NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2138 8.3144 121.7898 55.6327 33.0574 175.1308 2 E 3.7339 8.7500 126.2831 55.0822 30.0691 175.0713 3 S 4.3272 8.9046 122.7569 57.9578 66.2418 174.6331 4 A 4.0208 8.5939 124.6342 55.3510 18.1295 180.0122 5 A 3.9475 8.0117 118.5041 55.3495 18.4766 179.5930 6 A 3.9853 8.2194 119.3656 55.0866 18.3618 179.7315 7 K 4.0735 8.4501 119.9647 59.0718 32.2854 178.7282 8 F 4.0763 8.6016 121.1903 61.4266 39.4263 176.9745 9 E 4.0363 8.4709 118.2292 59.3080 29.0317 179.2912 10 R 3.8237 7.9755 117.9344 59.6676 30.2753 178.3371 11 Q 4.0173 8.0303 116.6191 58.0043 28.8465 176.4496 12 H 4.6607 7.8333 112.9497 54.8093 30.7982 172.9197 13 M 4.5724 7.6502 119.6417 53.7001 33.5299 176.2661 14 D 4.7412 8.1878 122.4966 52.5504 41.5760 174.6012 15 S 4.1213 8.1939 119.2325 61.7097 63.0728 175.0705 16 G 4.2319 8.7595 112.6403 44.2860 0.0000 173.6357 17 N 4.9788 7.5821 116.1018 51.4617 43.7967 173.7669 18 S 4.8395 8.1374 112.5520 55.7200 66.0210 173.4475 19 P 4.2976 0.0000 0.0000 65.4899 31.1427 177.7328 20 S 4.3700 7.5852 110.7921 58.8642 63.4061 174.5652 21 S 4.2865 7.6867 116.1280 58.7401 62.3476 173.7704 22 S 4.6001 8.5770 120.8860 59.1227 63.8062 175.7697 23 S 4.3300 8.1548 113.4014 58.8543 63.5672 174.7405 24 N 4.6597 7.9421 118.8544 54.0538 38.8757 175.1373 25 Y 4.0212 7.4909 120.9165 62.1262 38.7720 177.5622 26 C 4.1800 8.4485 117.0428 59.9099 38.5315 175.6967 27 N 4.4118 8.2554 117.6223 56.5946 38.1851 177.2423 28 L 4.0559 7.7163 119.9289 57.8966 41.6990 179.4366 29 M 3.7302 7.9152 119.0650 58.3510 31.6416 178.7060 30 M 4.0490 8.0925 119.2761 58.3055 32.0462 178.4635 31 C 4.1326 7.5982 118.7415 62.0975 31.6193 174.8943 32 C 3.9806 8.1943 119.1350 62.4368 31.0847 174.9629 33 R 4.4155 7.8756 116.6131 55.1445 30.1394 176.3014 34 K 3.8822 7.8016 116.4536 58.4364 29.9434 176.1858 35 M 4.5974 8.3581 115.5864 55.3958 32.0263 177.4061 36 T 4.6909 7.8482 107.3031 61.3740 69.5432 172.8119 37 Q 4.6719 8.2202 120.8589 56.1887 30.3141 174.7946 38 G 4.2195 10.7970 116.0873 45.0684 0.0000 173.2576 39 K 3.7087 7.0025 115.2485 55.0522 35.1774 175.4017 40 C 4.6564 8.5670 117.3298 55.7141 40.5625 173.9128 41 K 4.1597 8.6579 127.5439 55.8731 32.3317 174.8136 42 P 4.6900 0.0000 0.0000 65.4626 32.5883 176.5602 43 V 5.0183 7.6186 118.6093 61.0856 34.6101 174.1115 44 N 4.7867 9.2268 125.2946 52.5160 42.7980 172.8119 45 T 4.7897 7.7289 121.4142 61.6311 71.1072 173.3595 46 F 4.7429 8.9084 124.7718 55.7199 41.7023 174.7098 47 V 4.5276 8.3988 122.3081 61.6965 32.9820 174.8991 48 H 4.9464 9.0149 123.6330 55.6848 29.7163 174.7303 49 E 4.2710 8.1542 118.4210 55.3895 30.3890 177.0804 50 S 4.3366 8.3162 115.0375 58.3301 64.9122 174.9192 51 L 3.9473 8.5306 124.2672 58.3330 41.8009 179.1801 52 A 3.9908 7.9695 120.1618 55.3366 18.1675 179.0950 53 D 4.3031 7.9790 116.1387 57.5586 41.2993 179.0354 54 V 3.7610 7.8698 118.6909 65.9463 31.5648 178.1956 55 K 3.9387 8.5379 118.5000 59.4405 31.8771 179.0783 56 A 4.0293 8.2411 120.8899 54.8599 18.1077 179.7069 57 V 3.7559 7.7104 116.7195 66.2534 31.2980 177.2240 58 C 3.8001 7.9992 115.2253 58.2187 39.9426 174.2964 59 S 4.5655 7.4913 113.8780 57.9133 63.6699 174.7304 60 Q 4.7063 7.5839 121.2398 55.8902 31.1203 176.3139 61 K 4.1906 8.4939 127.9372 56.9999 33.2338 177.1740 62 K 4.1149 8.7729 128.0029 56.8296 32.3764 176.7852 63 V 4.6288 8.0539 117.5998 59.2140 36.2354 175.4630 64 T 3.9331 8.2928 112.3690 61.7960 69.4006 175.1444 65 C 4.6355 8.1764 122.1839 56.2115 41.0727 175.0282 66 K 3.7318 9.3745 123.6397 59.3838 31.7321 177.7556 67 N 4.5961 8.1419 113.5633 52.4483 37.4337 176.0558 68 G 3.8962 8.1664 107.2846 45.8446 0.0000 174.1423 69 Q 4.2912 8.2995 119.4593 56.1431 29.3078 176.0721 70 T 4.7211 8.1732 107.5870 61.8260 69.2101 173.8557 71 N 5.0638 8.0815 116.8583 53.9509 38.9153 173.9337 72 C 5.3688 7.9520 115.9182 56.7392 44.3256 172.3498 73 Y 5.2613 8.9046 118.6449 56.5121 42.0190 173.7799 74 Q 5.1575 9.2683 125.1033 54.1055 31.3801 174.9885 75 S 4.6222 8.8809 121.9687 58.2243 63.1861 174.8679 76 K 4.1515 9.3787 122.3702 59.1718 32.6974 176.9248 77 S 5.0331 7.6319 113.4178 56.0253 66.5012 174.1912 78 T 4.0572 8.2785 111.3394 62.3809 69.4573 173.3598 79 M 5.0100 8.9359 122.0765 53.4149 36.6744 175.1510 80 R 4.5483 9.4531 121.7582 56.2158 31.1375 175.8390 81 I 5.0947 8.9261 117.2661 59.3831 42.0549 174.2478 82 T 5.0387 9.1452 118.9181 61.9662 71.8944 172.9427 83 D 4.9076 9.1254 127.0121 53.5102 42.8950 174.7807 84 C 5.5287 9.3332 121.3918 55.3783 40.3121 173.0954 85 R 5.2161 8.8907 123.1399 53.8701 33.1777 174.8692 86 E 4.0347 9.3223 126.6190 56.5023 29.9933 177.0139 87 T 4.2631 8.2282 117.4431 60.7660 69.9058 175.1562 88 G 3.7090 8.4514 111.0391 48.5986 0.0000 175.4553 89 S 4.1902 7.9600 115.2860 60.9240 63.1866 174.9521 90 S 4.0209 7.4034 114.4792 58.4903 62.5709 173.3953 91 K 4.5064 8.3301 126.8925 54.3453 34.7739 174.7474 92 Y 4.2966 8.7999 127.5281 57.6571 39.0482 174.0177 93 P 3.1239 0.0000 0.0000 62.8758 32.5512 176.7082 94 N 4.5086 7.6737 119.6552 52.3662 36.8085 172.7488 95 C 4.3590 8.0136 115.1615 56.7612 39.5181 173.0580 96 A 5.0960 8.3446 127.4044 50.3632 20.9841 174.9988 97 Y 5.1341 9.4180 119.0086 55.9794 42.0205 175.0853 98 K 4.4852 9.2646 124.2009 55.9626 34.1259 175.3088 99 T 5.1485 8.5512 123.3722 62.3533 70.4009 173.9626 100 T 4.5943 8.7760 122.9342 61.7666 71.7930 173.1251 101 Q 4.5736 8.7557 126.2429 55.4039 29.6865 175.9201 102 V 4.5662 8.9117 116.6256 59.6327 36.5827 174.8067 103 E 5.5033 8.7458 121.6089 53.7475 31.4969 175.1494 104 K 4.7900 8.2609 122.6695 54.3579 37.4481 175.5638 105 H 4.7117 8.7675 118.9886 56.0692 29.7940 174.9303 106 I 4.7810 8.5507 115.7737 59.3885 40.6300 174.3805 107 I 4.8966 8.3473 124.3659 59.6992 39.9334 175.1226 108 V 4.7758 8.6129 119.4199 59.2731 35.8445 174.6055 109 A 4.9625 8.9692 125.1888 51.5491 20.2190 175.8840 110 C 5.4556 9.0241 119.1487 55.6003 44.7212 173.3882 111 G 3.9441 9.2318 107.8253 46.7038 0.0000 173.4523 112 G 4.3386 9.0862 106.8521 44.9255 0.0000 172.7422 113 K 4.5968 8.0505 116.7409 53.5635 34.2473 175.0581 114 P 4.3723 0.0000 0.0000 62.1496 31.9854 176.0622 115 S 4.6730 8.3162 114.8235 58.1773 62.7135 173.4845 116 V 4.6240 8.6625 119.7460 58.4326 36.2031 173.3179 117 P 4.7876 0.0000 0.0000 63.4514 31.0933 176.8734 118 V 4.5050 9.1623 116.0072 61.3636 34.1683 175.3310 119 H 4.8540 7.9998 119.4312 54.7320 33.4708 171.6908 120 F 4.5933 8.5610 127.7663 57.5065 39.5285 174.4325 121 D 4.6430 8.4275 126.8565 55.8465 42.0152 175.8122 122 A 4.6031 6.4307 117.6562 51.7245 22.1922 174.7713 123 S 5.2753 8.9257 113.4638 56.6515 66.4155 174.6897 124 V 4.1364 8.6596 119.9701 62.1443 31.5340 174.8979 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 K 8.31 4.21 0.00 1.74 1.79 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.39 7.81 2 E 8.75 3.73 0.00 2.12 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 3 S 8.90 4.33 0.00 4.10 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 4 A 8.59 4.02 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 5 A 8.01 3.95 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 6 A 8.22 3.99 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.45 4.07 0.00 1.94 2.04 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.31 7.81 8 F 8.60 4.08 0.00 3.17 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.47 4.04 0.00 2.26 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 0.00 2.49 2.69 0.00 10 R 7.98 3.82 0.00 1.76 2.07 0.00 3.22 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 1.58 1.63 0.00 11 Q 8.03 4.02 0.00 1.63 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.47 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 12 H 7.83 4.66 0.00 1.88 2.74 0.00 5.63 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 13 M 7.65 4.57 0.00 2.05 2.15 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 2.71 2.68 0.00 14 D 8.19 4.74 0.00 2.51 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.19 4.12 0.00 3.91 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.76 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 0.00 0.00 0.00 17 N 7.58 4.98 0.00 3.01 2.70 0.00 0.00 6.63 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 18 S 8.14 4.84 0.00 3.94 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 19 P 0.00 4.30 0.00 2.06 2.15 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 20 S 7.59 4.37 0.00 3.95 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 21 S 7.69 4.29 0.00 3.89 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 22 S 8.58 4.60 0.00 3.91 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 23 S 8.15 4.33 0.00 4.00 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 24 N 7.94 4.66 0.00 2.88 2.85 0.00 0.00 6.79 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 7.49 4.02 0.00 2.98 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 8.45 4.18 0.00 3.16 3.09 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 27 N 8.26 4.41 0.00 3.10 2.93 0.00 0.00 7.16 6.74 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 28 L 7.72 4.06 0.00 1.53 1.57 0.87 0.91 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 29 M 7.92 3.73 0.00 0.73 1.04 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.73 0.00 30 M 8.09 4.05 0.00 1.77 1.88 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 1.00 2.39 0.00 31 C 7.60 4.13 0.00 3.04 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 32 C 8.19 3.98 0.00 2.88 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 33 R 7.88 4.42 0.00 2.00 2.01 0.00 3.56 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.96 0.00 34 K 7.80 3.88 0.00 1.96 1.94 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.55 7.81 35 M 8.36 4.60 0.00 2.05 2.03 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 2.68 2.43 0.00 36 T 7.85 4.69 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 1.43 0.00 0.00 37 Q 8.22 4.67 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.77 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 38 G 10.80 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 39 K 7.00 3.71 0.00 1.63 1.46 0.00 1.52 0.00 0.00 1.64 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.22 1.41 7.81 40 C 8.57 4.66 0.00 3.25 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 41 K 8.66 4.16 0.00 1.84 1.80 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.21 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.40 7.81 42 P 0.00 4.69 0.00 2.19 2.31 0.00 3.73 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 43 V 7.62 5.02 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 0.79 0.00 0.00 0.97 0.00 0.00 44 N 9.23 4.79 0.00 2.63 2.24 0.00 0.00 6.66 7.21 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 45 T 7.73 4.79 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 0.90 0.00 0.00 46 F 8.91 4.74 0.00 3.04 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 47 V 8.40 4.53 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 0.86 0.00 0.00 1.05 0.00 0.00 48 H 9.01 4.95 0.00 3.12 3.28 0.00 5.71 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.15 4.27 0.00 1.99 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 2.34 2.26 0.00 50 S 8.32 4.34 0.00 4.05 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.53 3.95 0.00 1.80 1.72 0.94 1.16 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 52 A 7.97 3.99 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 53 D 7.98 4.30 0.00 2.81 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 54 V 7.87 3.76 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.03 0.00 0.00 55 K 8.54 3.94 0.00 1.94 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.59 7.81 56 A 8.24 4.03 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 57 V 7.71 3.76 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 1.19 0.00 0.00 1.00 0.00 0.00 58 C 8.00 3.80 0.00 2.89 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 59 S 7.49 4.57 0.00 3.90 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 60 Q 7.58 4.71 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.93 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 61 K 8.49 4.19 0.00 1.88 1.72 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.43 7.81 62 K 8.77 4.11 0.00 1.65 1.63 0.00 1.54 0.00 0.00 1.36 0.00 0.00 2.71 0.00 0.00 2.15 0.00 0.00 0.00 0.00 1.09 1.35 7.81 63 V 8.05 4.63 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 0.71 0.00 0.00 0.83 0.00 0.00 64 T 8.29 3.93 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 1.16 0.00 0.00 65 C 8.18 4.64 0.00 3.26 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 66 K 9.37 3.73 0.00 1.91 1.89 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.50 7.81 67 N 8.14 4.60 0.00 2.80 2.89 0.00 0.00 6.09 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.17 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.30 4.29 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 70 T 8.17 4.72 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 1.17 0.00 0.00 71 N 8.08 5.06 0.00 2.98 3.03 0.00 0.00 6.04 7.68 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 72 C 7.95 5.37 0.00 2.92 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 73 Y 8.90 5.26 0.00 2.87 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 74 Q 9.27 5.16 0.00 2.05 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 75 S 8.88 4.62 0.00 3.93 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 9.38 4.15 0.00 1.88 2.01 0.00 1.45 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.78 7.81 77 S 7.63 5.03 0.00 3.73 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 78 T 8.28 4.06 4.17 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 1.04 0.00 0.00 79 M 8.94 5.01 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 80 R 9.45 4.55 0.00 1.82 1.91 0.00 3.06 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 81 I 8.93 5.09 1.97 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.74 1.04 0.00 0.00 82 T 9.15 5.04 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 1.33 0.00 0.00 83 D 9.13 4.91 0.00 2.62 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 84 C 9.33 5.53 0.00 2.83 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 85 R 8.89 5.22 0.00 1.81 1.85 0.00 3.17 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 86 E 9.32 4.03 0.00 1.70 1.80 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 2.19 2.08 0.00 87 T 8.23 4.26 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 88 G 8.45 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 89 S 7.96 4.19 0.00 3.85 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 7.40 4.02 0.00 3.81 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.33 4.51 0.00 1.84 1.57 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.51 7.81 92 Y 8.80 4.30 0.00 2.95 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 93 P 0.00 3.12 0.00 1.75 1.01 0.00 3.63 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 94 N 7.67 4.51 0.00 2.93 2.77 0.00 0.00 6.97 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 95 C 8.01 4.36 0.00 3.12 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 96 A 8.34 5.10 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 9.42 5.13 0.00 2.94 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 98 K 9.26 4.49 0.00 1.84 1.73 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.45 7.81 99 T 8.55 5.15 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 1.30 0.00 0.00 100 T 8.78 4.59 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 1.23 0.00 0.00 101 Q 8.76 4.57 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 102 V 8.91 4.57 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.97 0.00 0.00 103 E 8.75 5.50 0.00 1.80 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 2.20 2.14 0.00 104 K 8.26 4.79 0.00 1.70 1.84 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.48 7.81 105 H 8.77 4.71 0.00 3.20 3.22 0.00 5.59 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.55 4.78 1.70 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.22 1.13 0.00 0.00 107 I 8.35 4.90 1.77 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 1.16 0.76 0.86 0.00 0.00 108 V 8.61 4.78 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.95 0.00 0.00 109 A 8.97 4.96 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 0.00 110 C 9.02 5.46 0.00 2.87 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 0.00 111 G 9.23 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 9.09 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.05 4.60 0.00 1.69 1.71 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.34 7.81 114 P 0.00 4.37 0.00 2.15 2.04 0.00 3.76 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 1.97 1.94 0.00 115 S 8.32 4.67 0.00 3.87 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 0.00 116 V 8.66 4.62 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 0.66 0.00 0.00 0.99 0.00 0.00 117 P 0.00 4.79 0.00 1.96 2.03 0.00 3.62 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 2.04 2.12 0.00 118 V 9.16 4.51 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.06 0.00 0.00 119 H 8.00 4.85 0.00 3.23 3.11 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.56 4.59 0.00 3.05 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 0.00 121 D 8.43 4.64 0.00 2.62 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 0.00 122 A 6.43 4.60 1.19 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 0.00 0.00 123 S 8.93 5.28 0.00 4.03 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 8.66 4.14 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 0.67 0.00 0.00 0.93 0.00 0.00