NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2096 8.3144 121.7906 56.0338 34.3001 176.0413 2 E 3.7936 8.0740 120.4013 54.3350 30.0305 174.7218 3 S 4.4352 9.3695 122.6839 58.4579 66.1121 175.1294 4 R 4.0483 8.5935 122.2222 59.2596 29.8886 179.1430 5 A 4.3039 7.9602 121.7109 54.4813 18.4114 179.4785 6 K 3.9435 8.1536 118.1209 59.4509 32.2960 178.8380 7 K 4.1396 8.4594 121.7711 58.8882 32.0189 178.5009 8 F 4.1693 8.7885 121.1730 61.3502 39.4581 176.9321 9 Q 4.0782 8.2996 117.7361 59.1499 28.3632 179.0510 10 R 3.8831 8.2793 118.2617 59.7558 30.2295 178.2325 11 Q 3.9993 8.1785 116.5377 57.9510 29.1058 176.2867 12 H 4.7781 7.9658 113.8801 53.9597 31.4983 173.1936 13 M 4.7610 7.8760 118.5674 53.3838 33.5671 176.6696 14 D 4.7492 9.2562 123.6864 52.7750 41.2275 175.5221 15 S 4.3926 8.4695 117.6408 60.9858 63.4764 175.4073 16 D 4.8077 7.9744 116.1993 54.0008 41.2637 176.2657 17 S 4.6207 7.7625 115.6315 57.7098 64.2312 174.4603 18 S 4.3369 7.8263 116.5177 54.7365 62.5015 171.5209 19 P 4.0904 0.0000 0.0000 64.0093 31.5931 177.1134 20 S 4.5757 8.1875 116.0327 57.1968 64.1221 174.4637 21 S 4.4151 8.4164 117.4297 59.7707 63.4928 174.2795 22 S 3.9726 8.0143 116.9309 59.7352 61.0043 171.9618 23 S 4.7864 7.2079 115.5913 57.4786 65.5580 173.7352 24 T 4.4253 8.2119 114.3952 62.5770 67.6462 175.9514 25 Y 3.9969 7.9470 122.8270 61.5579 38.7182 177.6147 26 C 4.1543 8.2851 116.8838 59.8643 38.5537 175.5574 27 N 4.3973 8.2734 117.6385 56.6362 38.0882 177.1241 28 Q 3.9540 7.8952 118.8522 59.4454 28.7894 179.0258 29 M 3.6711 7.8447 119.8982 58.3244 31.7040 178.8011 30 M 3.9877 8.2239 119.3915 58.1659 31.9764 178.8637 31 R 4.0522 7.4629 118.8344 58.9782 30.1313 178.7970 32 R 3.9644 7.9624 116.8426 58.7241 30.0089 178.2003 33 R 4.4091 7.8387 115.7343 55.3835 30.3615 175.9520 34 N 4.2875 7.8748 114.5513 55.1611 36.4396 174.7261 35 M 4.5721 8.3873 115.6715 55.3902 32.3640 177.1519 36 T 5.2971 7.6275 107.7261 60.5491 69.6122 172.9879 37 Q 4.4123 8.2265 122.1785 56.7209 29.1402 177.1575 38 G 3.8774 10.4770 112.5848 45.8460 0.0000 172.5789 39 R 3.8121 7.2703 113.7657 55.4043 32.3202 173.2512 40 C 4.9501 8.5909 116.3383 55.0448 40.2335 174.0059 41 K 4.0707 8.6041 127.2191 56.2353 32.3586 174.8430 42 P 4.5891 0.0000 0.0000 65.5094 32.3190 176.7268 43 V 5.0835 7.5297 109.5767 60.2399 35.7995 174.0607 44 N 4.6650 8.8024 120.1633 52.9751 42.9173 173.0500 45 T 4.8275 7.8378 120.3122 61.6557 71.8308 172.8262 46 F 4.9143 8.8526 124.5551 55.7265 42.0416 174.6838 47 V 4.3933 8.8743 122.7718 61.0159 33.4865 175.5014 48 H 5.4765 8.5486 126.6575 53.5564 26.5931 173.7059 49 E 4.7690 7.7261 116.8102 53.7330 34.4140 174.1047 50 P 4.3251 0.0000 0.0000 62.8305 32.1346 177.2259 51 L 3.9992 8.8455 123.4301 58.5874 41.6540 179.1273 52 L 4.1985 7.8831 120.8502 57.6745 41.7703 178.8936 53 L 4.0187 7.8227 117.9684 57.5118 41.8909 179.2883 54 V 3.8271 7.7521 118.0203 66.0027 31.5232 177.9880 55 Q 3.9346 8.2726 118.0447 58.8892 28.5450 178.6039 56 L 4.1451 8.2782 119.7250 57.0082 41.5901 179.3788 57 V 3.6228 7.6071 118.5747 65.9667 31.1404 176.6799 58 C 3.8174 7.6703 114.1157 57.9958 39.8723 173.9590 59 L 4.6989 7.5313 119.3902 54.3448 42.9280 177.1236 60 Q 4.6256 7.6971 118.9726 55.3551 28.6812 176.2781 61 E 4.0816 8.7811 127.1136 57.1954 30.6726 176.4015 62 K 4.0912 8.6895 129.6595 56.4135 33.1737 176.2149 63 V 4.5610 8.3780 119.8830 59.5465 36.6682 174.9426 64 T 4.1456 8.2851 118.7457 63.3355 69.1576 175.9588 65 C 4.6942 8.9350 123.9135 56.4755 40.9195 175.0219 66 K 3.7466 9.2595 121.7183 59.3362 31.6418 177.9512 67 N 4.6769 8.1688 114.1907 52.4474 37.3292 176.1073 68 G 3.9770 8.1112 108.2392 45.9341 0.0000 174.7482 69 Q 4.1138 8.2990 119.2150 56.1860 29.1474 176.9399 70 G 3.9230 8.5324 108.5141 45.6047 0.0000 173.6372 71 N 4.9793 7.7327 118.3093 52.9337 37.3225 175.0714 72 C 5.3609 7.4914 114.7599 56.5787 44.7348 173.8255 73 Y 5.1337 8.9361 118.5639 56.1601 41.8381 174.0579 74 K 5.1537 8.8721 125.7976 54.3124 33.2344 176.0985 75 S 4.4641 8.8252 122.6549 58.4820 63.5459 175.2928 76 N 4.5431 9.9223 121.0921 55.8538 38.6025 175.3911 77 S 4.9456 7.1416 108.8884 55.9834 66.4318 174.7131 78 S 4.4085 8.3766 116.3607 59.0427 63.8763 173.2888 79 M 5.0231 8.6507 119.4887 53.6830 36.7537 174.4478 80 H 4.7929 9.7516 120.7266 56.2443 29.9677 174.7243 81 I 5.0673 9.1798 116.4205 59.5051 42.0427 174.0954 82 T 5.0845 8.7187 117.6792 62.0267 72.4394 173.0959 83 D 5.0985 9.1978 126.8441 53.5557 42.8858 174.6924 84 C 5.4474 9.2321 121.6324 55.4152 39.6295 172.9963 85 R 5.2384 8.7888 123.0418 53.7940 32.9574 175.0227 86 L 3.8516 8.7577 126.9735 55.6709 42.7051 177.0672 87 T 4.1408 8.6406 116.4404 61.3753 69.7599 175.4306 88 N 4.3093 8.9002 120.5612 56.4812 38.7039 176.7957 89 G 3.7274 7.8757 104.7067 46.8782 0.0000 173.8132 90 S 4.2031 7.6185 117.0795 58.3828 63.4146 173.8834 91 R 4.5570 8.1681 122.9406 53.9721 32.7736 174.3324 92 Y 4.2571 8.8599 123.8335 57.9289 38.9997 174.0655 93 P 3.0545 0.0000 0.0000 62.1005 32.0747 175.0736 94 N 4.3564 8.0072 119.6644 53.4028 38.5389 173.3686 95 C 4.8489 8.6636 123.7638 55.1340 40.7410 172.7345 96 A 5.1073 8.7788 127.4064 50.2793 20.9418 175.0258 97 Y 5.1191 9.8349 119.9481 56.1083 41.6387 175.6977 98 R 4.3998 9.2407 122.0909 56.1349 32.1957 175.5791 99 T 4.8288 8.5766 119.7959 62.3473 70.7597 173.7032 100 S 4.5933 9.1050 123.7352 55.7377 64.9212 171.5488 101 P 4.9418 0.0000 0.0000 62.5205 32.2001 175.6620 102 K 4.4676 9.0759 121.9483 56.5365 36.6962 173.6566 103 E 5.1689 8.6594 119.5862 54.7799 31.2914 176.1796 104 R 4.8166 8.7513 122.7314 54.3969 35.2310 174.6362 105 H 4.6332 8.9054 118.9574 56.2468 30.1014 174.5839 106 I 4.9004 8.7136 114.8894 59.2416 41.0205 174.2830 107 I 5.0405 8.4526 123.8998 59.6890 40.3267 175.1043 108 V 4.8413 8.5896 119.0992 59.3324 35.9699 174.4934 109 A 4.9785 8.5052 125.1767 51.4051 20.3222 175.7501 110 C 5.2005 8.6894 119.1258 55.1572 37.8742 173.4370 111 E 4.8123 8.8666 121.0185 55.5092 34.4773 174.2660 112 G 3.9657 9.3545 106.3864 44.6932 0.0000 172.3449 113 S 4.6810 8.1832 112.3851 55.2654 64.2166 171.8943 114 P 4.3274 0.0000 0.0000 63.0001 31.5156 175.7611 115 Y 4.8207 8.2123 121.0114 56.5290 38.4908 174.4427 116 V 4.4379 8.0073 119.1803 58.1871 36.4330 173.4030 117 P 4.4716 0.0000 0.0000 62.9728 31.5806 177.4787 118 V 4.4828 8.6505 115.8939 61.2215 33.8921 175.2514 119 H 5.0216 7.8088 119.9854 54.8267 33.5148 171.8285 120 F 4.5025 8.7893 128.1825 57.4532 39.1205 174.5229 121 D 4.5572 8.4336 127.1891 56.7318 41.8484 175.8445 122 A 4.6398 6.6761 117.1314 51.2887 22.4925 174.9323 123 S 5.2217 8.7977 113.1376 56.7780 66.2252 173.9785 124 V 4.5095 8.6763 113.8905 59.6657 35.2350 176.6267 125 E 3.8380 9.1298 124.7930 57.3652 30.0198 176.1482 126 D 4.6455 8.1425 121.6733 54.6347 42.2769 172.7001 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 1.92 0.00 1.77 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 1.44 7.81 2 E 8.07 3.79 0.00 2.13 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 3 S 9.37 4.44 0.00 4.10 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 4 R 8.59 4.05 0.00 1.95 2.23 0.00 3.20 0.00 0.00 3.36 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 5 A 7.96 4.30 1.31 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 0.00 0.00 6 K 8.15 3.94 0.00 1.89 2.02 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.47 7.81 7 K 8.46 4.14 0.00 1.99 2.04 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.50 1.34 7.81 8 F 8.79 4.17 0.00 3.20 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 Q 8.30 4.08 0.00 2.40 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.57 0.00 0.00 0.00 0.00 0.00 2.54 2.71 0.00 10 R 8.28 3.88 0.00 1.76 2.10 0.00 3.38 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 11 Q 8.18 4.00 0.00 1.62 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.47 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 12 H 7.97 4.78 0.00 2.01 2.60 0.00 5.59 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.88 4.76 0.00 1.98 2.17 0.00 0.00 0.00 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.66 0.00 14 D 9.26 4.75 0.00 2.64 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 15 S 8.47 4.39 0.00 3.93 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 16 D 7.97 4.81 0.00 2.62 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.76 4.62 0.00 3.73 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 18 S 7.83 4.34 0.00 3.81 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.09 0.00 1.85 1.35 0.00 3.15 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.44 0.00 20 S 8.19 4.58 0.00 3.86 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 21 S 8.42 4.42 0.00 4.01 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 22 S 8.01 3.97 0.00 3.99 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 23 S 7.21 4.79 0.00 3.92 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 24 T 8.21 4.43 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 1.22 0.00 0.00 25 Y 7.95 4.00 0.00 2.96 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 26 C 8.29 4.15 0.00 3.19 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 27 N 8.27 4.40 0.00 2.96 2.92 0.00 0.00 7.12 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 28 Q 7.90 3.95 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.55 0.00 29 M 7.84 3.67 0.00 0.68 1.01 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.22 0.00 30 M 8.22 3.99 0.00 1.59 1.76 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 1.00 2.31 0.00 31 R 7.46 4.05 0.00 1.92 2.02 0.00 3.13 0.00 0.00 3.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.53 0.00 32 R 7.96 3.96 0.00 1.67 1.90 0.00 3.07 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 33 R 7.84 4.41 0.00 1.90 2.12 0.00 3.56 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.96 0.00 34 N 7.87 4.29 0.00 2.91 2.95 0.00 0.00 6.78 7.77 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 35 M 8.39 4.57 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.39 0.00 36 T 7.63 5.30 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 1.41 0.00 0.00 37 Q 8.23 4.41 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.72 0.00 0.00 0.00 0.00 0.00 2.45 2.32 0.00 38 G 10.48 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 39 R 7.27 3.81 0.00 1.74 1.80 0.00 2.91 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 40 C 8.59 4.95 0.00 3.03 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 8.60 4.07 0.00 1.85 1.80 0.00 1.77 0.00 0.00 1.61 0.00 0.00 3.17 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.59 1.45 7.81 42 P 0.00 4.59 0.00 2.15 2.11 0.00 3.66 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 43 V 7.53 5.08 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 0.68 0.00 0.00 0.96 0.00 0.00 44 N 8.80 4.66 0.00 2.55 2.29 0.00 0.00 7.01 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 7.84 4.83 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 0.95 0.00 0.00 46 F 8.85 4.91 0.00 3.00 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 47 V 8.87 4.39 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 0.98 0.00 0.00 1.05 0.00 0.00 48 H 8.55 5.48 0.00 3.05 3.27 0.00 5.64 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.73 4.77 0.00 1.96 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 2.28 2.33 0.00 50 P 0.00 4.33 0.00 2.20 2.01 0.00 3.65 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 51 L 8.85 4.00 0.00 1.81 1.74 1.04 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.88 4.20 0.00 1.81 1.67 0.97 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 53 L 7.82 4.02 0.00 1.91 1.75 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.75 3.83 2.35 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 1.34 0.00 0.00 1.06 0.00 0.00 55 Q 8.27 3.93 0.00 2.30 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 56 L 8.28 4.15 0.00 1.67 1.71 0.96 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.61 3.62 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 1.12 0.00 0.00 1.02 0.00 0.00 58 C 7.67 3.82 0.00 2.83 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 59 L 7.53 4.70 0.00 1.65 1.61 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 60 Q 7.70 4.63 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.92 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 61 E 8.78 4.08 0.00 2.08 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 2.36 2.31 0.00 62 K 8.69 4.09 0.00 1.85 1.64 0.00 1.86 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.19 0.94 7.81 63 V 8.38 4.56 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 0.75 0.00 0.00 0.81 0.00 0.00 64 T 8.29 4.15 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 1.23 0.00 0.00 65 C 8.93 4.69 0.00 3.07 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 66 K 9.26 3.75 0.00 1.72 1.89 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.70 1.55 7.81 67 N 8.17 4.68 0.00 2.79 2.88 0.00 0.00 6.14 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 8.11 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 69 Q 8.30 4.11 0.00 2.29 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.68 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 70 G 8.53 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 71 N 7.73 4.98 0.00 2.99 3.14 0.00 0.00 6.06 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 7.49 5.36 0.00 3.06 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 73 Y 8.94 5.13 0.00 2.82 2.96 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 74 K 8.87 5.15 0.00 1.70 1.69 0.00 1.77 0.00 0.00 1.88 0.00 0.00 2.68 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.35 7.81 75 S 8.83 4.46 0.00 4.02 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 76 N 9.92 4.54 0.00 2.83 2.96 0.00 0.00 6.77 7.92 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 77 S 7.14 4.95 0.00 3.69 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.38 4.41 0.00 3.83 3.79 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 79 M 8.65 5.02 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 80 H 9.75 4.79 0.00 3.16 3.32 0.00 5.75 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 9.18 5.07 1.93 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 1.37 1.35 1.05 0.00 0.00 82 T 8.72 5.08 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 1.32 0.00 0.00 83 D 9.20 5.10 0.00 2.65 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 84 C 9.23 5.45 0.00 2.89 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 85 R 8.79 5.24 0.00 1.81 1.85 0.00 3.18 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 1.61 0.00 86 L 8.76 3.85 0.00 1.51 1.48 0.33 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.64 4.14 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 88 N 8.90 4.31 0.00 2.70 2.91 0.00 0.00 6.93 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 89 G 7.88 3.73 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 0.00 0.00 0.00 90 S 7.62 4.20 0.00 4.01 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 91 R 8.17 4.56 0.00 1.90 1.80 0.00 3.31 0.00 0.00 3.10 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 92 Y 8.86 4.26 0.00 2.96 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 93 P 0.00 3.05 0.00 1.79 1.17 0.00 3.64 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 1.72 1.65 0.00 94 N 8.01 4.36 0.00 2.77 2.82 0.00 0.00 6.96 7.20 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 95 C 8.66 4.85 0.00 3.12 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 96 A 8.78 5.11 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 9.83 5.12 0.00 2.83 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 98 R 9.24 4.40 0.00 1.79 1.90 0.00 3.13 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 99 T 8.58 4.83 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 1.36 0.00 0.00 100 S 9.10 4.59 0.00 3.75 3.79 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 0.00 101 P 0.00 4.94 0.00 1.91 1.93 0.00 3.72 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 102 K 9.08 4.47 0.00 1.77 1.89 0.00 1.41 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.42 7.81 103 E 8.66 5.17 0.00 1.79 1.82 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 1.95 2.20 0.00 104 R 8.75 4.82 0.00 1.76 1.94 0.00 3.33 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.79 0.00 105 H 8.91 4.63 0.00 3.16 3.24 0.00 5.57 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 0.00 106 I 8.71 4.90 1.82 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.96 1.14 0.00 0.00 107 I 8.45 5.04 1.69 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 1.17 0.64 0.85 0.00 0.00 108 V 8.59 4.84 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 0.72 0.00 0.00 0.87 0.00 0.00 109 A 8.51 4.98 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 0.00 110 C 8.69 5.20 0.00 1.88 1.82 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 0.00 111 E 8.87 4.81 0.00 1.87 1.82 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 2.29 2.26 0.00 112 G 9.35 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 0.00 0.00 0.00 113 S 8.18 4.68 0.00 3.80 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 0.00 114 P 0.00 4.33 0.00 2.22 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.21 4.82 0.00 2.82 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 0.00 116 V 8.01 4.44 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 0.61 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.47 0.00 0.51 0.93 0.00 3.25 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.79 0.00 118 V 8.65 4.48 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 0.62 0.00 0.00 0.95 0.00 0.00 119 H 7.81 5.02 0.00 3.28 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 8.79 4.50 0.00 2.57 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.43 4.56 0.00 2.68 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 A 6.68 4.64 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.80 5.22 0.00 4.05 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 0.00 124 V 8.68 4.51 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 0.84 0.00 0.00 0.91 0.00 0.00 125 E 9.13 3.84 0.00 1.94 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 2.31 2.31 0.00 126 D 8.14 4.65 0.00 2.64 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