NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 A 4.3910 8.1227 122.4662 51.4260 21.3565 176.0494 16 S 5.2511 7.8577 108.4111 54.8838 64.7448 171.4859 17 S 4.7410 9.8416 121.1019 57.5731 66.9713 173.0133 18 S 5.3491 8.1521 116.6977 56.8976 66.3534 173.0319 19 W 5.6245 8.8114 121.0123 55.4714 33.7200 173.6697 20 Q 5.1761 9.2303 123.7614 54.5238 32.1891 174.3712 21 N 5.7201 9.1016 123.6875 50.3094 39.7720 175.7052 22 Q 4.0729 8.7092 116.5081 59.0018 28.3017 177.7345 23 S 4.3892 8.4092 113.0051 58.3465 63.1721 175.0748 24 G 3.9578 8.5354 109.5976 45.1895 0.0000 174.1477 25 S 4.5870 7.8344 115.6927 58.7014 64.4680 173.2595 26 T 5.2720 8.6922 118.9224 62.1057 72.5839 172.9559 27 M 5.0660 9.0162 121.4512 53.6285 35.7211 173.4991 28 I 5.1829 8.3109 119.4168 59.1719 41.3445 174.1188 29 I 5.0586 9.1244 122.4161 59.2461 40.9158 173.9915 30 Q 5.6572 9.1756 124.3692 53.5620 31.3022 174.5230 31 V 4.7125 8.3450 123.8240 61.5410 32.6532 175.3209 32 D 4.7551 8.6335 129.0597 52.2177 41.5980 176.6110 33 S 4.1514 8.1414 111.9847 59.8240 63.3396 174.3870 34 F 4.7124 8.4461 119.6149 57.1489 39.2056 176.4863 35 G 3.9786 8.0853 108.7407 45.7373 0.0000 173.4626 36 N 5.1074 8.1965 116.8695 52.9576 40.3307 174.0184 37 V 5.0736 8.5938 121.8039 61.2486 34.6124 174.5668 38 S 4.9602 9.4629 121.2296 56.3297 66.8736 174.6605 39 G 4.1219 6.9154 105.9894 46.1686 0.0000 171.0558 40 Q 5.1609 7.7531 117.6980 54.4595 34.0478 173.4717 41 Y 4.9720 9.2280 121.8407 55.8412 42.3338 174.1636 42 V 4.8146 8.9845 127.3615 61.1681 34.2286 173.6063 43 N 5.1428 9.1991 127.2866 52.6486 40.1946 175.1997 44 R 4.8068 8.9856 124.4349 55.6584 31.4781 175.1344 45 A 4.2034 8.2043 122.8411 51.3344 18.8599 178.1700 46 Q 3.9715 8.4703 121.9857 57.5745 29.1471 177.0245 47 G 3.8742 9.0203 109.5610 45.3455 0.0000 172.9617 48 T 4.2694 7.0258 109.1820 59.5592 70.8939 174.2386 49 G 3.7198 7.9290 111.3921 45.0645 0.0000 173.5824 50 C 4.5619 8.8812 113.4051 57.0809 37.8800 173.7507 51 Q 4.8122 7.8917 116.3507 55.8177 30.6048 175.5992 52 N 4.2250 8.6687 115.6573 53.6569 36.5573 175.1761 53 S 4.6314 7.7718 109.3320 56.4554 65.8269 172.8028 54 P 4.6066 0.0000 0.0000 63.2837 31.7675 175.1320 55 Y 4.7556 8.7555 121.3454 55.1092 41.1977 173.5398 56 P 4.7905 0.0000 0.0000 62.8832 32.1252 175.4180 57 L 4.9919 8.7980 124.8733 53.6082 45.3606 175.0705 58 T 4.8383 8.6826 119.4871 61.0756 71.6625 173.0221 59 G 4.2891 8.3025 111.3710 46.3137 0.0000 172.0388 60 R 5.3572 9.0300 117.5441 54.6586 34.7228 175.1413 61 V 4.9709 8.4771 114.2179 59.9079 35.4159 175.8427 62 N 4.7510 9.3632 122.3066 52.9280 41.2635 176.0172 63 G 3.9322 8.3008 118.2116 47.3459 0.0000 172.7335 64 T 4.2706 8.7943 120.0830 61.5329 67.4007 172.8408 65 F 5.3446 8.1412 119.1737 56.6199 42.5260 174.1705 66 I 4.9959 8.5286 118.3058 60.3356 41.9325 173.0080 67 A 5.3840 9.0214 129.1391 50.3085 22.6067 175.0073 68 F 5.5012 8.8788 115.4029 55.5215 42.2987 173.6294 69 S 5.3058 9.6456 114.8632 56.9977 67.3862 173.4903 70 V 4.5746 8.8706 122.6469 61.1224 34.8437 174.0620 71 G 3.9971 8.4345 114.8612 44.3876 0.0000 174.7150 72 W 4.2567 8.1891 127.7689 55.0771 27.3614 175.2186 73 N 5.4185 8.0279 117.1344 52.1759 41.6123 173.2324 74 N 4.9713 9.1707 120.5091 52.2015 38.7461 176.2525 75 S 4.3107 8.5083 112.9260 59.2784 62.6001 170.7268 76 T 4.1845 7.9761 117.1882 65.4419 68.7890 174.9659 77 E 4.5842 8.6349 122.0234 54.5580 32.5302 172.9788 78 N 5.2095 8.9386 124.8523 52.4383 40.1205 174.7731 79 C 4.5295 9.3170 123.1048 56.1991 39.9460 172.8023 80 N 4.0704 8.5387 118.9880 52.5680 36.8441 172.2772 81 S 5.1762 7.4550 111.6107 57.9375 66.3205 174.9246 82 A 5.1137 8.7087 125.7348 51.2788 23.0253 175.3117 83 T 4.9472 9.1057 116.4619 61.6537 72.9533 173.4331 84 G 4.4274 8.5590 111.6312 44.1712 0.0000 171.6927 85 W 5.3937 9.0219 122.4805 54.9736 33.1110 174.8607 86 T 5.0150 8.8693 118.9990 62.5833 72.5095 173.0452 87 G 5.0174 9.2758 113.5325 47.2076 0.0000 171.3382 88 Y 5.3309 7.7158 117.8777 55.0655 41.7716 174.8167 89 A 4.8513 8.6784 124.1595 51.9714 19.6010 176.9679 90 Q 4.5186 9.3341 118.8341 54.5906 32.6662 174.7578 91 V 4.5116 8.5070 121.9524 61.2655 31.1255 176.0215 92 N 4.7679 8.8439 132.4755 51.9750 39.4229 177.1583 93 G 3.8157 8.5004 112.2706 46.6425 0.0000 174.0666 94 N 4.5252 9.3535 120.0042 55.4664 39.8687 175.4185 95 N 4.6742 8.0439 116.1812 53.0002 39.7165 173.4405 96 T 5.2571 8.5501 116.7479 60.3944 70.6435 172.3360 97 E 5.4942 9.2908 126.6568 54.7460 34.1027 174.8737 98 I 4.6994 8.9826 123.9601 59.6397 39.5143 174.9749 99 V 4.3527 7.9534 129.0089 62.2069 32.3338 175.0230 100 T 5.3522 9.2077 117.9775 60.1447 72.5942 172.9641 101 S 5.0672 8.9593 118.1356 56.6711 66.6181 173.1986 102 W 5.5853 8.3977 118.1030 55.0759 31.9351 173.5124 103 N 5.6480 8.9668 117.6539 51.4809 42.4236 173.2955 104 L 5.0833 9.1746 123.2389 53.4450 45.3025 174.7488 105 A 5.4393 9.0350 129.0944 50.6387 21.4778 174.9167 106 Y 5.1062 8.3045 118.9566 55.8017 42.2188 173.3568 107 E 4.1760 8.5245 121.0878 56.1642 29.7096 176.3385 108 G 4.2457 8.7434 119.4170 44.3852 0.0000 173.3035 109 G 3.4535 8.6474 107.0795 47.2164 0.0000 174.9946 110 S 4.3681 8.7319 113.2243 58.8692 64.5494 174.4283 111 G 3.6293 6.7445 107.9719 44.0235 0.0000 170.7452 112 P 4.7443 0.0000 0.0000 62.9280 32.2707 175.6621 113 A 4.4773 8.2625 123.0940 51.0292 23.4156 175.2603 114 I 4.9736 8.0401 118.9200 59.7583 40.3794 174.7550 115 E 4.6858 9.5954 129.0474 54.8545 31.5292 174.8448 116 Q 4.6324 8.2143 124.7151 54.8906 31.3855 174.9336 117 G 2.6781 6.6969 106.6714 45.8494 0.0000 171.9673 118 Q 4.9843 8.1201 116.8511 54.4921 33.1098 174.6572 119 D 5.1051 9.0395 121.0059 53.1801 45.6228 174.3726 120 T 5.0156 9.0698 119.8816 61.9658 71.0691 173.3118 121 F 5.1449 9.4437 125.9231 56.1242 41.3540 174.8036 122 Q 4.9992 10.0780 123.9534 54.4608 30.5473 174.6885 123 Y 3.4123 9.2779 126.2937 57.8925 39.3933 175.6375 124 V 3.6522 7.0326 127.5276 60.6178 31.7715 173.5700 125 P 4.0790 0.0000 0.0000 65.2629 31.5762 179.4086 126 T 4.4620 7.3371 107.8212 62.1175 68.3463 173.6944 127 T 3.3000 8.6042 105.8405 62.9170 68.3355 171.6758 128 E 4.0118 7.6080 127.4325 57.3633 31.1303 174.5041 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 15 A 8.12 4.39 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.86 5.25 0.00 4.14 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 9.84 4.74 0.00 3.97 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 18 S 8.15 5.35 0.00 3.48 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 W 8.81 5.62 0.00 3.20 3.24 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 20 Q 9.23 5.18 0.00 2.12 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.61 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 21 N 9.10 5.72 0.00 2.44 1.44 0.00 0.00 6.59 7.05 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 22 Q 8.71 4.07 0.00 2.19 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.98 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 23 S 8.41 4.39 0.00 4.05 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 24 G 8.54 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 0.00 0.00 0.00 25 S 7.83 4.59 0.00 4.07 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 26 T 8.69 5.27 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 1.14 0.00 0.00 27 M 9.02 5.07 0.00 1.66 1.92 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.11 0.00 28 I 8.31 5.18 1.84 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 1.33 0.91 0.00 0.00 29 I 9.12 5.06 1.74 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.83 0.54 0.00 0.00 30 Q 9.18 5.66 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.82 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 31 V 8.35 4.71 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.94 0.00 0.00 32 D 8.63 4.76 0.00 2.95 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 33 S 8.14 4.15 0.00 3.62 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 34 F 8.45 4.71 0.00 3.12 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 35 G 8.09 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.20 5.11 0.00 3.12 2.80 0.00 0.00 6.47 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 37 V 8.59 5.07 2.16 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 0.86 0.00 0.00 0.93 0.00 0.00 38 S 9.46 4.96 0.00 3.86 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 39 G 6.92 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 0.00 0.00 0.00 40 Q 7.75 5.16 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 41 Y 9.23 4.97 0.00 2.97 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 42 V 8.98 4.81 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.96 0.00 0.00 43 N 9.20 5.14 0.00 3.13 3.03 0.00 0.00 6.94 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 44 R 8.99 4.81 0.00 1.81 1.87 0.00 3.35 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.55 0.00 45 A 8.20 4.20 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 46 Q 8.47 3.97 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.53 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 47 G 9.02 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 48 T 7.03 4.27 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 1.02 0.00 0.00 49 G 7.93 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 C 8.88 4.56 0.00 2.71 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 51 Q 7.89 4.81 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.87 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 52 N 8.67 4.22 0.00 2.88 2.90 0.00 0.00 6.69 7.62 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 53 S 7.77 4.63 0.00 3.88 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 54 P 0.00 4.61 0.00 2.06 2.03 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.95 0.00 55 Y 8.76 4.76 0.00 3.07 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 56 P 0.00 4.79 0.00 1.94 1.99 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 57 L 8.80 4.99 0.00 1.69 1.49 0.67 0.18 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 58 T 8.68 4.84 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 59 G 8.30 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 60 R 9.03 5.36 0.00 1.71 1.81 0.00 3.28 0.00 0.00 3.20 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.78 0.00 61 V 8.48 4.97 2.12 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 0.73 0.00 0.00 1.03 0.00 0.00 62 N 9.36 4.75 0.00 2.71 2.78 0.00 0.00 7.26 7.48 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 63 G 8.30 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 0.00 0.00 0.00 64 T 8.79 4.27 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 65 F 8.14 5.34 0.00 3.25 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 66 I 8.53 5.00 1.90 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.66 1.02 0.00 0.00 67 A 9.02 5.38 1.27 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 0.00 0.00 0.00 0.00 0.00 68 F 8.88 5.50 0.00 3.09 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 69 S 9.65 5.31 0.00 3.72 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 70 V 8.87 4.57 1.37 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 -0.25 0.00 0.00 0.77 0.00 0.00 71 G 8.43 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 0.00 0.00 0.00 72 W 8.19 4.26 0.00 3.23 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 73 N 8.03 5.42 0.00 2.80 2.74 0.00 0.00 7.05 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 74 N 9.17 4.97 0.00 2.84 2.74 0.00 0.00 6.38 7.05 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 75 S 8.51 4.31 0.00 4.21 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 76 T 7.98 4.18 4.44 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 0.00 0.00 0.00 1.24 0.00 0.00 77 E 8.63 4.58 0.00 2.09 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 2.28 2.30 0.00 78 N 8.94 5.21 0.00 2.93 2.77 0.00 0.00 7.15 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 79 C 9.32 4.53 0.00 3.00 3.06 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 80 N 8.54 4.07 0.00 2.98 2.85 0.00 0.00 6.57 7.25 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 81 S 7.46 5.18 0.00 4.13 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 82 A 8.71 5.11 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 83 T 9.11 4.95 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 -0.09 0.00 0.00 84 G 8.56 4.43 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 0.00 0.00 0.00 85 W 9.02 5.39 0.00 1.78 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 0.00 0.00 0.00 0.00 86 T 8.87 5.02 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 1.31 0.00 0.00 87 G 9.28 5.02 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 0.00 0.00 0.00 88 Y 7.72 5.33 0.00 2.43 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 89 A 8.68 4.85 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 90 Q 9.33 4.52 0.00 2.13 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 91 V 8.51 4.51 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 0.82 0.00 0.00 0.94 0.00 0.00 92 N 8.84 4.77 0.00 2.78 2.83 0.00 0.00 7.02 7.23 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 93 G 8.50 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 94 N 9.35 4.53 0.00 2.75 2.91 0.00 0.00 6.86 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.04 4.67 0.00 2.88 2.96 0.00 0.00 6.58 7.05 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 96 T 8.55 5.26 4.30 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 1.12 0.00 0.00 97 E 9.29 5.49 0.00 2.01 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 2.33 2.34 0.00 98 I 8.98 4.70 1.79 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 -0.13 0.81 0.00 0.00 99 V 7.95 4.35 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 0.00 0.00 0.96 0.00 0.00 0.81 0.00 0.00 100 T 9.21 5.35 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 101 S 8.96 5.07 0.00 3.75 3.64 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 0.00 102 W 8.40 5.59 0.00 2.62 2.36 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 0.00 103 N 8.97 5.65 0.00 2.63 2.72 0.00 0.00 6.64 6.58 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 0.00 104 L 9.17 5.08 0.00 1.68 1.75 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 105 A 9.04 5.44 1.26 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 0.00 0.00 0.00 106 Y 8.30 5.11 0.00 3.01 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 0.00 107 E 8.52 4.18 0.00 2.20 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 2.34 2.34 0.00 108 G 8.74 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 G 8.65 3.45 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 0.00 0.00 0.00 110 S 8.73 4.37 0.00 3.97 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 G 6.74 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.74 0.00 1.86 1.91 0.00 3.64 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.04 0.00 113 A 8.26 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 I 8.04 4.97 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.66 0.93 0.00 0.00 115 E 9.60 4.69 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 116 Q 8.21 4.63 0.00 1.75 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.57 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 117 G 6.70 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Q 8.12 4.98 0.00 1.84 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.64 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 119 D 9.04 5.11 0.00 2.99 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 T 9.07 5.02 4.27 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 0.00 0.00 1.31 0.00 0.00 121 F 9.44 5.14 0.00 3.00 3.17 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 0.00 122 Q 10.08 5.00 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.97 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 123 Y 9.28 3.41 0.00 2.44 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 0.00 124 V 7.03 3.65 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 0.62 0.00 0.00 0.84 0.00 0.00 125 P 0.00 4.08 0.00 1.94 2.04 0.00 3.44 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.99 0.00 126 T 7.34 4.46 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 1.15 0.00 0.00 127 T 8.60 3.30 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 1.10 0.00 0.00 128 E 7.61 4.01 0.00 1.93 1.88 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 2.21 2.20 0.00