NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 S 4.4508 8.3193 115.4125 57.4031 64.9594 173.6438 21 V 3.5617 7.6209 121.5764 61.4626 31.6366 175.1356 22 S 4.5240 8.1476 117.6962 56.4632 63.7762 172.9182 23 V 4.4128 7.8029 122.9609 59.0516 33.6919 175.7528 24 D 4.5688 8.6829 123.8868 53.6084 41.3771 175.5238 25 L 4.6993 8.4129 124.2410 52.8879 43.5766 175.5897 26 N 4.9044 8.6546 120.0899 51.2936 41.4902 173.8780 27 V 4.1492 8.1689 122.2231 61.8266 33.9274 175.1084 28 D 4.3755 8.9087 129.5647 54.5475 38.1622 172.3853 29 P 4.4121 0.0000 0.0000 63.0710 32.4833 177.1607 30 S 4.6281 8.5167 114.2397 59.6186 64.6969 173.4270 31 L 4.8541 7.6733 122.3035 53.8877 44.7846 174.8771 32 Q 4.5682 9.2318 125.4799 54.2081 32.4260 174.3490 33 I 5.0483 8.4732 124.4466 59.4909 40.4805 174.4175 34 D 4.9361 9.2182 124.8461 52.2535 43.6866 174.4230 35 I 5.4100 9.4909 120.9385 58.4082 37.1175 174.1096 36 P 4.5163 0.0000 0.0000 64.1273 32.3834 176.3613 37 D 4.8630 7.7008 117.3659 52.4183 42.4404 174.0383 38 A 5.2122 8.3306 120.6546 50.5983 22.8225 174.9982 39 L 4.8873 8.9902 121.2524 53.2691 45.2401 175.0642 40 S 5.0654 8.8541 120.0547 56.4814 65.0808 172.4773 41 E 4.5583 8.9272 126.2495 55.5387 32.1926 176.3156 42 R 3.7753 9.5631 125.1692 57.4367 27.7345 176.7238 43 D 4.2955 7.8043 112.0893 54.5928 38.9762 174.1383 44 K 4.5740 7.7989 119.8802 54.8977 34.0662 175.4895 45 V 4.6110 8.3202 124.2905 61.0048 33.6482 174.6854 46 K 4.6964 8.9367 127.4664 54.7833 34.4117 175.0780 47 F 5.0400 9.5296 125.1390 56.6856 41.2600 175.2680 48 T 4.7698 8.9019 120.7631 62.9273 69.9232 173.8354 49 V 4.7215 8.9779 127.8735 61.5388 33.6146 173.6866 50 H 5.3370 9.2851 128.6603 54.6280 32.5154 172.6260 51 T 4.6302 8.2963 122.2028 61.3891 71.6216 172.9878 52 K 4.8396 8.4216 125.2332 54.7755 35.0495 175.1617 53 T 5.0404 8.8482 118.6895 60.9758 71.3025 173.7827 54 T 4.6450 8.8100 116.4876 61.5411 70.0677 174.5036 55 L 4.4937 8.1070 124.1870 54.2953 42.2706 175.8307 56 P 4.7048 0.0000 0.0000 63.8640 31.8293 177.1178 57 T 4.0418 7.8542 108.9194 63.4519 69.3376 174.7292 58 F 4.6756 7.5579 119.6513 56.3526 40.1453 176.1573 59 Q 4.1620 9.0216 122.9266 58.3448 28.7489 176.2808 60 S 4.7258 7.4822 110.0830 56.5555 65.8643 172.1441 61 P 4.6902 0.0000 0.0000 63.6722 32.2879 175.8471 62 E 4.9795 7.9152 119.6123 54.9975 32.6024 173.7894 63 F 4.8826 7.9649 119.9062 56.6961 41.6668 172.7113 64 S 5.2845 8.7663 114.1392 57.3248 66.9915 173.6930 65 V 4.7672 8.7805 114.3031 60.3055 36.4969 174.1930 66 T 5.1142 8.3709 118.2141 62.3567 70.2745 174.6643 67 R 4.9520 9.3288 123.9336 54.7723 34.9433 174.4144 68 Q 5.1407 9.4580 120.9132 54.5596 31.8012 176.1852 69 H 4.2887 9.4847 119.9911 60.1758 29.6681 176.9042 70 E 4.1265 8.6086 119.4242 59.7917 29.2199 179.1416 71 D 4.7065 8.6411 118.9706 57.5335 40.8878 178.7389 72 F 4.2611 8.9434 117.9862 60.5756 38.9215 177.7647 73 V 3.5750 8.1213 118.1117 65.4426 31.2439 177.7619 74 W 4.2315 8.6227 128.3797 60.4366 30.5607 177.6035 75 L 3.0791 8.2307 119.9996 58.2122 41.4849 178.2293 76 H 4.1685 8.4285 118.2403 59.5484 29.7862 176.7879 77 D 4.2681 8.4340 120.9379 57.5718 40.4054 178.6727 78 T 3.6350 7.5506 112.8101 65.0604 67.5189 175.8324 79 L 4.2040 7.7999 121.0498 58.0715 41.4785 179.6792 80 T 3.9468 7.8245 108.4994 64.3232 68.7656 175.5622 81 E 4.4342 7.9397 119.1179 56.3006 30.0880 177.1021 82 T 4.0114 7.4758 118.1282 62.7351 69.0336 175.3033 83 T 3.8659 8.2768 117.8106 64.6321 69.0601 176.0560 84 D 4.4819 7.7337 119.8225 56.2203 41.1546 176.0874 85 Y 4.8258 7.7818 116.9405 57.7821 37.9452 177.2948 86 A 3.9690 7.8956 125.5179 55.1319 18.4492 179.5079 87 G 3.9172 8.0743 101.8738 45.8644 0.0000 173.1252 88 L 4.7131 7.7059 119.4806 52.7056 44.2625 175.9130 89 I 4.2252 8.0146 121.6484 59.9977 37.9189 175.7885 90 I 4.0143 8.1194 127.1576 59.6284 37.9528 174.2860 91 P 4.5234 0.0000 0.0000 61.5384 32.0489 174.4708 92 P 4.3132 0.0000 0.0000 62.2748 31.9164 176.1631 93 A 3.1636 7.7912 123.5522 51.2065 18.8180 175.8933 94 P 4.2802 0.0000 0.0000 62.0719 31.9873 176.4488 95 T 4.1439 7.8363 109.9238 60.3983 69.9154 174.4091 96 K 3.4285 8.1982 124.0458 55.4973 32.6894 174.9628 97 P 3.9523 0.0000 0.0000 63.1173 31.6728 175.6982 98 D 4.3027 7.6373 120.8179 53.2181 42.5977 174.1164 99 F 4.6737 8.4201 124.4010 57.4454 39.6251 177.7662 100 D 4.5514 8.6835 124.6007 57.7026 40.5050 178.8194 101 G 3.5942 8.0564 105.8791 47.3187 0.0000 173.7888 102 P 4.3711 0.0000 0.0000 65.0810 31.3747 178.3866 103 R 3.9353 8.2280 118.5592 59.3227 30.0628 178.1595 104 E 3.9876 8.2777 119.1424 59.2287 29.5520 178.9533 105 K 4.0395 8.1192 118.5538 59.5793 32.0239 179.1998 106 M 4.0360 8.3980 119.3943 58.5137 31.7554 178.6262 107 Q 3.9762 8.1728 119.6410 58.9904 28.9857 178.4596 108 K 3.9851 7.8343 118.6429 59.2364 32.3591 178.5532 109 L 4.2660 8.2956 121.1914 58.4969 41.4607 179.2769 110 G 3.8550 8.3960 105.4277 48.1079 0.0000 175.3182 111 E 4.2834 8.1194 119.7357 58.1183 29.6492 178.4671 112 G 4.0544 8.0810 104.8259 44.4226 0.0000 174.8882 113 E 3.7897 7.8375 122.5839 59.0702 29.3694 179.1626 114 G 3.6157 8.0012 105.5856 47.7477 0.0000 173.8505 115 S 4.6019 8.0602 114.7513 58.4561 63.6562 173.4982 116 M 4.9102 7.3822 117.0972 52.4368 34.1181 175.9872 117 T 4.1178 8.1479 109.8237 61.5281 70.9146 175.3698 118 K 3.9627 8.5731 121.5444 59.6226 32.1129 179.2032 119 E 3.9354 8.1347 119.0538 59.2834 29.6654 178.3572 120 E 3.9479 8.2931 119.3394 59.1268 29.6939 178.3987 121 F 4.0553 8.5304 120.6212 61.4523 39.4990 177.0063 122 A 4.0237 8.3770 120.4015 54.8495 18.1271 179.5737 123 K 3.8473 8.1460 118.2451 60.0394 32.2679 179.1069 124 M 4.0356 8.1079 119.0579 57.9000 31.8139 178.6106 125 K 3.6215 8.0198 120.3318 59.6112 32.3786 178.7158 126 Q 3.9647 7.9534 119.6879 58.9764 28.9024 178.0003 127 E 3.9625 8.1852 119.7968 59.4723 29.4663 179.3358 128 L 4.0636 8.1030 119.1007 57.7818 41.5443 179.4677 129 E 3.9783 8.3671 118.4977 59.2405 29.3371 179.1878 130 A 4.0204 8.2267 120.9950 54.8719 18.3884 179.0045 131 E 3.8961 8.3444 117.9697 59.7828 29.7088 178.4207 132 Y 4.0510 8.3482 119.3873 60.9471 38.8165 178.1458 133 L 4.3226 8.5392 119.7317 57.8769 41.6857 179.4862 134 A 4.0296 8.2614 120.8345 55.0934 18.3523 179.7491 135 V 3.4736 8.0056 116.8645 66.0414 31.4864 178.0904 136 F 4.5676 8.4039 120.3044 61.4145 39.2860 176.9472 137 K 3.9028 8.5439 119.7020 59.3988 31.8629 178.6184 138 K 3.9307 8.1700 119.8952 59.8556 32.1631 178.7918 139 T 3.8864 8.1364 113.4042 64.8948 67.1219 176.3351 140 V 3.8102 8.2700 120.5039 66.2122 31.7012 178.0098 141 S 4.0964 8.2614 112.9190 61.4737 62.4487 175.9255 142 S 4.0764 8.3579 116.1948 61.6859 61.5028 175.8667 143 H 3.9999 8.1083 118.7219 58.1774 28.4525 177.3928 144 E 4.0665 8.5384 121.5343 59.3558 29.5757 178.8221 145 V 3.5910 7.8779 118.3285 66.0103 31.5005 177.4761 146 F 4.2462 7.8743 119.2122 61.6405 39.1721 177.2334 147 L 3.7992 7.8348 117.5989 57.8346 41.3018 179.5617 148 Q 4.1170 8.3063 119.5489 58.3605 28.3925 178.8578 149 R 3.8779 8.1859 118.7737 59.2066 30.4084 178.7476 150 L 3.7258 7.5199 118.9466 57.6123 41.2220 179.7742 151 S 4.4137 8.1496 114.3915 60.9224 62.7006 175.7348 152 S 4.5735 7.5406 115.4311 57.8775 63.8398 173.4556 153 H 4.3909 7.5379 124.6374 54.7113 30.2531 174.1715 154 P 4.3644 0.0000 0.0000 64.8024 31.9881 177.6800 155 V 4.0820 7.9060 117.6185 65.0216 32.4239 177.5365 156 L 3.6790 7.5706 118.2629 57.3924 41.1955 179.3177 157 S 4.4798 7.9824 113.2542 60.5487 62.9456 175.6246 158 K 4.4509 7.7784 120.3041 55.4272 32.7778 176.1299 159 D 4.5464 7.7638 121.2995 53.7784 41.9823 176.9048 160 R 3.8526 8.7867 126.1231 59.7291 29.9909 178.4480 161 N 4.6262 8.3605 115.9158 56.1399 38.6097 176.9684 162 F 4.5142 8.6585 122.2315 61.7314 39.5881 176.8119 163 H 4.1652 8.6946 115.9638 58.9696 28.4786 177.8737 164 V 3.6580 8.1944 120.0245 66.0737 31.1581 177.5970 165 F 4.1738 8.6867 119.4881 61.6374 39.2738 176.8101 166 L 4.2963 8.1849 117.4086 56.8404 41.5733 177.6324 167 E 4.2366 7.9748 116.4934 56.9449 31.3222 175.4255 168 Y 4.3988 8.0817 120.1648 57.0380 38.7939 175.6467 169 D 4.5109 8.1532 132.4982 53.0795 40.1947 174.3453 170 Q 4.1975 6.3789 117.8722 53.8142 33.2875 175.3336 171 D 4.4613 8.2265 118.4902 53.4835 40.3000 176.4468 172 L 3.8947 8.4599 128.1370 57.7398 42.0161 179.5812 173 S 4.2154 8.3872 112.7122 61.2642 63.2575 174.6320 174 V 3.8315 7.0884 118.0016 61.0259 31.2930 175.9074 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 20 S 8.32 4.45 0.00 3.99 4.04 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 21 V 7.62 3.56 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.93 0.00 0.00 22 S 8.15 4.52 0.00 3.79 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 23 V 7.80 4.41 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 0.83 0.00 0.00 0.93 0.00 0.00 24 D 8.68 4.57 0.00 2.69 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 25 L 8.41 4.70 0.00 1.61 1.57 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.65 4.90 0.00 2.65 2.68 0.00 0.00 6.79 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 27 V 8.17 4.15 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 0.84 0.00 0.00 0.93 0.00 0.00 28 D 8.91 4.38 0.00 2.81 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 29 P 0.00 4.41 0.00 2.16 2.05 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.95 0.00 30 S 8.52 4.63 0.00 3.96 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 0.00 31 L 7.67 4.85 0.00 1.64 1.57 0.58 0.87 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 32 Q 9.23 4.57 0.00 1.87 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.53 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 33 I 8.47 5.05 1.93 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.56 1.01 0.00 0.00 34 D 9.22 4.94 0.00 2.84 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 35 I 9.49 5.41 2.01 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.86 1.27 0.00 0.00 36 P 0.00 4.52 0.00 2.16 2.30 0.00 4.09 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.89 0.00 37 D 7.70 4.86 0.00 2.69 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 38 A 8.33 5.21 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 39 L 8.99 4.89 0.00 1.77 1.50 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.85 5.07 0.00 2.98 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 41 E 8.93 4.56 0.00 1.96 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 42 R 9.56 3.78 0.00 1.85 1.91 0.00 3.28 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 43 D 7.80 4.30 0.00 2.88 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 44 K 7.80 4.57 0.00 1.75 1.72 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.52 7.81 45 V 8.32 4.61 1.73 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 -0.15 0.00 0.00 0.78 0.00 0.00 46 K 8.94 4.70 0.00 1.68 1.73 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.38 7.81 47 F 9.53 5.04 0.00 3.34 3.19 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 48 T 8.90 4.77 4.46 0.00 0.00 0.00 0.00 0.00 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 49 V 8.98 4.72 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 1.07 0.00 0.00 1.19 0.00 0.00 50 H 9.29 5.34 0.00 3.17 3.37 0.00 5.59 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 8.30 4.63 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 0.51 0.00 0.00 52 K 8.42 4.84 0.00 1.50 1.54 0.00 1.64 0.00 0.00 1.50 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.20 1.03 7.81 53 T 8.85 5.04 3.81 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 1.03 0.00 0.00 54 T 8.81 4.65 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 1.21 0.00 0.00 55 L 8.11 4.49 0.00 2.11 1.82 1.15 1.00 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 56 P 0.00 4.70 0.00 2.21 2.20 0.00 3.84 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 57 T 7.85 4.04 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 1.19 0.00 0.00 58 F 7.56 4.68 0.00 3.22 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 9.02 4.16 0.00 1.91 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.66 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 60 S 7.48 4.73 0.00 4.00 3.83 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 61 P 0.00 4.69 0.00 2.13 2.24 0.00 3.97 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 2.14 1.97 0.00 62 E 7.92 4.98 0.00 1.88 1.77 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 2.19 2.34 0.00 63 F 7.96 4.88 0.00 3.11 3.10 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 64 S 8.77 5.28 0.00 3.76 3.78 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 65 V 8.78 4.77 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 0.88 0.00 0.00 0.97 0.00 0.00 66 T 8.37 5.11 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 1.26 0.00 0.00 67 R 9.33 4.95 0.00 1.89 1.82 0.00 2.55 0.00 0.00 3.02 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.86 0.00 68 Q 9.46 5.14 0.00 2.15 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.71 0.00 0.00 0.00 0.00 0.00 2.57 2.40 0.00 69 H 9.48 4.29 0.00 3.50 3.53 0.00 5.89 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 70 E 8.61 4.13 0.00 2.24 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 0.00 2.51 2.59 0.00 71 D 8.64 4.71 0.00 3.17 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 72 F 8.94 4.26 0.00 3.13 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 73 V 8.12 3.58 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 1.10 0.00 0.00 0.89 0.00 0.00 74 W 8.62 4.23 0.00 3.56 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 75 L 8.23 3.08 0.00 1.85 1.77 0.81 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 76 H 8.43 4.17 0.00 3.10 3.21 0.00 5.65 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 77 D 8.43 4.27 0.00 2.84 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 78 T 7.55 3.64 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 79 L 7.80 4.20 0.00 1.78 1.69 0.71 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 80 T 7.82 3.95 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 81 E 7.94 4.43 0.00 1.96 1.99 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 2.30 2.40 0.00 82 T 7.48 4.01 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 0.18 0.00 0.00 83 T 8.28 3.87 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 1.21 0.00 0.00 84 D 7.73 4.48 0.00 2.38 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 85 Y 7.78 4.83 0.00 3.10 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 86 A 7.90 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 G 8.07 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 88 L 7.71 4.71 0.00 1.61 1.41 0.54 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.01 4.23 1.86 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 1.40 0.51 0.90 0.00 0.00 90 I 8.12 4.01 1.86 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 1.43 0.70 0.89 0.00 0.00 91 P 0.00 4.52 0.00 2.33 2.05 0.00 3.65 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 1.90 1.76 0.00 92 P 0.00 4.31 0.00 2.13 2.07 0.00 3.83 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 1.99 1.96 0.00 93 A 7.79 3.16 0.81 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 0.00 0.00 94 P 0.00 4.28 0.00 1.36 1.66 0.00 2.71 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.35 0.00 95 T 7.84 4.14 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 1.12 0.00 0.00 96 K 8.20 3.43 0.00 1.63 1.66 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.38 7.81 97 P 0.00 3.95 0.00 2.02 1.80 0.00 3.62 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 98 D 7.64 4.30 0.00 2.42 2.33 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 99 F 8.42 4.67 0.00 3.07 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 0.00 100 D 8.68 4.55 0.00 2.89 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 0.00 101 G 8.06 3.59 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 0.00 0.00 0.00 102 P 0.00 4.37 0.00 2.55 2.45 0.00 3.75 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.08 0.00 103 R 8.23 3.94 0.00 2.35 2.04 0.00 3.15 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.73 0.00 104 E 8.28 3.99 0.00 2.19 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 0.00 2.32 2.37 0.00 105 K 8.12 4.04 0.00 2.05 1.85 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.63 7.81 106 M 8.40 4.04 0.00 2.03 2.29 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.52 0.00 107 Q 8.17 3.98 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 108 K 7.83 3.99 0.00 1.97 1.88 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.66 7.81 109 L 8.30 4.27 0.00 1.79 1.83 0.93 0.60 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 0.00 110 G 8.40 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 0.00 111 E 8.12 4.28 0.00 2.11 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 0.00 2.36 2.34 0.00 112 G 8.08 4.05 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 0.00 0.00 0.00 0.00 113 E 7.84 3.79 0.00 1.71 1.66 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 1.71 1.47 0.00 114 G 8.00 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 0.00 115 S 8.06 4.60 0.00 4.00 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 0.00 116 M 7.38 4.91 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.81 0.00 117 T 8.15 4.12 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 0.00 118 K 8.57 3.96 0.00 1.81 1.94 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.44 7.81 119 E 8.13 3.94 0.00 2.05 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 2.40 2.39 0.00 120 E 8.29 3.95 0.00 2.17 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 2.34 2.40 0.00 121 F 8.53 4.06 0.00 3.24 3.23 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 0.00 122 A 8.38 4.02 1.44 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 0.00 0.00 123 K 8.15 3.85 0.00 1.95 1.94 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.42 1.47 7.81 124 M 8.11 4.04 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.51 0.00 125 K 8.02 3.62 0.00 1.27 1.73 0.00 1.56 0.00 0.00 1.52 0.00 0.00 2.92 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.31 1.24 7.81 126 Q 7.95 3.96 0.00 2.27 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 127 E 8.19 3.96 0.00 2.21 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 2.31 2.60 0.00 128 L 8.10 4.06 0.00 1.77 1.73 0.90 0.96 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 0.00 129 E 8.37 3.98 0.00 2.16 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 2.24 2.36 0.00 130 A 8.23 4.02 1.40 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 0.00 0.00 0.00 131 E 8.34 3.90 0.00 2.10 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 2.36 2.37 0.00 132 Y 8.35 4.05 0.00 3.22 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 0.00 133 L 8.54 4.32 0.00 1.96 1.81 0.98 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 134 A 8.26 4.03 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 0.00 135 V 8.01 3.47 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 0.40 0.00 0.00 0.92 0.00 0.00 136 F 8.40 4.57 0.00 3.49 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 0.00 137 K 8.54 3.90 0.00 1.86 1.97 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.46 7.81 138 K 8.17 3.93 0.00 2.00 1.92 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.44 7.81 139 T 8.14 3.89 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 1.52 0.00 0.00 140 V 8.27 3.81 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 1.15 0.00 0.00 1.20 0.00 0.00 141 S 8.26 4.10 0.00 4.04 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 0.00 142 S 8.36 4.08 0.00 3.85 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 0.00 143 H 8.11 4.00 0.00 2.86 2.41 0.00 5.87 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 E 8.54 4.07 0.00 2.16 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 2.37 2.40 0.00 145 V 7.88 3.59 2.18 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 0.93 0.00 0.00 0.97 0.00 0.00 146 F 7.87 4.25 0.00 3.14 3.28 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 0.00 147 L 7.83 3.80 0.00 2.05 1.89 1.31 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 148 Q 8.31 4.12 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 149 R 8.19 3.88 0.00 1.80 1.92 0.00 3.21 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 150 L 7.52 3.73 0.00 1.00 0.34 -0.19 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 151 S 8.15 4.41 0.00 4.17 4.42 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 0.00 152 S 7.54 4.57 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 0.00 153 H 7.54 4.39 0.00 3.08 3.13 0.00 5.59 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 P 0.00 4.36 0.00 2.19 2.13 0.00 3.30 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 1.86 1.84 0.00 155 V 7.91 4.08 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 0.99 0.00 0.00 0.94 0.00 0.00 156 L 7.57 3.68 0.00 1.34 1.24 0.48 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 157 S 7.98 4.48 0.00 4.28 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 0.00 158 K 7.78 4.45 0.00 1.92 1.90 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.48 1.62 7.81 159 D 7.76 4.55 0.00 2.89 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 0.00 160 R 8.79 3.85 0.00 1.87 1.94 0.00 3.44 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 161 N 8.36 4.63 0.00 2.94 2.73 0.00 0.00 6.78 8.13 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 0.00 162 F 8.66 4.51 0.00 2.96 3.38 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 0.00 0.00 0.00 0.00 163 H 8.69 4.17 0.00 3.31 3.42 0.00 5.70 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 V 8.19 3.66 2.48 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 1.06 0.00 0.00 1.00 0.00 0.00 165 F 8.69 4.17 0.00 3.57 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 L 8.18 4.30 0.00 2.01 1.95 0.32 0.93 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 0.00 167 E 7.97 4.24 0.00 2.00 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 1.63 2.51 0.00 168 Y 8.08 4.40 0.00 2.73 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 0.00 169 D 8.15 4.51 0.00 2.59 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 Q 6.38 4.20 0.00 0.97 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.95 0.00 0.00 0.00 0.00 0.00 1.41 1.79 0.00 171 D 8.23 4.46 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 0.00 172 L 8.46 3.89 0.00 1.78 1.43 0.77 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 173 S 8.39 4.22 0.00 4.02 4.03 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 0.00 174 V 7.09 3.83 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 0.64 0.00 0.00 0.92 0.00 0.00