NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6803 8.1633 120.2770 54.6910 34.1984 174.5643 2 K 4.4426 8.7477 122.9724 55.4720 33.4564 174.2406 3 Y 5.0954 8.3186 121.3730 56.2494 42.4091 172.8641 4 M 3.7961 8.5598 116.1616 53.4821 35.2024 173.6892 5 I 5.2416 8.2338 119.7592 59.7701 40.4041 175.0332 6 T 4.8150 9.3024 117.5249 59.9449 70.8927 173.6150 7 S 6.0994 8.9039 120.0561 55.6063 65.4011 174.3939 8 K 4.1274 8.7623 119.7091 58.1541 32.5686 177.7304 9 G 4.1141 8.0121 108.2863 44.9616 0.0000 174.4650 10 D 4.6408 8.0522 120.2657 52.6488 41.5797 176.8388 11 E 3.9296 8.6526 119.2809 59.6060 29.5191 179.0738 12 K 3.8769 8.0539 120.3218 59.4487 32.2582 178.7995 13 S 4.2647 8.2103 114.6608 61.3231 62.3085 176.3861 14 D 4.3580 8.0874 122.1836 57.3397 40.8135 178.7454 15 L 4.0953 8.7044 120.5657 58.3086 40.4081 178.9151 16 L 3.9425 7.9824 121.7418 57.9871 41.9127 178.7575 17 R 3.9623 7.8600 118.2580 59.6162 30.0599 178.4792 18 L 4.0047 7.8155 118.1686 57.9769 41.6229 179.2324 19 N 4.4979 8.1760 115.7721 55.9621 38.4145 177.5883 20 M 3.8819 8.3600 120.8720 58.1303 31.8321 178.4976 21 I 4.5971 8.2652 120.4012 63.9923 37.7821 177.9787 22 A 4.2970 8.2155 121.4936 55.1589 17.9225 179.8020 23 G 3.5520 8.0465 104.2683 48.1292 0.0000 175.8929 24 F 4.7132 8.5788 120.2315 59.9085 38.6551 177.9139 25 G 3.8443 7.9365 104.4140 47.4666 0.0000 174.9467 26 E 4.1406 7.8967 118.6875 57.4962 29.8276 175.4809 27 Y 4.7231 7.5430 116.0111 55.8965 40.9567 176.0864 28 D 4.7675 8.5431 120.0333 53.5136 39.5498 174.0323 29 M 5.0625 7.8973 120.0971 53.3257 36.7527 173.4084 30 E 4.7434 8.8753 123.6612 54.2460 32.6979 174.1543 31 Y 3.4369 8.6301 128.6385 57.3765 39.5400 174.6772 32 D 4.3999 8.0861 128.1174 53.6961 43.1452 174.2952 33 D 4.5471 8.7082 125.0458 53.3893 40.3335 177.4842 34 V 3.9963 7.9674 120.0603 64.8135 32.5744 175.9087 35 E 4.6791 8.3208 115.0002 53.9569 28.9431 173.5124 36 P 4.2580 0.0000 0.0000 63.3345 32.9002 176.8623 37 E 4.4092 8.4441 118.8421 57.3851 31.4163 176.0514 38 I 4.6883 7.3399 120.0450 59.2004 40.9555 174.4370 39 V 4.3578 7.8449 127.2718 61.1030 33.5043 174.2038 40 I 4.9632 8.4789 129.1273 59.7495 39.4580 174.4080 41 S 5.2744 9.6210 122.5487 56.6428 64.7061 172.5649 42 I 4.8750 10.2205 129.2767 60.9664 38.9121 175.0949 43 G 3.3501 9.3458 119.4593 44.7929 0.0000 172.5796 44 G 4.2879 8.1933 107.6756 43.0885 0.0000 173.9392 45 D 4.7108 8.5352 120.6723 57.1045 40.7737 179.5461 46 G 3.6604 8.1445 106.1052 48.2189 0.0000 175.8356 47 T 4.0615 7.9540 117.8868 66.1529 68.4696 176.6460 48 F 4.1182 8.3632 122.8858 60.8966 39.3398 177.0022 49 L 3.9738 8.3400 120.2244 58.4678 41.9542 179.2113 50 S 4.1664 8.1109 114.3554 61.3756 62.6997 176.5887 51 A 4.0632 8.0433 123.4798 55.1628 17.9947 179.1150 52 F 3.7944 7.8765 117.9228 62.0926 39.4210 177.0229 53 H 4.1281 8.3421 113.8680 58.2906 28.4930 177.3616 54 Q 3.9184 7.8877 121.2322 58.4293 29.0867 176.9809 55 Y 4.6724 7.5423 116.7659 57.6115 38.8897 177.4842 56 E 3.8466 7.9362 119.3484 58.4371 29.9594 177.3831 57 E 4.2211 7.9898 117.7355 57.7582 30.0448 176.9535 58 R 4.7100 7.8892 118.6333 55.6760 31.1630 177.8667 59 L 4.0642 8.3496 120.6081 57.8949 42.0353 178.3336 60 D 4.5703 8.0109 117.4774 57.0052 41.0850 177.1835 61 E 4.5676 8.2366 114.4063 55.8359 30.7549 175.5767 62 I 4.6065 7.5709 119.3122 59.2247 39.9133 174.5877 63 A 4.8846 8.6098 127.9998 50.2711 21.4748 175.7527 64 F 4.9058 9.2253 121.5287 56.5387 41.3388 175.1802 65 I 5.3417 9.2405 122.3813 59.7461 41.5613 174.3883 66 G 4.9210 9.1907 112.3999 43.7908 0.0000 171.8057 67 I 5.2437 9.4878 125.0878 59.8883 40.4457 174.1706 68 H 5.3146 9.4047 124.7889 55.5710 33.1269 174.4768 69 T 4.0621 8.5892 114.7067 63.9265 70.2300 175.5095 70 G 3.9532 7.1014 117.3820 44.7693 0.0000 173.6301 71 H 4.0877 8.7555 123.8931 56.1116 30.0744 176.3522 72 L 3.9012 8.3751 127.3336 55.8186 41.8953 178.7019 73 G 3.4838 6.1696 105.9337 45.0280 0.0000 172.9378 74 F 4.6180 8.3923 116.0024 58.0814 39.5871 175.8976 75 Y 4.5702 7.6472 117.8631 56.9761 38.5979 174.5464 76 A 4.9982 7.7941 120.7375 51.2562 22.1068 176.2878 77 D 4.8499 8.8926 118.2035 53.2566 42.8688 175.3808 78 W 5.1344 8.0217 116.6953 55.2213 33.1329 174.3090 79 R 5.2066 8.5616 120.0147 53.2119 32.1279 175.5300 80 P 4.2258 0.0000 0.0000 66.0943 31.1918 178.6159 81 A 4.1657 8.1024 116.8582 54.2632 18.5517 178.0385 82 E 4.5451 8.3953 116.1320 56.1803 30.1090 177.5700 83 A 3.8678 8.5561 123.6422 55.1196 17.8720 179.6473 84 D 4.2149 7.9504 117.0868 56.2720 39.4147 178.8774 85 K 3.9570 7.9772 120.2949 58.9494 32.1045 179.0458 86 L 2.7704 7.1599 120.0944 57.5632 41.9823 178.5978 87 V 2.8767 7.0839 118.1641 65.9437 31.2357 178.1214 88 K 3.5886 7.3094 116.6837 59.3930 31.9596 179.4041 89 L 4.0104 7.8663 119.4306 57.6083 41.5100 179.3275 90 L 4.3356 8.2405 120.3860 58.4165 41.8706 179.0210 91 A 4.0020 7.6123 119.3602 54.4589 18.3031 178.8975 92 K 4.2590 8.0200 115.1130 56.9631 33.1232 177.4055 93 G 3.8089 7.9980 108.1460 46.9373 0.0000 174.3579 94 E 4.4619 8.3664 119.4914 54.6738 28.4966 174.1206 95 Y 4.9288 6.8810 116.5174 55.5764 42.2687 175.5739 96 Q 4.7139 8.7597 120.9791 54.1647 31.8928 174.7769 97 K 5.3129 8.6805 125.0975 55.9517 33.2656 176.5281 98 V 4.6861 8.4283 122.2558 61.5508 35.2830 173.7071 99 S 5.4970 8.9483 121.8295 57.0544 66.4297 172.8517 100 Y 5.0843 8.8066 120.1708 55.5866 41.0945 173.8832 101 P 4.8067 0.0000 0.0000 62.7540 32.7395 175.0344 102 L 4.9486 8.4199 120.2055 52.9457 46.6443 174.7714 103 L 5.1117 8.4841 121.2757 53.3485 44.7966 174.8301 104 K 4.9566 9.1881 128.4786 55.6457 34.1141 175.1235 105 T 5.1194 9.1342 123.9116 62.0520 71.8779 172.9667 106 T 4.9489 8.6822 122.5857 61.6223 71.8710 173.0841 107 V 4.4292 9.1851 127.1971 61.0923 33.7576 174.4019 108 K 4.4777 8.7375 127.9495 55.4398 34.1516 175.1455 109 Y 4.5551 8.4194 120.3192 60.0977 39.5845 176.6887 *114 K 4.2804 7.7451 121.1241 55.4549 34.3129 175.9654 115 E 5.1152 8.6638 120.3178 55.6711 32.6536 173.8947 116 A 4.7697 9.1878 129.1292 50.3667 21.8525 175.0033 117 T 4.9315 8.0014 117.9806 61.8798 71.7739 173.2656 118 Y 4.8993 9.0880 122.3410 56.4182 42.5984 174.0337 119 L 5.3056 8.8677 122.7330 53.3380 43.9538 175.6441 120 A 5.0484 9.0471 124.7291 50.3929 21.5379 177.1638 121 L 3.5793 8.8307 123.6032 57.2726 42.4738 176.8716 122 N 4.9676 8.5840 114.8861 53.6740 40.2313 175.1133 123 E 5.1201 7.7907 113.4268 55.8896 33.3872 173.0842 124 S 5.1829 9.0106 114.3865 56.9023 65.7758 172.6859 125 T 5.2067 8.8688 116.7097 59.8724 72.3298 172.9906 126 V 4.8691 8.7318 122.4407 61.3061 34.5130 174.5630 127 K 4.3282 8.9015 125.9100 54.8186 36.4020 176.6598 128 S 4.4477 9.2917 115.8861 60.8686 61.6608 173.8235 129 S 4.6522 8.3183 119.8366 57.9795 60.2622 172.8542 *132 P 4.0993 0.0000 0.0000 62.3083 32.1025 178.1287 133 F 4.7019 7.8199 121.5701 57.8043 40.4155 174.0208 134 V 4.8642 7.9856 125.3918 60.6420 34.0496 174.4095 135 V 4.6192 8.8601 127.0883 60.0874 35.0807 173.9851 136 D 5.0958 9.1793 124.8803 53.8990 42.3429 175.3322 137 V 4.6376 9.1797 124.5348 61.3125 33.5686 174.4484 138 V 4.8997 8.8976 128.4643 61.1134 34.5191 174.0441 139 I 4.7432 9.0668 128.5493 59.8511 39.9898 175.7164 140 N 4.2163 9.7071 126.4247 54.6043 36.5590 174.8556 141 D 4.5995 8.3220 112.8105 54.6062 39.0137 174.1256 142 I 4.4835 7.4451 120.9365 59.0783 39.3517 174.6019 143 H 4.3585 9.0172 124.8459 57.1106 30.1431 173.4749 144 F 4.8185 9.1655 129.4424 59.5174 40.5941 175.1859 145 E 4.6229 7.8894 114.2376 55.1554 33.1455 173.6611 146 R 5.0404 8.6416 121.2202 54.8841 31.5163 174.5717 147 F 4.7700 9.5042 130.4671 57.1013 41.4452 174.3698 148 R 5.0618 7.4103 124.9539 53.0127 32.7707 174.5653 149 G 3.8207 7.9686 112.3045 46.3773 0.0000 171.7886 150 D 4.4680 8.8193 119.6221 56.2029 41.4060 176.3201 151 G 3.3633 7.1912 102.6648 46.3845 0.0000 171.5775 152 L 5.2534 8.0080 118.3828 53.0467 46.6175 175.6443 153 C 5.0123 8.8102 121.0878 57.9124 34.9714 172.1240 154 M 4.8762 8.8396 126.6718 53.7560 33.9800 174.1649 155 S 5.2534 8.8005 121.5454 56.4312 65.3583 173.6148 156 T 4.3912 8.6591 117.0765 60.8702 69.5335 172.9055 157 P 4.2672 0.0000 0.0000 65.9060 31.4451 179.2886 158 S 3.9543 7.8746 111.4105 61.1111 63.2417 175.8893 159 G 3.7964 8.2161 107.9921 46.1146 0.0000 175.3056 160 T 3.9871 7.4567 111.8946 64.3100 68.8408 175.8467 161 T 4.0361 7.6586 110.4921 61.7858 69.9324 174.3731 162 A 4.8720 8.2581 124.8085 52.0629 17.7060 178.8072 163 Y 4.3688 8.5371 122.2064 63.1391 38.4037 176.3683 164 N 4.0759 8.3556 117.7008 56.7573 38.8684 176.3591 165 K 3.7692 7.8784 120.2560 59.7801 32.1257 178.9436 166 S 4.1901 8.0493 113.1590 61.0038 62.7619 175.5234 167 L 4.3294 7.0921 119.6407 54.3538 41.6533 177.4070 168 G 3.9205 7.9017 107.9861 44.7636 0.0000 174.5577 169 G 3.6239 7.4817 108.3365 44.8262 0.0000 173.8075 170 A 4.0442 8.4686 124.6813 51.9186 18.9965 177.3113 171 L 4.3586 8.4049 122.3617 54.2815 42.6152 176.3361 172 M 4.8399 8.1738 123.2125 53.1168 34.8969 175.3711 173 H 2.8817 8.8099 122.6270 55.4233 30.3405 174.0531 174 P 3.8721 0.0000 0.0000 63.9624 31.0548 177.1955 175 S 4.2452 7.5184 113.1585 60.0665 63.6401 174.4588 176 I 3.8191 7.1664 122.6786 60.9890 37.3220 175.9135 177 E 4.2017 8.6104 125.0067 55.7623 28.2947 174.9134 178 A 4.9165 7.6973 123.9131 51.4263 22.5823 174.5571 179 M 5.0175 9.1458 115.8426 53.7063 35.3415 174.1493 180 Q 5.0011 8.9567 121.1554 54.3585 32.4366 173.4864 181 L 5.1531 9.0977 129.4860 53.7088 44.1505 175.1633 182 T 4.9937 8.9974 116.1493 59.9356 72.1189 172.6436 183 E 4.8472 8.6315 121.6617 55.4892 32.3489 174.9709 184 M 4.5074 8.9280 122.6807 53.3841 33.7795 176.2239 185 A 3.6417 8.5261 129.3790 52.9583 16.2330 176.8523 186 S 3.9715 7.8868 114.8148 58.2151 63.5173 174.0740 187 I 3.6291 8.4406 129.2651 62.9129 37.5460 175.9191 188 N 4.3687 8.0405 116.0873 53.4095 36.9161 171.1160 189 N 5.1511 7.4115 115.5439 51.0242 40.8169 174.3027 190 R 3.9807 8.7995 117.1879 60.1000 29.9925 178.6936 191 V 3.5585 7.7222 115.2211 64.9735 32.3583 175.3085 192 Y 4.9854 7.9975 116.4098 56.5824 38.2099 175.8463 193 R 4.2060 7.9230 118.7027 56.6269 31.0660 176.9448 194 T 4.9713 8.3502 112.0755 59.4692 71.8214 173.9933 195 I 3.8183 8.6142 122.0733 62.0702 38.3587 176.6945 196 G 4.3930 8.5497 112.8963 46.2753 0.0000 174.4304 197 S 4.3030 7.6871 115.2474 57.0102 63.5063 172.5553 198 P 4.6249 0.0000 0.0000 62.9680 32.1365 175.6127 199 L 4.4546 8.6859 122.5100 52.8351 44.5413 175.4968 200 V 4.5710 7.9992 123.9613 61.2212 33.0584 174.4913 201 F 4.9119 9.2796 127.6489 55.0699 41.5134 174.3815 202 P 5.2116 0.0000 0.0000 60.9000 33.0667 175.6336 203 K 3.8996 8.4236 119.9499 58.1487 32.4172 177.4327 204 H 4.4109 8.6735 118.7773 56.5370 27.2324 175.1819 205 H 4.7572 7.8557 116.6140 55.2600 29.4524 174.9106 206 V 4.5774 9.2614 122.5568 59.8606 34.4682 174.3462 207 V 4.5303 8.5070 124.7530 60.9702 33.8109 174.0034 208 S 5.0262 9.1703 122.8730 56.4369 65.2928 172.2479 209 L 5.0289 9.0254 127.5805 53.2027 43.7935 175.4559 210 Q 4.9365 8.8581 123.2057 53.0049 31.7955 173.3581 211 P 4.7801 0.0000 0.0000 63.8412 31.3074 176.4312 212 V 3.8071 8.2378 115.8616 63.3352 32.8385 176.0378 213 N 4.8150 8.4389 113.1924 52.5427 41.3057 176.2698 214 D 4.5649 8.1249 119.6829 54.4913 42.8214 177.2787 215 K 4.6458 8.6068 130.5542 56.3035 33.1659 173.8240 216 D 5.2161 7.5009 119.6221 54.5277 40.7632 181.4642 217 F 5.0487 8.8469 119.6766 55.5269 44.4954 173.6782 218 Q 4.5794 9.3009 124.0263 55.4039 29.8348 174.1729 219 I 5.0267 8.7899 128.6655 59.8767 39.5064 175.2491 220 S 5.1291 9.0550 122.8045 56.7242 66.4105 173.6249 221 V 4.3729 8.2323 122.2578 61.0868 33.9562 174.9771 222 D 4.3694 9.9102 134.2296 57.0294 40.9162 178.9741 *223 H 3.0998 7.8750 120.3888 55.1815 30.1063 173.2562 224 L 4.5129 6.8890 124.3684 52.8252 42.0289 178.1577 225 S 4.9744 8.4931 120.2191 56.6733 64.2112 173.6673 226 I 4.4527 9.2303 126.6601 59.0793 40.2216 174.7546 227 L 4.7062 8.6024 129.1220 54.8587 42.1795 175.1584 228 H 4.8905 9.2540 127.3639 55.5519 30.4310 175.3122 *229 R 4.5820 8.8368 123.7162 55.4074 30.7996 172.9721 230 D 4.3854 8.6443 123.8429 54.3218 39.2548 174.0309 231 V 4.0287 8.4610 119.2831 62.8858 32.5439 175.1982 232 Q 4.4535 8.6370 125.3226 57.9465 30.1140 175.7252 233 E 4.8222 7.6505 118.5931 54.8583 33.5002 173.7642 234 I 4.7043 8.4658 127.0175 59.3096 40.3351 174.3329 235 R 4.7847 8.5453 127.2810 54.5384 32.8895 173.7467 236 Y 5.4352 8.7354 123.8041 56.4421 41.4375 174.4403 237 E 4.9366 8.6722 118.4333 55.0665 33.4888 174.7614 238 V 4.0946 8.3812 121.5665 63.1105 32.0490 175.7640 239 S 4.3927 9.0354 123.2341 58.1167 62.4441 174.2896 240 A 4.1367 8.7438 128.1542 54.6605 18.5351 178.4013 241 K 4.4174 7.9021 114.8274 56.0513 33.0187 176.2414 242 K 4.8938 8.2103 119.4664 54.7321 36.3810 175.1974 243 I 4.3585 8.2496 122.1478 60.0967 39.9689 173.9501 244 H 5.4017 8.7213 125.4431 54.1268 31.7739 173.0438 245 F 5.3004 9.7411 121.8235 55.6316 41.8996 174.8096 246 A 4.2782 8.6381 125.1942 51.2583 19.0359 176.8910 247 R 4.7812 8.7948 121.6350 55.1395 32.8853 177.1324 248 F 4.8085 9.0815 120.7498 57.2256 39.9384 174.9008 249 R 4.4752 7.3707 115.7006 55.1107 31.4974 174.0443 250 S 4.1571 8.5784 113.3910 57.9872 62.5142 173.1359 251 F 4.1049 8.9049 130.9409 57.7030 39.8390 174.6800 252 P 4.5756 0.0000 0.0000 61.0228 28.0989 175.7489 253 F 4.1835 8.0610 126.6132 62.2723 39.8884 176.2328 254 W 4.3228 8.0637 117.6082 59.5990 28.7744 178.3360 255 R 4.0162 7.9973 118.4038 59.1315 29.5871 178.5734 256 R 3.7432 7.6406 118.1942 58.8343 29.9064 178.8966 257 V 3.9542 7.6977 118.1771 66.4139 31.5214 177.5310 258 H 4.1607 8.2704 117.7522 59.6155 29.5732 177.0461 259 D 4.5351 8.1288 118.9562 56.7285 40.5970 178.5230 260 S 3.9105 7.6121 115.1948 60.4226 63.1145 175.4830 261 F 4.8020 7.9218 118.1951 58.7176 40.1848 177.0323 262 I 3.9353 8.7863 118.9525 63.6471 37.7495 175.6353 263 E 4.0202 6.7705 121.7424 55.3943 30.3321 176.4356 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 M 8.16 4.68 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 2 K 8.75 4.44 0.00 1.60 1.57 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.40 7.81 3 Y 8.32 5.10 0.00 2.82 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 4 M 8.56 3.80 0.00 1.63 1.73 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.22 0.00 5 I 8.23 5.24 2.13 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.13 1.10 0.00 0.00 6 T 9.30 4.81 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 1.31 0.00 0.00 7 S 8.90 6.10 0.00 3.96 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 8 K 8.76 4.13 0.00 1.84 2.05 0.00 1.62 0.00 0.00 1.81 0.00 0.00 3.01 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.48 1.67 7.81 9 G 8.01 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 D 8.05 4.64 0.00 2.94 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 11 E 8.65 3.93 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 12 K 8.05 3.88 0.00 1.90 2.06 0.00 1.62 0.00 0.00 1.83 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.63 7.81 13 S 8.21 4.26 0.00 4.09 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 14 D 8.09 4.36 0.00 3.02 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 15 L 8.70 4.10 0.00 1.89 1.94 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 16 L 7.98 3.94 0.00 1.91 1.74 0.92 0.90 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 17 R 7.86 3.96 0.00 2.08 2.19 0.00 3.49 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.83 0.00 18 L 7.82 4.00 0.00 1.77 1.71 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.18 4.50 0.00 2.77 2.84 0.00 0.00 7.05 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 20 M 8.36 3.88 0.00 2.06 2.36 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.38 0.00 21 I 8.27 4.60 2.22 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 1.79 1.74 0.98 0.00 0.00 22 A 8.22 4.30 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.05 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 24 F 8.58 4.71 0.00 3.31 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 25 G 7.94 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 0.00 0.00 0.00 26 E 7.90 4.14 0.00 1.53 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 2.32 2.54 0.00 27 Y 7.54 4.72 0.00 3.10 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 28 D 8.54 4.77 0.00 2.70 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 29 M 7.90 5.06 0.00 1.72 1.95 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.63 0.00 30 E 8.88 4.74 0.00 2.08 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 2.18 2.23 0.00 31 Y 8.63 3.44 0.00 2.85 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.09 4.40 0.00 2.49 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.71 4.55 0.00 2.90 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.97 4.00 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 0.85 0.00 0.00 0.94 0.00 0.00 35 E 8.32 4.68 0.00 1.98 1.86 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 2.16 2.16 0.00 36 P 0.00 4.26 0.00 1.87 1.81 0.00 3.55 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.21 0.00 37 E 8.44 4.41 0.00 2.03 1.95 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 2.20 2.18 0.00 38 I 7.34 4.69 1.72 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.10 0.74 0.00 0.00 39 V 7.84 4.36 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 0.85 0.00 0.00 -0.00 0.00 0.00 40 I 8.48 4.96 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.43 1.00 0.00 0.00 41 S 9.62 5.27 0.00 3.99 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 10.22 4.88 1.96 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.72 0.99 0.00 0.00 43 G 9.35 3.35 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 0.00 44 G 8.19 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 45 D 8.54 4.71 0.00 2.91 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 46 G 8.14 3.66 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 0.00 0.00 0.00 47 T 7.95 4.06 4.55 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 1.31 0.00 0.00 48 F 8.36 4.12 0.00 3.29 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.34 3.97 0.00 2.11 1.92 0.98 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.11 4.17 0.00 4.00 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 51 A 8.04 4.06 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 7.88 3.79 0.00 2.31 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 53 H 8.34 4.13 0.00 3.20 3.34 0.00 5.71 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 7.89 3.92 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.41 0.00 0.00 0.00 0.00 0.00 1.82 1.35 0.00 55 Y 7.54 4.67 0.00 3.08 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 56 E 7.94 3.85 0.00 1.81 1.43 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 2.27 2.20 0.00 57 E 7.99 4.22 0.00 1.95 2.01 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 2.25 2.23 0.00 58 R 7.89 4.71 0.00 1.87 1.83 0.00 3.12 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 59 L 8.35 4.06 0.00 1.66 1.97 0.78 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 60 D 8.01 4.57 0.00 2.64 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.24 4.57 0.00 1.88 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 2.21 2.35 0.00 62 I 7.57 4.61 1.79 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.44 0.03 0.00 0.00 63 A 8.61 4.88 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 64 F 9.23 4.91 0.00 2.65 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 65 I 9.24 5.34 1.99 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.81 1.19 0.00 0.00 66 G 9.19 4.92 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 0.00 0.00 0.00 67 I 9.49 5.24 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.95 1.09 0.00 0.00 68 H 9.40 5.31 0.00 3.25 3.13 0.00 5.77 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.59 4.06 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 1.23 0.00 0.00 70 G 7.10 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 0.00 0.00 0.00 71 H 8.76 4.09 0.00 3.06 3.13 0.00 5.69 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 72 L 8.38 3.90 0.00 1.45 1.80 0.81 1.06 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 73 G 6.17 3.48 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 74 F 8.39 4.62 0.00 2.62 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 75 Y 7.65 4.57 0.00 2.67 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 76 A 7.79 5.00 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 77 D 8.89 4.85 0.00 2.78 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 W 8.02 5.13 0.00 3.43 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 79 R 8.56 5.21 0.00 2.04 1.85 0.00 3.16 0.00 0.00 3.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.53 0.00 80 P 0.00 4.23 0.00 2.18 2.16 0.00 3.65 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 81 A 8.10 4.17 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.40 4.55 0.00 2.51 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 83 A 8.56 3.87 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 84 D 7.95 4.21 0.00 2.81 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 85 K 7.98 3.96 0.00 2.16 1.99 0.00 1.82 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.47 7.81 86 L 7.16 2.77 0.00 0.27 1.03 0.06 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 87 V 7.08 2.88 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 0.45 0.00 0.00 0.21 0.00 0.00 88 K 7.31 3.59 0.00 1.92 1.77 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.26 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.49 1.61 7.81 89 L 7.87 4.01 0.00 1.34 1.62 1.01 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.24 4.34 0.00 1.93 1.77 0.86 1.08 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 91 A 7.61 4.00 0.69 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 0.00 0.00 92 K 8.02 4.26 0.00 1.97 1.95 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.71 1.58 7.81 93 G 8.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.37 4.46 0.00 2.26 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 2.36 2.31 0.00 95 Y 6.88 4.93 0.00 2.36 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 0.00 0.00 0.00 96 Q 8.76 4.71 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.05 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 97 K 8.68 5.31 0.00 1.76 1.83 0.00 1.83 0.00 0.00 2.26 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.60 1.49 7.81 98 V 8.43 4.69 2.20 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 1.13 0.00 0.00 1.03 0.00 0.00 99 S 8.95 5.50 0.00 3.85 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 0.00 100 Y 8.81 5.08 0.00 2.91 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 0.00 101 P 0.00 4.81 0.00 1.93 1.99 0.00 3.61 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 2.16 2.11 0.00 102 L 8.42 4.95 0.00 1.63 1.78 1.17 0.37 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 0.00 103 L 8.48 5.11 0.00 1.79 1.54 0.99 0.58 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 0.00 104 K 9.19 4.96 0.00 1.89 1.83 0.00 1.63 0.00 0.00 1.80 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.43 7.81 105 T 9.13 5.12 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 106 T 8.68 4.95 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 107 V 9.19 4.43 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 0.58 0.00 0.00 0.89 0.00 0.00 108 K 8.74 4.48 0.00 1.55 1.60 0.00 1.63 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.29 7.81 109 Y 8.42 4.56 0.00 2.84 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 *114 K 7.75 4.28 0.00 1.47 1.73 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.02 7.81 115 E 8.66 5.12 0.00 1.94 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 2.16 2.27 0.00 116 A 9.19 4.77 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 0.00 117 T 8.00 4.93 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 1.13 0.00 0.00 118 Y 9.09 4.90 0.00 2.87 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 0.00 119 L 8.87 5.31 0.00 1.65 1.84 0.94 0.91 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 0.00 120 A 9.05 5.05 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 L 8.83 3.58 0.00 0.34 1.31 0.52 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.10 0.00 149 G 7.97 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 D 8.82 4.47 0.00 2.95 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 0.00 151 G 7.19 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 L 8.01 5.25 0.00 1.49 1.38 0.74 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 153 C 8.81 5.01 0.00 2.93 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 0.00 154 M 8.84 4.88 0.00 1.16 0.81 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.92 0.00 155 S 8.80 5.25 0.00 3.85 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 0.00 156 T 8.66 4.39 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 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0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 P 0.00 3.87 0.00 0.49 1.04 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.74 0.00 175 S 7.52 4.25 0.00 4.00 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 0.00 176 I 7.17 3.82 1.80 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.51 0.88 0.00 0.00 177 E 8.61 4.20 0.00 2.02 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 178 A 7.70 4.92 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 0.00 179 M 9.15 5.02 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 180 Q 8.96 5.00 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.18 2.33 0.00 181 L 9.10 5.15 0.00 1.88 1.67 0.85 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 182 T 9.00 4.99 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 1.21 0.00 0.00 183 E 8.63 4.85 0.00 2.08 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 0.00 2.55 2.43 0.00 184 M 8.93 4.51 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.36 0.00 185 A 8.53 3.64 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 S 7.89 3.97 0.00 4.04 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 0.00 187 I 8.44 3.63 1.74 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.67 0.92 0.00 0.00 188 N 8.04 4.37 0.00 2.75 2.77 0.00 0.00 7.21 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 N 7.41 5.15 0.00 2.84 2.85 0.00 0.00 6.26 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 0.00 190 R 8.80 3.98 0.00 1.77 1.98 0.00 3.21 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 191 V 7.72 3.56 1.70 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 0.02 0.00 0.00 0.79 0.00 0.00 192 Y 8.00 4.99 0.00 3.04 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 0.00 193 R 7.92 4.21 0.00 1.78 1.86 0.00 3.30 0.00 0.00 3.44 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.54 0.00 194 T 8.35 4.97 4.69 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 1.44 0.00 0.00 195 I 8.61 3.82 2.18 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 1.43 0.79 1.18 0.00 0.00 196 G 8.55 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 0.00 197 S 7.69 4.30 0.00 3.89 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 0.00 198 P 0.00 4.62 0.00 1.92 2.00 0.00 3.59 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 1.99 2.09 0.00 199 L 8.69 4.45 0.00 1.47 0.83 0.74 0.54 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 0.00 200 V 8.00 4.57 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.84 0.00 0.00 201 F 9.28 4.91 0.00 2.97 2.91 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 0.00 202 P 0.00 5.21 0.00 2.03 2.03 0.00 3.27 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 1.65 1.63 0.00 203 K 8.42 3.90 0.00 1.75 1.56 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.23 1.39 7.81 204 H 8.67 4.41 0.00 3.45 3.50 0.00 5.75 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 H 7.86 4.76 0.00 3.36 3.28 0.00 5.61 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 0.00 206 V 9.26 4.58 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.86 0.00 0.00 207 V 8.51 4.53 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 0.69 0.00 0.00 -0.11 0.00 0.00 208 S 9.17 5.03 0.00 3.79 3.61 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 0.00 209 L 9.03 5.03 0.00 1.39 1.42 1.03 0.80 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 0.00 210 Q 8.86 4.94 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.92 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 211 P 0.00 4.78 0.00 2.24 2.65 0.00 3.94 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 2.08 2.46 0.00 212 V 8.24 3.81 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 0.82 0.00 0.00 1.00 0.00 0.00 213 N 8.44 4.81 0.00 2.69 2.48 0.00 0.00 6.60 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 0.00 214 D 8.12 4.56 0.00 2.54 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 K 8.61 4.65 0.00 1.48 1.77 0.00 1.83 0.00 0.00 1.85 0.00 0.00 2.78 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.39 1.00 7.81 216 D 7.50 5.22 0.00 2.50 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 F 8.85 5.05 0.00 3.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 Q 9.30 4.58 0.00 2.22 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 219 I 8.79 5.03 1.92 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.96 0.88 0.00 0.00 220 S 9.05 5.13 0.00 3.70 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 0.00 221 V 8.23 4.37 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.73 0.00 0.00 222 D 9.91 4.37 0.00 2.80 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *223 H 7.88 3.10 0.00 3.00 3.07 0.00 7.19 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 0.00 224 L 6.89 4.51 0.00 1.53 1.59 0.92 0.84 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 0.00 225 S 8.49 4.97 0.00 3.85 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 0.00 226 I 9.23 4.45 1.85 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 0.97 0.96 0.73 0.00 0.00 227 L 8.60 4.71 0.00 1.67 1.63 0.94 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 228 H 9.25 4.89 0.00 3.32 3.52 0.00 5.65 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *229 R 8.84 4.58 0.00 1.59 1.71 0.00 3.41 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.18 0.00 230 D 8.64 4.39 0.00 2.85 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 0.00 231 V 8.46 4.03 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 1.15 0.00 0.00 232 Q 8.64 4.45 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.31 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 233 E 7.65 4.82 0.00 1.95 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.24 0.00 234 I 8.47 4.70 1.55 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.33 0.36 0.00 0.00 235 R 8.55 4.78 0.00 1.66 1.56 0.00 2.95 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.46 0.00 236 Y 8.74 5.44 0.00 2.75 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 E 8.67 4.94 0.00 2.03 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 2.18 2.23 0.00 238 V 8.38 4.09 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 0.76 0.00 0.00 0.94 0.00 0.00 239 S 9.04 4.39 0.00 3.93 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 0.00 240 A 8.74 4.14 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 K 7.90 4.42 0.00 1.82 1.79 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.43 7.81 242 K 8.21 4.89 0.00 1.52 1.75 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.43 7.81 243 I 8.25 4.36 1.85 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.37 0.90 0.00 0.00 244 H 8.72 5.40 0.00 3.34 3.21 0.00 5.63 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 F 9.74 5.30 0.00 2.80 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 0.00 246 A 8.64 4.28 0.42 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 0.00 247 R 8.79 4.78 0.00 1.91 2.09 0.00 3.40 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 248 F 9.08 4.81 0.00 3.31 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 249 R 7.37 4.48 0.00 1.88 1.93 0.00 2.94 0.00 0.00 2.98 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 250 S 8.58 4.16 0.00 3.90 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 0.00 251 F 8.90 4.10 0.00 3.04 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 0.00 252 P 0.00 4.58 0.00 2.12 2.06 0.00 2.47 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 253 F 8.06 4.18 0.00 3.15 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 0.00 254 W 8.06 4.32 0.00 3.49 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 0.00 255 R 8.00 4.02 0.00 1.85 1.83 0.00 3.10 0.00 0.00 3.27 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 256 R 7.64 3.74 0.00 1.71 1.22 0.00 2.94 0.00 0.00 2.81 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.38 0.00 257 V 7.70 3.95 2.38 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 1.35 0.00 0.00 0.51 0.00 0.00 258 H 8.27 4.16 0.00 3.37 3.50 0.00 5.83 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 0.00 259 D 8.13 4.54 0.00 2.56 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 0.00 260 S 7.61 3.91 0.00 3.50 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 0.00 261 F 7.92 4.80 0.00 3.15 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 262 I 8.79 3.94 1.59 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.82 0.87 0.00 0.00 263 E 6.77 4.02 0.00 2.08 1.95 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 2.20 2.24 0.00 * Residues marked with a * may have inaccurate shift predictions.