.94 4.06 0.00 1.96 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 2.29 2.24 0.00 96 P 0.00 4.36 0.00 1.56 1.71 0.00 3.71 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 97 V 7.91 4.22 1.79 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 0.78 0.00 0.00 0.48 0.00 0.00 98 V 8.26 4.92 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 0.27 0.00 0.00 0.69 0.00 0.00 *100 T 8.18 4.54 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 1.05 0.00 0.00 101 L 8.67 4.90 0.00 1.60 1.61 1.27 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 102 N 8.48 4.69 0.00 2.65 2.63 0.00 0.00 7.16 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 0.00 103 K 8.65 3.20 0.00 1.56 1.39 0.00 1.45 0.00 0.00 1.16 0.00 0.00 2.44 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.30 0.63 7.81 104 E 8.05 4.00 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 105 N 8.81 4.26 0.00 2.73 2.93 0.00 0.00 7.21 6.79 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 0.00 106 T 8.16 3.71 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 107 L 7.80 3.85 0.00 2.07 1.80 0.90 0.89 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 0.00 108 N 8.28 4.27 0.00 3.00 2.87 0.00 0.00 7.06 7.27 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 0.00 109 Q 8.27 4.08 0.00 2.35 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.78 0.00 0.00 0.00 0.00 0.00 2.45 2.73 0.00 110 F 8.78 4.26 0.00 3.11 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 0.00 111 K 8.07 3.96 0.00 2.04 1.86 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.62 7.81 112 N 8.30 4.65 0.00 2.81 2.91 0.00 0.00 7.14 8.09 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 0.00 113 L 7.76 4.49 0.00 1.62 1.59 1.05 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.20 3.99 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 0.00 123 F 8.94 4.07 0.00 3.02 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 E 8.74 3.80 0.00 2.29 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 2.29 2.34 0.00 125 K 8.00 4.01 0.00 1.83 1.80 0.00 1.74 0.00 0.00 1.77 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.59 7.81 126 C 7.67 4.02 0.00 1.77 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 0.00 0.00 0.00 0.00 127 V 6.50 3.06 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 0.68 0.00 0.00 -0.02 0.00 0.00 128 E 8.23 3.86 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 129 Y 8.08 3.83 0.00 3.05 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 0.00 130 I 7.83 3.34 2.21 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.88 1.12 0.00 0.00 131 R 8.51 3.90 0.00 1.93 1.96 0.00 3.54 0.00 0.00 3.40 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.04 0.00 132 K 7.93 3.82 0.00 1.85 1.59 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.35 7.81 133 Q 7.79 3.76 0.00 1.82 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 1.25 2.06 0.00 134 A 7.89 3.39 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 I 7.24 3.71 1.93 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.27 0.86 0.00 0.00 136 L 7.59 3.97 0.00 1.63 1.73 0.91 0.75 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 0.00 137 T 8.00 4.40 4.78 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 1.64 0.00 0.00 138 G 8.97 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 0.00 139 F 8.50 5.35 0.00 3.15 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 0.00 140 K 8.63 4.43 0.00 1.81 1.71 0.00 1.55 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.52 7.81 141 I 8.02 4.73 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.57 0.88 0.00 0.00 142 S 8.79 4.60 0.00 4.05 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 0.00 143 N 8.20 5.42 0.00 2.86 2.82 0.00 0.00 7.01 7.69 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 0.00 144 P 0.00 4.60 0.00 1.69 2.00 0.00 3.71 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.09 0.00 145 F 7.98 4.88 0.00 3.15 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 0.00 0.00 146 V 7.92 3.88 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.01 0.00 0.00 147 N 8.64 4.57 0.00 2.78 2.64 0.00 0.00 6.62 7.99 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 *159 N 7.98 4.65 0.00 2.76 2.68 0.00 0.00 6.93 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 S 8.30 5.19 0.00 3.29 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 F 8.33 5.52 0.00 3.29 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 0.00 162 H 8.82 5.61 0.00 2.70 3.09 0.00 5.56 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 L 8.28 4.57 0.00 1.83 1.86 1.01 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 164 Q 8.62 4.78 0.00 1.97 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 165 C 8.89 4.76 0.00 3.20 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 H 9.45 5.45 0.00 3.25 3.46 0.00 5.76 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 R 8.97 4.51 0.00 1.33 1.78 0.00 3.21 0.00 0.00 3.14 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.00 0.00 168 G 8.80 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 0.00 0.00 0.00 169 T 8.94 4.19 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 1.24 0.00 0.00 170 K 7.86 4.54 0.00 1.76 1.66 0.00 1.86 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.31 1.23 7.81 171 E 8.64 4.37 0.00 1.74 1.83 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 2.24 2.30 0.00 172 G 8.52 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.08 4.96 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 1.02 0.00 0.00 174 L 8.55 4.97 0.00 1.79 1.42 0.14 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 175 Y 9.14 4.79 0.00 2.84 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 0.00 176 F 9.05 4.46 0.00 1.51 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 0.00 0.00 0.00 0.00 177 L 8.50 4.38 0.00 1.94 1.64 0.85 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 178 P 0.00 4.63 0.00 2.07 2.13 0.00 3.65 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 179 D 7.99 4.98 0.00 2.55 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 0.00 180 H 8.30 5.42 0.00 3.08 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 I 8.92 4.76 1.85 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 1.23 0.87 0.27 0.00 0.00 182 I 8.29 4.76 1.64 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 1.11 1.04 0.57 0.00 0.00 183 F 8.99 4.93 0.00 2.97 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 0.00 184 G 7.56 3.40 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 0.00 185 F 8.11 5.06 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 0.00 186 K 7.82 4.40 0.00 1.78 1.78 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.47 7.81 187 K 8.45 4.16 0.00 1.78 1.79 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.46 7.81 188 P 0.00 4.68 0.00 2.22 2.08 0.00 3.87 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 189 I 8.12 4.21 1.97 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 1.34 0.55 1.16 0.00 0.00 190 L 9.16 4.69 0.00 1.17 0.91 1.03 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 191 L 7.77 4.92 0.00 1.54 1.36 1.01 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 192 F 9.07 5.03 0.00 3.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 D 8.82 4.92 0.00 2.76 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 0.00 194 A 8.62 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 8.32 4.14 0.00 3.90 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 D 8.77 4.62 0.00 2.87 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 0.00 197 I 7.50 4.31 1.84 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 0.56 0.96 0.00 0.00 198 E 9.28 4.20 0.00 1.99 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 2.27 0.00 199 S 7.83 4.68 0.00 3.89 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 I 8.30 5.08 1.90 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 1.40 1.06 0.83 0.00 0.00 201 T 8.66 4.36 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 202 Y 8.52 5.42 0.00 2.93 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 0.00 203 S 9.04 4.66 0.00 3.37 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 S 8.15 3.82 0.00 3.73 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 0.00 205 I 7.46 4.51 1.88 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 1.53 1.08 0.89 0.00 0.00 206 T 7.76 4.44 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 1.24 0.00 0.00 207 R 8.60 4.16 0.00 1.80 2.00 0.00 3.19 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 208 L 7.98 4.61 0.00 1.74 1.68 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 209 T 7.60 5.49 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 1.23 0.00 0.00 210 F 7.94 5.22 0.00 3.10 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 0.00 211 N 9.06 5.33 0.00 2.74 2.87 0.00 0.00 7.10 9.25 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 0.00 212 A 9.16 5.42 1.53 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 0.00 213 S 8.80 5.11 0.00 3.73 3.69 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 0.00 214 L 9.10 5.05 0.00 1.56 1.43 0.43 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 215 V 8.35 4.95 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 0.75 0.00 0.00 0.99 0.00 0.00 216 T 9.23 4.59 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 217 K 9.05 3.99 0.00 1.70 1.98 0.00 1.83 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.56 7.81 218 D 7.92 4.65 0.00 2.60 2.61 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 0.00 219 G 8.18 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 0.00 220 E 8.38 4.08 0.00 1.98 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 2.34 2.49 0.00 221 K 7.88 4.96 0.00 1.84 1.44 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.30 1.01 7.81 222 Y 9.51 4.60 0.00 2.81 2.43 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.24 4.80 0.00 1.74 1.61 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 2.25 2.21 0.00 224 F 9.40 4.87 0.00 3.03 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 0.00 225 S 9.14 5.41 0.00 3.79 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *227 T 7.90 4.28 3.00 0.00 0.00 0.00 0.00 0.00 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 0.00 228 D 8.60 4.72 0.00 2.78 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 0.00 229 Q 8.72 4.43 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.67 0.00 230 T 8.12 3.97 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 1.26 0.00 0.00 231 E 8.58 4.10 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 232 Y 8.25 3.92 0.00 2.17 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 0.00 233 A 8.00 3.68 1.22 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 0.00 234 K 7.58 3.38 0.00 1.00 0.74 0.00 0.99 0.00 0.00 1.06 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.08 1.17 7.81 235 I 7.18 3.48 1.88 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 1.22 1.09 1.04 0.00 0.00 236 D 7.92 4.17 0.00 1.74 2.33 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 0.00 237 D 7.77 4.43 0.00 2.81 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 0.00 238 Y 8.10 4.03 0.00 3.30 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 0.00 239 V 7.84 4.00 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 0.99 0.00 0.00 1.09 0.00 0.00 240 K 9.04 4.01 0.00 1.72 1.79 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.36 7.81 241 R 8.45 4.10 0.00 1.66 1.97 0.00 3.10 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 242 K 8.04 4.03 0.00 1.76 1.87 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.94 1.32 7.81 243 Q 7.71 4.30 0.00 2.30 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 *245 K 7.68 4.12 0.00 1.80 1.62 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 * Residues marked with a * may have inaccurate shift predictions.