NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7132 8.3544 109.6530 44.8308 0.0000 173.1598 1 S 4.0214 6.7749 112.9070 55.2557 66.5871 171.5751 2 F 5.1858 9.4702 128.4444 57.2321 41.4734 174.3952 3 T 4.0227 7.2995 122.2140 60.5897 70.8935 171.7115 4 P 4.1327 0.0000 0.0000 62.6915 31.7657 177.5014 5 S 4.6368 7.7518 118.7321 55.3499 63.8008 173.5082 6 G 4.1562 7.5388 109.1951 46.2922 0.0000 169.1353 7 T 4.6251 7.8498 110.3293 61.2144 71.3177 173.4532 8 T 5.1028 8.4391 118.1551 61.8198 70.6720 174.4038 9 G 4.1979 9.2266 113.4442 44.6920 0.0000 172.0320 10 T 5.0286 8.5445 121.1310 62.0240 71.1344 173.7002 11 T 4.4334 8.8515 124.1449 62.1594 69.9959 173.8222 12 K 5.1825 8.5455 126.0117 54.6616 34.7531 175.8646 13 L 4.8208 9.0564 125.2893 54.1434 46.1833 174.3008 14 T 5.0971 8.8267 122.9900 62.0426 70.7057 173.4768 15 V 4.8004 9.1622 127.8032 61.9175 33.8006 174.9438 16 T 5.0711 8.7793 116.8594 60.7691 72.7745 171.6994 17 E 4.7764 8.3587 120.3817 55.2686 31.9818 175.4715 18 K 3.8996 8.7105 119.7064 60.3335 32.2508 177.6235 19 C 4.2159 7.9335 120.9308 58.9169 30.5749 171.7433 20 Q 4.3813 8.4644 128.6250 54.1783 29.7535 175.1112 21 V 4.1053 8.2058 125.7722 61.0803 31.6479 174.6354 22 R 4.2312 8.3701 126.7542 55.2037 30.2521 176.3843 23 V 4.2279 8.2985 123.2012 61.9090 33.6769 177.0507 24 G 3.8461 8.5920 114.9200 45.0666 0.0000 172.6923 25 D 4.4735 8.4701 119.3838 53.7966 41.5154 176.0043 26 L 4.0506 8.3171 124.1261 55.7632 42.5387 176.3327 27 T 4.6069 7.9475 113.9706 59.6420 72.0804 173.3295 28 V 3.8067 8.3047 121.7333 63.2097 32.2122 174.4770 29 A 5.3452 8.4514 128.9293 50.4096 22.2731 174.7737 30 K 4.7636 9.0804 119.0239 55.1923 37.4698 175.8777 31 T 4.7796 8.3820 112.1799 60.4725 70.4439 175.9009 32 R 4.1013 8.6586 121.0622 59.8115 28.9150 179.3099 33 G 3.6168 8.0603 104.4551 47.0724 0.0000 174.6398 34 Q 4.2863 8.2145 118.7845 56.6531 30.2876 176.3407 35 L 4.3342 7.9496 123.2903 54.1798 40.7354 176.4544 36 T 4.5362 7.2884 110.0649 60.1730 70.7429 174.1483 37 D 4.4507 8.4638 122.2367 55.9521 41.3670 176.6848 38 A 3.7814 9.2986 128.2814 51.8032 17.6697 177.6882 39 A 4.2960 7.8839 119.5298 51.3979 19.3856 175.6831 40 P 4.6014 0.0000 0.0000 63.2459 31.7394 175.9976 41 I 4.1705 9.0216 124.0856 61.2539 38.9812 176.3825 42 G 4.2202 7.1157 110.5145 45.5111 0.0000 170.1205 43 P 5.1350 0.0000 0.0000 61.4436 33.6740 175.6122 44 V 4.3664 8.4742 120.9543 61.0551 34.0015 174.7574 45 T 4.5096 8.5349 118.8918 61.7406 69.7956 174.0755 46 V 4.5223 8.8600 123.9141 61.4087 35.0964 174.1521 47 Q 4.6460 8.8443 125.4607 54.3671 31.4961 174.2494 48 A 4.8375 8.7431 126.2607 50.7870 20.8954 176.2884 49 L 4.5128 8.0862 118.7608 53.6602 45.9255 176.4521 50 G 3.9222 8.9731 110.6509 47.2077 0.0000 173.4460 51 C 4.8163 8.0495 116.1220 58.7971 28.9050 176.4206 52 D 4.3792 8.3960 121.3986 55.5862 39.0928 176.5637 53 A 4.7142 7.7739 121.2449 51.4362 19.8106 175.3064 54 R 4.6569 7.7330 116.4075 56.3485 35.6384 174.4982 55 Q 4.4678 8.5059 119.4568 54.2494 30.1832 175.5886 56 V 4.2010 8.3673 124.5140 63.7991 32.8699 174.5737 57 A 5.5542 9.4827 127.1508 50.8759 23.4604 174.8355 58 L 5.3496 9.3395 119.1395 52.8682 45.5782 175.5593 59 K 4.6903 8.9019 125.2122 54.3929 34.3179 175.1269 60 A 5.4707 8.3844 128.9390 50.4343 20.0753 176.9538 61 D 4.5282 8.6937 119.4202 54.6412 41.6815 177.7318 62 T 3.5896 8.9202 118.2711 67.1884 68.5033 174.8757 63 D 4.6072 8.0069 117.3033 55.0794 40.8199 176.2207 64 N 4.6314 8.9468 116.5871 51.8494 39.3486 173.9916 65 F 4.5049 6.5443 111.8877 55.1766 41.1061 173.2819 66 E 4.6839 9.3018 118.8267 57.1593 33.6571 175.7293 67 Q 3.4187 9.4778 126.8046 58.8536 26.8467 172.4737 68 G 4.0962 7.8919 100.7472 45.8082 0.0000 171.0999 69 K 4.6183 7.7092 117.8215 54.2394 35.0291 175.3580 70 F 5.3667 8.2214 120.8445 56.2828 42.0193 174.5531 71 F 5.1050 7.9499 113.0416 56.2543 41.3086 173.4364 72 L 4.7123 8.7523 121.2395 54.7605 43.3481 175.6659 73 I 5.3189 8.6772 121.5958 58.9381 41.2949 175.1970 74 S 4.5707 8.5384 123.4847 57.6011 63.5323 174.9643 75 D 4.4841 8.5653 121.0122 57.3914 40.3618 177.5165 76 N 4.4603 7.9731 114.0825 52.3593 37.8274 175.2866 77 N 4.5824 8.3525 116.4751 54.6148 38.2774 174.1979 78 R 4.2526 7.5247 116.7495 57.7509 31.1785 176.0817 79 D 4.8751 8.2526 118.3677 53.0789 42.4759 175.8328 80 K 4.8912 8.4946 121.8752 54.6983 34.8784 176.1333 81 L 4.6314 8.5301 124.7727 52.7074 43.5853 174.1924 82 Y 4.8050 8.8180 122.7680 58.4754 38.9835 175.8641 83 V 5.2187 8.6935 115.6370 60.0720 36.6094 174.2916 84 N 5.1115 9.4315 118.9678 51.6775 41.5092 173.9538 85 I 4.6074 8.0528 123.6063 59.4994 38.9520 175.2354 86 R 4.6501 8.4988 127.5842 53.9382 33.5192 172.7081 87 P 4.9613 0.0000 0.0000 63.1730 31.6412 176.6708 88 T 4.2281 8.8397 111.4039 63.4141 69.7566 175.0576 89 D 4.2456 8.1799 121.9299 54.6951 39.1333 176.7790 *91 S 4.2045 8.3368 110.6106 57.2821 65.1125 173.5435 92 A 4.6008 8.1657 123.8072 50.9770 20.0071 176.3194 93 W 4.7464 8.6695 121.3278 54.9115 33.3282 174.8225 94 T 4.3804 7.9683 117.4220 61.9143 71.9986 173.0338 95 T 5.1012 8.1846 120.5322 61.9897 70.9137 174.0789 96 D 4.2131 9.4346 126.1947 53.2583 43.1483 174.2051 97 N 4.2583 9.7906 127.9755 54.4742 37.1770 174.5823 98 G 2.2115 7.2676 105.3301 44.5179 0.0000 171.2194 99 V 4.6210 7.4244 120.3183 60.8877 34.2519 174.1894 100 F 5.4199 9.4916 131.2012 56.7983 40.7043 173.3229 101 Y 5.2323 7.8345 124.2069 54.5735 40.0370 174.9071 102 K 2.9342 8.0090 122.6013 55.5224 32.7315 177.9004 103 N 4.4546 8.4506 124.7510 55.0899 38.8009 174.7464 104 D 4.8785 6.7143 114.0046 52.0080 43.6259 175.8905 105 V 4.6103 7.2981 116.8666 59.7400 32.7902 175.3478 106 G 4.1971 8.4838 107.5820 44.5834 0.0000 174.9359 107 S 4.6071 8.2814 117.3799 57.1300 61.4082 173.2530 108 W 4.4517 8.5754 133.8333 57.0985 32.3191 174.4850 109 G 4.0239 7.5178 112.4914 44.3365 0.0000 172.1381 110 G 3.3616 7.1788 109.9784 46.0090 0.0000 171.1373 111 I 4.9827 7.8590 119.6805 59.5088 40.3152 174.9478 112 I 4.5338 8.8719 128.4593 59.5872 39.0360 175.1842 113 G 3.8630 8.9557 115.5862 45.3490 0.0000 172.1245 114 I 4.6825 7.7406 123.9763 59.4823 39.4271 174.4672 115 Y 5.2834 8.5751 124.1408 55.6723 42.4289 175.1846 116 V 3.9107 8.9739 122.5528 63.2164 32.8064 174.6589 117 D 4.9256 9.1624 129.3830 53.8818 40.7529 175.7350 118 G 4.1261 9.5857 112.9441 45.1550 0.0000 171.7042 119 Q 4.0797 8.4606 120.2369 56.6559 29.5448 177.5258 120 Q 4.6308 8.9246 123.4851 55.3660 29.8277 176.3609 121 T 4.3121 8.0428 106.0478 63.2447 69.2133 174.5654 122 N 4.6817 7.8046 118.4974 53.2690 39.3193 175.0940 123 T 3.8184 7.5684 116.0683 63.2874 68.8542 172.2631 124 P 4.3976 0.0000 0.0000 61.7413 32.0132 174.7024 125 P 4.4517 0.0000 0.0000 62.1862 32.1258 176.7970 126 G 3.8754 7.6792 107.9105 45.6932 0.0000 170.0887 127 N 5.3741 7.8667 116.9919 51.9189 40.5138 173.8607 128 Y 5.1057 9.6190 122.9835 56.5961 40.9034 175.2017 129 T 5.1987 8.8210 118.5763 61.8159 73.5205 172.9010 130 L 5.1030 8.7074 125.7562 52.7646 45.4050 174.9546 131 T 4.9894 8.5358 123.2809 61.9648 71.0252 173.6722 132 L 5.2240 8.8984 125.7922 53.2574 45.3620 175.4911 133 T 5.0422 9.0810 120.7728 61.7348 71.2423 174.4276 134 G 4.1893 9.0293 113.2692 46.1004 0.0000 174.0842 135 G 4.1852 8.0689 107.9527 45.8269 0.0000 171.3728 136 Y 5.5192 6.7427 117.0508 55.2089 42.1406 173.9686 137 W 5.2001 9.4066 130.7992 55.7566 32.5842 175.6766 138 A 4.0742 8.0115 127.9622 52.2245 19.0120 175.6488 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 0 G 8.35 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 1 S 6.77 4.02 0.00 3.65 3.31 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 0.00 2 F 9.47 5.19 0.00 3.29 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 3 T 7.30 4.02 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 0.72 0.00 0.00 4 P 0.00 4.13 0.00 1.86 2.05 0.00 3.46 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.19 0.00 5 S 7.75 4.64 0.00 3.76 3.75 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 6 G 7.54 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 0.00 0.00 0.00 0.00 7 T 7.85 4.63 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 1.25 0.00 0.00 8 T 8.44 5.10 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 1.26 0.00 0.00 9 G 9.23 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 0.00 0.00 0.00 0.00 10 T 8.54 5.03 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 11 T 8.85 4.43 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 1.15 0.00 0.00 12 K 8.55 5.18 0.00 1.62 1.71 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.40 7.81 13 L 9.06 4.82 0.00 1.71 1.49 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 14 T 8.83 5.10 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 1.29 0.00 0.00 15 V 9.16 4.80 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 1.03 0.00 0.00 0.76 0.00 0.00 16 T 8.78 5.07 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 17 E 8.36 4.78 0.00 1.98 1.97 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 2.27 2.23 0.00 18 K 8.71 3.90 0.00 1.71 1.84 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.43 7.81 19 C 7.93 4.22 0.00 2.97 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 20 Q 8.46 4.38 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 21 V 8.21 4.11 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 0.90 0.00 0.00 0.93 0.00 0.00 22 R 8.37 4.23 0.00 1.84 1.87 0.00 3.23 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 23 V 8.30 4.23 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 0.80 0.00 0.00 0.93 0.00 0.00 24 G 8.59 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 25 D 8.47 4.47 0.00 2.68 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.32 4.05 0.00 1.58 1.58 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.95 4.61 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 28 V 8.30 3.81 2.26 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 0.92 0.00 0.00 0.92 0.00 0.00 29 A 8.45 5.35 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 9.08 4.76 0.00 1.63 1.63 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.37 7.81 31 T 8.38 4.78 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 32 R 8.66 4.10 0.00 2.24 2.36 0.00 2.85 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.66 0.00 33 G 8.06 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.21 4.29 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.55 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 35 L 7.95 4.33 0.00 1.78 1.60 0.82 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.29 4.54 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 37 D 8.46 4.45 0.00 2.66 2.63 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 38 A 9.30 3.78 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 39 A 7.88 4.30 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 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.60 0.00 2.04 2.16 0.00 3.79 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 41 I 9.02 4.17 1.87 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 1.11 0.58 0.85 0.00 0.00 42 G 7.12 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 43 P 0.00 5.14 0.00 2.03 1.98 0.00 3.64 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.90 0.00 44 V 8.47 4.37 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 1.04 0.00 0.00 0.84 0.00 0.00 45 T 8.53 4.51 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 1.18 0.00 0.00 46 V 8.86 4.52 2.40 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 1.46 0.00 0.00 1.19 0.00 0.00 47 Q 8.84 4.65 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.62 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 48 A 8.74 4.84 1.45 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 49 L 8.09 4.51 0.00 1.49 1.54 1.00 0.92 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 50 G 8.97 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 0.00 0.00 0.00 51 C 8.05 4.82 0.00 3.00 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 52 D 8.40 4.38 0.00 2.75 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 53 A 7.77 4.71 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 54 R 7.73 4.66 0.00 1.52 1.54 0.00 2.87 0.00 0.00 2.95 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.10 0.00 55 Q 8.51 4.47 0.00 2.30 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.03 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 56 V 8.37 4.20 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 1.44 0.00 0.00 1.12 0.00 0.00 57 A 9.48 5.55 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 0.00 0.00 0.00 0.00 0.00 0.00 58 L 9.34 5.35 0.00 1.68 1.55 1.10 1.16 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 59 K 8.90 4.69 0.00 0.79 0.97 0.00 1.22 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.20 1.06 7.81 60 A 8.38 5.47 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 61 D 8.69 4.53 0.00 2.73 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 62 T 8.92 3.59 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 1.06 0.00 0.00 63 D 8.01 4.61 0.00 2.68 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 N 8.95 4.63 0.00 2.88 2.74 0.00 0.00 6.67 8.79 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 65 F 6.54 4.50 0.00 2.77 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 66 E 9.30 4.68 0.00 2.24 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 2.12 2.08 0.00 67 Q 9.48 3.42 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.32 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 68 G 7.89 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.71 4.62 0.00 2.30 2.05 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.41 1.47 7.81 70 F 8.22 5.37 0.00 3.03 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 71 F 7.95 5.10 0.00 2.78 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.75 4.71 0.00 1.76 1.84 0.93 1.10 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 73 I 8.68 5.32 2.20 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.37 1.01 0.00 0.00 74 S 8.54 4.57 0.00 3.54 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 75 D 8.57 4.48 0.00 2.56 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 76 N 7.97 4.46 0.00 2.86 2.99 0.00 0.00 5.94 6.96 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 77 N 8.35 4.58 0.00 2.80 2.92 0.00 0.00 6.97 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 78 R 7.52 4.25 0.00 1.59 1.96 0.00 3.28 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 79 D 8.25 4.88 0.00 2.73 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 80 K 8.49 4.89 0.00 0.92 0.74 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.17 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.57 1.00 7.81 81 L 8.53 4.63 0.00 1.30 1.40 0.86 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 82 Y 8.82 4.81 0.00 3.11 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 83 V 8.69 5.22 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 0.75 0.00 0.00 0.95 0.00 0.00 84 N 9.43 5.11 0.00 2.64 2.72 0.00 0.00 7.30 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 85 I 8.05 4.61 0.65 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.07 -0.16 0.00 0.00 86 R 8.50 4.65 0.00 1.86 1.80 0.00 3.07 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 87 P 0.00 4.96 0.00 2.44 1.63 0.00 3.79 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.65 0.00 88 T 8.84 4.23 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 1.35 0.00 0.00 89 D 8.18 4.25 0.00 2.98 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 *91 S 8.34 4.20 0.00 4.00 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 92 A 8.17 4.60 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 93 W 8.67 4.75 0.00 2.42 1.74 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 94 T 7.97 4.38 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 0.89 0.00 0.00 95 T 8.18 5.10 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 1.22 0.00 0.00 96 D 9.43 4.21 0.00 2.49 2.29 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 97 N 9.79 4.26 0.00 2.86 2.82 0.00 0.00 7.34 7.98 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 98 G 7.27 2.21 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 0.00 0.00 0.00 0.00 99 V 7.42 4.62 2.31 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 1.13 0.00 0.00 0.87 0.00 0.00 100 F 9.49 5.42 0.00 2.93 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 0.00 101 Y 7.83 5.23 0.00 2.92 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 0.00 102 K 8.01 2.93 0.00 0.79 1.14 0.00 0.79 0.00 0.00 1.33 0.00 0.00 2.20 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.45 0.21 7.81 103 N 8.45 4.45 0.00 2.55 2.76 0.00 0.00 6.75 8.18 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 0.00 104 D 6.71 4.88 0.00 2.46 2.39 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 0.00 105 V 7.30 4.61 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 1.04 0.00 0.00 0.94 0.00 0.00 106 G 8.48 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 0.00 0.00 0.00 0.00 107 S 8.28 4.61 0.00 3.81 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 0.00 108 W 8.58 4.45 0.00 3.42 3.22 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 0.00 109 G 7.52 4.02 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 0.00 110 G 7.18 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 0.00 111 I 7.86 4.98 1.90 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.02 0.89 0.00 0.00 112 I 8.87 4.53 1.77 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 1.30 0.95 0.57 0.00 0.00 113 G 8.96 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 I 7.74 4.68 1.72 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.07 0.79 0.00 0.00 115 Y 8.58 5.28 0.00 2.81 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 0.00 116 V 8.97 3.91 2.31 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 0.81 0.00 0.00 0.99 0.00 0.00 117 D 9.16 4.93 0.00 2.68 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 0.00 118 G 9.59 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 0.00 0.00 0.00 0.00 119 Q 8.46 4.08 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.45 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 120 Q 8.92 4.63 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.90 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 121 T 8.04 4.31 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 1.29 0.00 0.00 122 N 7.80 4.68 0.00 2.73 2.89 0.00 0.00 6.99 7.54 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 0.00 123 T 7.57 3.82 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 0.89 0.00 0.00 124 P 0.00 4.40 0.00 2.14 2.03 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.14 0.00 125 P 0.00 4.45 0.00 2.07 2.10 0.00 3.85 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 126 G 7.68 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 0.00 0.00 0.00 127 N 7.87 5.37 0.00 2.85 2.72 0.00 0.00 6.72 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 0.00 128 Y 9.62 5.11 0.00 2.90 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 0.00 129 T 8.82 5.20 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 1.22 0.00 0.00 130 L 8.71 5.10 0.00 1.73 1.45 0.86 0.43 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 0.00 131 T 8.54 4.99 4.40 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 1.23 0.00 0.00 132 L 8.90 5.22 0.00 1.51 1.49 0.73 0.53 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 0.00 133 T 9.08 5.04 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 1.37 0.00 0.00 134 G 9.03 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 0.00 0.00 0.00 0.00 135 G 8.07 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 0.00 0.00 0.00 0.00 136 Y 6.74 5.52 0.00 3.08 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 0.00 137 W 9.41 5.20 0.00 3.32 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 0.00 138 A 8.01 4.07 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.