NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6171 8.3049 120.2860 54.9205 34.9555 175.3961 2 R 4.4223 7.7704 117.4700 53.6387 33.8473 172.5543 3 I 4.9373 8.6563 124.3822 59.5608 41.2256 173.9886 4 G 4.2772 8.7205 113.3054 45.0331 0.0000 170.8260 5 H 5.4701 8.7982 119.9767 54.2623 32.9940 172.5615 6 G 4.6152 9.2379 112.2920 43.7270 0.0000 171.2009 7 F 5.3483 8.4569 120.9127 57.1748 42.4299 172.7272 8 D 4.3283 7.9084 123.7267 53.2568 44.8722 174.3165 9 V 4.6189 7.7846 116.3355 60.1776 35.9582 174.3404 10 H 5.0340 9.4064 118.7515 54.3386 33.5315 172.4269 11 A 4.9786 8.3835 122.2214 50.5404 21.3825 176.8118 12 F 5.0739 8.4382 119.3975 57.0849 40.4652 173.6539 13 G 3.2407 9.3795 106.0046 45.9716 0.0000 172.3571 14 G 3.2908 10.1894 117.4069 44.5496 0.0000 175.1981 15 E 3.9127 7.6129 118.7702 55.1875 29.1143 175.2772 16 G 3.8552 7.5788 108.5543 41.0000 0.0000 172.0195 17 P 4.8103 0.0000 0.0000 62.7158 32.3087 175.5518 18 I 4.6446 8.5857 114.3472 59.4240 41.0010 174.4339 19 I 5.0539 8.1020 122.4548 59.6717 40.7659 174.9958 20 I 4.6511 8.3308 127.4574 60.6750 40.3519 175.7943 21 G 3.8436 10.2511 114.3241 46.4978 0.0000 174.6855 22 G 3.7104 8.5952 107.1781 44.8878 0.0000 174.3412 23 V 4.2637 7.3658 119.8955 61.2427 32.7763 174.5593 24 R 4.5843 8.5472 127.5705 55.9554 30.5950 175.1272 25 I 4.5972 8.6507 128.6751 58.6861 39.6825 173.6782 26 P 4.8282 0.0000 0.0000 62.9857 32.1175 175.1074 27 Y 4.6037 8.5735 119.7870 57.0678 41.4249 173.2408 28 E 3.6540 6.9738 125.4587 58.6708 29.6061 177.6868 29 K 4.8178 6.8584 114.9254 54.7878 35.5672 174.2568 30 G 4.4928 8.4064 107.3801 43.8721 0.0000 171.4297 31 L 5.3030 8.3209 118.9025 51.6758 43.5135 177.1298 32 L 4.5910 8.7223 124.8196 52.7281 43.2067 176.7080 33 A 3.7768 8.9534 135.0000 53.0537 18.8785 178.8124 34 H 4.6836 8.7146 121.7806 52.4613 27.6175 174.9523 35 S 5.0274 7.2696 117.9907 57.5568 64.8028 177.4941 36 D 4.2816 8.0481 121.8146 53.6743 39.4474 177.1602 37 G 4.2157 8.4199 115.9386 45.8853 0.0000 174.0212 38 D 4.9104 7.1717 123.1773 51.9261 39.6390 175.4079 39 V 3.7978 8.0944 118.6802 63.1563 31.9418 177.4017 40 A 3.9108 7.7938 119.5740 55.2923 18.3803 179.5662 41 L 3.8929 7.9420 116.7862 58.1705 41.7599 179.2202 42 H 4.2111 8.2759 116.0675 59.0425 28.7807 177.7448 43 A 4.0185 8.1351 122.3835 54.7296 18.1571 179.5365 44 L 3.8758 7.7537 119.1165 58.4496 42.1827 179.2541 45 T 3.8451 8.3743 116.0359 66.8765 68.4679 176.2406 46 D 4.4255 8.0996 120.4946 57.2812 40.7785 178.8612 47 A 3.9068 7.8778 120.5797 55.1280 18.6330 179.2156 48 L 3.9071 7.8656 117.2363 58.1778 41.7482 179.9549 49 L 4.1267 8.5786 119.0286 57.8462 41.7399 179.9241 50 G 3.5991 8.5978 105.4122 47.1307 0.0000 175.3140 51 A 4.3855 7.9093 123.3440 53.5311 18.9458 178.5997 52 A 3.5557 7.5672 116.1597 51.4257 19.7013 176.6808 53 A 3.6328 7.3275 118.1174 53.8475 16.1517 177.8741 54 L 4.7737 8.3372 117.0522 54.4299 44.1938 176.8688 55 G 4.1016 7.7945 104.9612 43.8063 0.0000 176.3295 56 D 5.0988 8.7465 113.1324 54.4390 39.9142 177.4659 57 I 3.2130 7.7454 118.0449 61.1968 34.2655 173.9296 58 G 4.7091 7.3157 113.7880 45.2915 0.0000 171.0883 59 K 4.4602 8.2538 119.9602 56.2425 34.3109 176.8533 60 L 4.3936 7.9247 116.6301 55.8938 42.4768 176.3593 61 F 5.2098 7.6256 119.7898 55.3689 40.5296 173.2546 62 P 4.4904 0.0000 0.0000 62.1690 30.4995 176.4143 63 D 4.3119 8.5960 127.9035 55.4477 47.3800 175.7804 64 T 4.6280 7.7419 108.6306 60.9991 69.1999 173.8024 65 D 4.6148 7.8579 120.7576 53.0226 43.4813 173.5951 66 P 4.2862 0.0000 0.0000 63.9838 31.0219 177.3259 67 A 3.9987 7.7949 122.0692 53.3551 18.8845 178.2193 68 F 4.7322 7.9168 116.4697 54.9404 38.9414 174.9709 69 K 4.0854 7.7221 124.2144 56.6989 32.8101 176.7566 70 G 3.9405 8.0016 117.4332 44.7036 0.0000 172.4507 71 A 4.5031 7.9241 126.8796 49.4566 21.8803 175.9863 72 D 5.4039 8.1656 122.2405 52.1986 42.0012 177.8692 73 S 4.0218 8.7057 115.6236 61.7366 62.7351 177.1620 74 R 3.8353 7.8130 120.3787 59.1049 29.7334 178.8357 75 E 3.9539 8.3504 118.4345 59.3836 29.4571 179.3049 76 L 3.8761 7.5123 118.9133 57.5257 41.5777 179.2791 77 L 3.9232 8.1086 120.5063 58.3331 41.6386 178.9998 78 R 4.0209 7.9304 118.5048 59.3339 30.0289 178.1531 79 E 3.9820 8.3983 118.9961 59.1709 29.7546 178.3667 80 A 4.0046 8.5492 121.3602 55.1102 18.3964 179.4208 81 W 4.5648 8.7498 127.1937 60.4971 30.6968 178.2169 82 R 3.7054 7.7259 118.1912 59.5766 29.6181 178.7221 83 R 3.9102 7.8245 117.3220 59.2992 29.5711 179.1837 84 I 3.7686 7.6289 119.6081 64.5663 37.1516 178.5715 85 Q 4.0273 8.0388 119.8444 57.8577 28.1422 178.4016 86 A 4.0015 7.6267 121.5238 55.0725 18.4105 179.1845 87 K 4.2753 7.6004 112.9256 56.2127 32.0386 177.2411 88 G 3.6787 8.1989 106.9687 46.9969 0.0000 173.7341 89 Y 4.8252 7.3336 115.8526 56.0207 40.4939 175.1260 90 T 4.8583 8.1513 111.2929 59.5926 72.6705 172.7805 91 L 4.2965 9.3496 125.4655 55.7850 42.4813 175.5735 92 G 4.1485 8.7952 112.4398 46.0777 0.0000 172.8741 93 N 4.8846 7.3714 115.3905 51.6215 40.4372 173.0321 94 V 4.6671 8.4835 112.7492 59.7717 36.7029 173.9893 95 D 5.2400 8.8779 122.5673 52.4942 44.5060 174.3016 96 V 4.8603 8.7455 125.4262 61.3356 34.7613 174.2045 97 T 4.8714 9.2786 124.2403 61.9664 71.1984 172.9992 98 I 4.4474 9.0953 128.6728 60.1899 39.3588 175.1721 99 I 4.9302 8.8398 127.2201 59.8411 39.7800 174.4565 100 A 4.6816 8.8643 127.3744 51.1902 22.3755 176.9969 101 Q 3.9948 8.9767 121.3025 58.6469 29.6209 175.8303 102 A 4.2699 7.1874 116.9334 50.6855 21.4716 173.5868 103 P 4.5282 0.0000 0.0000 61.5864 32.5797 175.9882 104 K 4.1670 8.3533 118.2024 56.7473 32.3713 177.8857 105 M 4.3408 8.6761 123.0946 56.8267 32.2450 178.4897 106 L 3.9149 7.7726 121.0755 57.6089 42.2931 177.0182 107 P 4.4157 0.0000 0.0000 64.8344 31.7327 176.6888 108 H 4.7656 8.7400 115.9214 55.8283 29.5967 176.2665 109 I 3.6728 7.2660 121.7338 64.1366 37.0363 175.8858 110 P 4.1759 0.0000 0.0000 66.2588 30.9050 178.0317 111 Q 3.7485 7.9527 118.7397 58.8441 28.9331 177.8586 112 M 4.3122 8.0719 119.7933 58.4806 32.0203 178.8436 113 R 3.8645 8.0666 118.1658 59.2231 30.0286 179.1042 114 V 3.4949 7.4019 116.5888 66.0411 31.8449 177.7471 115 F 4.7324 7.8312 117.1492 60.8773 38.9604 177.7514 116 I 3.7149 8.0640 119.1756 64.2500 36.7067 177.7194 117 A 4.2953 8.2023 118.0573 52.7007 18.1007 177.6468 118 E 4.4582 7.7651 119.1542 57.8536 31.1540 176.2869 119 D 4.7747 7.4515 114.3764 54.5957 40.9387 176.5578 120 L 4.1711 7.2581 116.3843 53.2020 44.4571 178.4560 121 G 3.7906 8.2040 106.7999 44.2679 0.0000 173.5846 122 C 3.8925 8.6809 120.8227 58.5432 30.2523 172.0638 123 H 4.8426 8.1250 117.8181 54.6748 31.2728 175.4251 124 M 3.8874 8.2488 123.0212 58.8063 31.7690 178.6455 125 D 4.2968 8.0947 116.2838 56.8248 41.2394 176.8630 126 D 4.8034 8.4818 118.8870 53.7380 41.0780 175.7236 127 V 4.8053 8.3805 119.8279 59.9559 33.9794 174.4236 128 N 5.1268 9.0327 123.3991 51.7402 42.2290 173.1503 129 V 5.0530 8.1586 123.2233 61.4056 34.8847 173.8840 130 K 4.8011 9.0077 125.0068 55.6446 36.3254 174.5223 131 A 5.3377 8.4673 121.5951 50.5999 22.4159 175.1880 132 T 4.6884 8.8668 113.4048 60.8006 70.8397 174.9297 133 T 4.7487 8.6102 115.6169 61.8370 69.9467 176.0175 134 T 3.3708 7.9492 114.5642 60.8022 66.5712 170.9135 135 E 3.9845 7.9074 117.4230 58.4385 27.2418 174.0376 136 K 4.4766 8.0818 111.6855 56.8787 29.2428 176.4478 137 L 4.4460 6.9024 116.2632 56.4565 44.3035 181.5469 138 G 3.9629 7.3240 111.6394 44.7717 0.0000 174.3451 139 F 4.5339 8.6474 115.5233 59.8938 38.2093 177.5540 140 T 4.2875 6.2665 111.7903 63.8209 68.8532 176.9551 141 G 3.6297 7.7496 108.0371 47.1525 0.0000 174.7688 142 R 4.4007 7.8656 117.6974 55.6190 30.3223 177.3434 143 G 4.1401 7.8395 106.4700 46.0591 0.0000 175.0392 144 E 4.2728 8.4826 121.1000 59.0131 30.0915 176.7113 145 G 4.0823 7.6286 105.0085 45.1586 0.0000 171.1108 146 I 4.7836 8.5663 118.6229 59.2064 41.6087 174.7924 147 A 5.1784 8.7630 129.1763 50.4906 23.0729 174.2763 148 C 5.0746 8.8059 118.6191 57.9473 35.6194 172.4346 149 E 5.3537 9.3417 125.7554 54.5623 32.7480 174.2791 150 A 5.2165 8.9488 126.1678 50.6435 23.3053 175.3587 151 V 5.0399 8.6586 111.9437 59.9512 36.5125 174.4572 152 A 5.0227 8.6239 123.0382 51.2238 23.5052 174.7576 153 L 5.6770 8.3529 119.5844 53.6411 45.9659 174.9566 154 L 6.2000 8.6380 124.0239 52.4981 46.0511 173.9132 155 I 4.6696 8.2205 111.6864 60.8471 40.7477 175.3996 156 K 4.1630 8.7327 120.3811 57.7544 33.7306 174.8905 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 8.30 4.62 0.00 2.00 2.43 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.62 0.00 2 R 7.77 4.42 0.00 1.64 1.82 0.00 3.30 0.00 0.00 3.44 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 3 I 8.66 4.94 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.56 0.91 0.00 0.00 4 G 8.72 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 0.00 0.00 0.00 0.00 5 H 8.80 5.47 0.00 3.13 3.13 0.00 5.67 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 G 9.24 4.62 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 7 F 8.46 5.35 0.00 3.05 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 8 D 7.91 4.33 0.00 2.62 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 0.00 0.00 0.00 0.00 9 V 7.78 4.62 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 0.57 0.00 0.00 0.74 0.00 0.00 10 H 9.41 5.03 0.00 2.87 2.98 0.00 5.62 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 11 A 8.38 4.98 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 12 F 8.44 5.07 0.00 3.11 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 13 G 9.38 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 0.00 0.00 0.00 14 G 10.19 3.29 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 15 E 7.61 3.91 0.00 2.10 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 2.21 2.24 0.00 16 G 7.58 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 17 P 0.00 4.81 0.00 1.98 2.17 0.00 3.66 0.00 0.00 3.73 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 18 I 8.59 4.64 1.94 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.30 1.20 0.00 0.00 19 I 8.10 5.05 1.83 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 1.33 1.45 0.95 0.00 0.00 20 I 8.33 4.65 1.84 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 1.18 1.16 0.88 0.00 0.00 21 G 10.25 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 22 G 8.60 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 23 V 7.37 4.26 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 0.93 0.00 0.00 1.15 0.00 0.00 24 R 8.55 4.58 0.00 1.88 1.87 0.00 3.27 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 25 I 8.65 4.60 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.57 0.91 0.00 0.00 26 P 0.00 4.83 0.00 2.13 2.09 0.00 3.86 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 27 Y 8.57 4.60 0.00 2.85 2.97 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 28 E 6.97 3.65 0.00 1.19 1.62 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 2.09 1.74 0.00 29 K 6.86 4.82 0.00 1.47 1.80 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.52 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.26 1.14 7.81 30 G 8.41 4.49 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 0.00 0.00 0.00 31 L 8.32 5.30 0.00 1.51 1.50 0.87 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.72 4.59 0.00 1.65 0.80 1.07 1.13 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 33 A 8.95 3.78 1.21 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 34 H 8.71 4.68 0.00 3.14 3.35 0.00 6.03 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 35 S 7.27 5.03 0.00 4.00 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 36 D 8.05 4.28 0.00 2.80 2.85 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 37 G 8.42 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 38 D 7.17 4.91 0.00 2.74 2.34 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 39 V 8.09 3.80 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 1.03 0.00 0.00 0.84 0.00 0.00 40 A 7.79 3.91 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 41 L 7.94 3.89 0.00 1.61 1.67 0.87 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 42 H 8.28 4.21 0.00 3.22 3.32 0.00 5.63 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.14 4.02 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 44 L 7.75 3.88 0.00 1.85 1.81 0.84 0.72 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 45 T 8.37 3.85 4.35 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 1.21 0.00 0.00 46 D 8.10 4.43 0.00 2.92 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 47 A 7.88 3.91 1.42 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 48 L 7.87 3.91 0.00 1.93 1.87 0.74 0.33 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 49 L 8.58 4.13 0.00 1.87 1.73 0.96 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 50 G 8.60 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 0.00 0.00 0.00 51 A 7.91 4.39 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 52 A 7.57 3.56 1.25 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 53 A 7.33 3.63 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.34 4.77 0.00 1.61 1.65 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.79 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 56 D 8.75 5.10 0.00 2.86 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 57 I 7.75 3.21 1.92 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.56 1.20 0.00 0.00 58 G 7.32 4.71 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 59 K 8.25 4.46 0.00 1.69 1.82 0.00 1.58 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.44 7.81 60 L 7.92 4.39 0.00 0.97 1.49 0.70 0.31 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 61 F 7.63 5.21 0.00 2.80 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 62 P 0.00 4.49 0.00 2.00 1.38 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.25 0.00 63 D 8.60 4.31 0.00 2.43 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 7.74 4.63 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 1.17 0.00 0.00 65 D 7.86 4.61 0.00 2.63 2.54 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 0.00 0.00 0.00 0.00 66 P 0.00 4.29 0.00 2.08 2.10 0.00 3.75 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 67 A 7.79 4.00 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 0.00 0.00 68 F 7.92 4.73 0.00 3.28 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 69 K 7.72 4.09 0.00 1.76 1.70 0.00 1.70 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.57 7.81 70 G 8.00 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 71 A 7.92 4.50 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 72 D 8.17 5.40 0.00 2.83 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 73 S 8.71 4.02 0.00 3.79 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 74 R 7.81 3.84 0.00 1.86 1.86 0.00 3.39 0.00 0.00 3.02 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.41 0.00 75 E 8.35 3.95 0.00 2.29 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 0.00 2.34 2.40 0.00 76 L 7.51 3.88 0.00 1.66 1.57 0.14 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.11 3.92 0.00 1.75 1.83 0.85 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 78 R 7.93 4.02 0.00 2.29 2.01 0.00 3.18 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 1.72 1.69 0.00 79 E 8.40 3.98 0.00 2.28 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 1.90 2.15 0.00 80 A 8.55 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.75 4.56 0.00 3.39 3.27 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 82 R 7.73 3.71 0.00 2.19 1.96 0.00 3.17 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 83 R 7.82 3.91 0.00 2.04 1.97 0.00 3.15 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 84 I 7.63 3.77 1.97 0.00 0.00 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 1.58 1.23 0.96 0.00 0.00 85 Q 8.04 4.03 0.00 1.88 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 1.16 1.32 0.00 86 A 7.63 4.00 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 87 K 7.60 4.28 0.00 2.04 1.84 0.00 1.88 0.00 0.00 1.86 0.00 0.00 3.19 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.49 7.81 88 G 8.20 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 0.00 0.00 0.00 89 Y 7.33 4.83 0.00 3.22 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 90 T 8.15 4.86 4.35 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 1.25 0.00 0.00 91 L 9.35 4.30 0.00 1.71 1.72 0.73 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 92 G 8.80 4.15 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 0.00 93 N 7.37 4.88 0.00 2.78 2.87 0.00 0.00 5.79 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 94 V 8.48 4.67 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 0.66 0.00 0.00 0.88 0.00 0.00 95 D 8.88 5.24 0.00 2.75 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 96 V 8.75 4.86 2.05 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 0.89 0.00 0.00 0.89 0.00 0.00 97 T 9.28 4.87 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 98 I 9.10 4.45 1.85 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 1.19 0.74 0.88 0.00 0.00 99 I 8.84 4.93 1.95 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 1.17 0.70 0.86 0.00 0.00 100 A 8.86 4.68 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 0.00 101 Q 8.98 3.99 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 102 A 7.19 4.27 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 0.00 103 P 0.00 4.53 0.00 2.18 2.03 0.00 3.45 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.79 0.00 104 K 8.35 4.17 0.00 1.78 1.79 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.47 7.81 105 M 8.68 4.34 0.00 2.03 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 2.62 2.51 0.00 106 L 7.77 3.91 0.00 1.66 1.65 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 107 P 0.00 4.42 0.00 2.07 2.08 0.00 3.81 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 1.72 1.96 0.00 108 H 8.74 4.77 0.00 3.22 3.33 0.00 5.65 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.27 3.67 2.00 0.00 0.00 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 1.57 0.47 0.89 0.00 0.00 110 P 0.00 4.18 0.00 2.20 2.28 0.00 3.56 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 111 Q 7.95 3.75 0.00 2.08 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.11 0.00 112 M 8.07 4.31 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.91 0.00 113 R 8.07 3.86 0.00 1.98 1.93 0.00 3.22 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 114 V 7.40 3.49 2.05 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 0.68 0.00 0.00 0.87 0.00 0.00 115 F 7.83 4.73 0.00 3.33 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 0.00 116 I 8.06 3.71 1.95 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 1.44 1.07 0.81 0.00 0.00 117 A 8.20 4.30 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 0.00 118 E 7.77 4.46 0.00 2.24 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 2.28 2.36 0.00 119 D 7.45 4.77 0.00 2.73 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 0.00 120 L 7.26 4.17 0.00 1.23 0.81 0.51 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.20 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 0.00 0.00 0.00 122 C 8.68 3.89 0.00 3.40 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 0.00 123 H 8.13 4.84 0.00 3.22 3.21 0.00 5.90 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 0.00 124 M 8.25 3.89 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 125 D 8.09 4.30 0.00 2.70 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 0.00 126 D 8.48 4.80 0.00 2.77 2.65 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 0.00 0.00 0.00 0.00 127 V 8.38 4.81 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 0.64 0.00 0.00 0.88 0.00 0.00 128 N 9.03 5.13 0.00 2.82 2.83 0.00 0.00 6.17 7.15 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 0.00 129 V 8.16 5.05 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 0.85 0.00 0.00 0.91 0.00 0.00 130 K 9.01 4.80 0.00 1.82 1.82 0.00 1.30 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.39 7.81 131 A 8.47 5.34 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 0.00 132 T 8.87 4.69 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 1.20 0.00 0.00 133 T 8.61 4.75 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 1.20 0.00 0.00 134 T 7.95 3.37 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 1.18 0.00 0.00 135 E 7.91 3.98 0.00 2.17 2.03 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 2.22 2.40 0.00 136 K 8.08 4.48 0.00 1.89 1.89 0.00 1.78 0.00 0.00 2.37 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.60 7.81 137 L 6.90 4.45 0.00 1.88 1.58 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 138 G 7.32 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 0.00 139 F 8.65 4.53 0.00 3.47 3.39 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 0.00 140 T 6.27 4.29 4.07 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 0.00 0.00 0.00 0.66 0.00 0.00 141 G 7.75 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 0.00 142 R 7.87 4.40 0.00 1.91 2.04 0.00 3.38 0.00 0.00 3.27 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 143 G 7.84 4.14 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 0.00 144 E 8.48 4.27 0.00 2.53 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 2.45 2.39 0.00 145 G 7.63 4.08 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 0.00 0.00 0.00 146 I 8.57 4.78 1.60 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 1.07 1.02 0.63 0.00 0.00 147 A 8.76 5.18 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 0.00 148 C 8.81 5.07 0.00 2.83 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 0.00 149 E 9.34 5.35 0.00 2.23 1.81 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 2.30 2.58 0.00 150 A 8.95 5.22 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 0.00 151 V 8.66 5.04 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 0.74 0.00 0.00 0.98 0.00 0.00 152 A 8.62 5.02 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 0.00 153 L 8.35 5.68 0.00 1.71 1.47 0.99 0.52 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 0.00 154 L 8.64 6.20 0.00 1.42 1.69 0.61 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.22 4.67 1.94 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 1.47 0.51 0.99 0.00 0.00 156 K 8.73 4.16 0.00 2.02 1.90 0.00 1.56 0.00 0.00 1.72 0.00 0.00 2.72 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.35 7.81