NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.4468 8.4293 116.2201 55.1366 30.3874 173.2720 2 C 4.2000 7.7413 114.1712 56.9585 29.9866 172.1312 3 D 4.6042 8.3808 118.3378 55.0498 40.1233 175.6332 4 L 4.0832 8.0192 120.1072 57.1853 42.2550 175.7130 5 P 4.5512 0.0000 0.0000 62.4683 32.1292 175.6427 6 C 4.1847 8.5200 114.6637 58.2189 30.4814 174.9187 7 G 3.9353 8.1926 107.1613 45.4615 0.0000 172.7599 8 V 4.2966 7.1735 119.1366 61.0807 32.7126 174.5235 9 Y 4.8095 8.2003 123.4175 56.8003 42.1718 174.1808 10 D 3.9002 8.0815 119.7786 51.5120 44.2003 174.5604 11 P 4.0786 0.0000 0.0000 64.8601 31.1874 178.1403 12 A 3.9836 8.6190 120.4452 54.9987 17.8669 179.7421 13 Q 3.7510 8.0099 116.5199 59.0531 28.7387 178.5623 14 A 4.0673 7.8183 121.2101 55.2528 18.4645 179.4799 15 R 3.8154 8.2602 117.4731 59.6287 30.1636 178.6064 16 I 3.8068 7.9796 118.5458 63.9693 37.9526 177.7609 17 E 3.9524 8.0124 119.2313 59.4135 29.3486 179.1940 18 A 4.0572 8.2665 120.8848 55.0675 18.2983 179.5457 19 E 3.9574 8.7617 117.9640 59.5844 29.4736 179.6997 20 S 4.1078 8.2976 114.4312 61.2527 62.9810 176.6315 21 V 3.5438 7.8863 121.8555 65.8225 31.2111 178.0189 22 K 4.1423 8.1627 119.0581 59.3646 31.9273 178.5987 23 A 4.1531 8.2932 121.4206 55.1085 18.3025 179.7943 24 V 3.5279 8.1896 117.1163 66.1980 31.7235 178.1029 25 Q 4.0159 8.1963 117.8212 59.2070 28.5926 178.9427 26 E 4.0034 8.4461 119.5354 59.5078 29.4880 179.6748 27 K 4.1346 8.4805 118.6225 59.6411 31.8639 179.2230 28 M 4.2990 8.1186 117.8893 57.7978 31.8991 177.8941 29 A 4.3620 8.0043 119.8365 53.3358 18.8380 177.9877 30 G 3.8448 7.8347 104.7697 45.1520 0.0000 173.6444 31 N 4.4838 7.7538 118.6607 52.9500 39.8610 173.2228 32 D 4.6981 8.6142 124.9457 53.3505 40.2391 176.6960 33 D 4.4150 8.4936 121.2107 54.2241 42.2438 174.7963 34 P 4.2777 0.0000 0.0000 66.0640 31.3778 178.1003 35 H 4.1541 8.3529 116.4462 59.1972 29.7546 176.8799 36 F 4.0810 8.4194 121.8949 61.4799 39.2773 176.8950 37 Q 3.9119 8.5341 118.0166 59.3643 28.4285 179.3850 38 T 3.8012 8.0400 116.5102 66.6757 68.5070 176.8815 39 R 3.7544 7.9528 119.8577 59.2288 30.0734 178.9248 40 A 3.7199 7.7607 120.6954 55.3731 18.2762 179.8195 41 T 3.7430 7.8173 114.1378 66.6143 68.6237 176.9115 42 V 3.5270 7.8396 120.2422 66.2624 31.4998 178.2350 43 I 3.9134 7.8274 119.4409 64.0403 36.8910 178.1058 44 K 3.8097 8.4002 121.0119 59.6019 31.9479 178.3001 45 E 3.8913 8.1465 119.3604 59.4081 29.5332 178.8793 46 Q 3.9642 7.9522 117.7178 59.1454 28.8015 179.0138 47 R 3.9758 8.2578 118.9458 58.9009 30.0400 178.9079 48 A 3.9882 8.2632 121.0212 55.1025 18.4022 179.2589 49 E 3.8622 8.1562 117.8040 59.4045 29.6636 179.0249 50 L 3.9286 7.9674 118.8343 57.6615 41.5886 179.2800 51 A 4.0434 8.1541 120.6964 55.1766 18.2414 179.7908 52 K 3.8745 8.2377 117.0224 59.7485 32.0699 178.8845 53 H 4.0983 8.2533 118.3882 59.7635 29.7843 176.9208 54 H 4.2154 8.2464 117.8857 58.8911 28.5915 178.0248 55 V 3.6271 8.0917 120.1476 66.0599 31.4086 177.9032 56 S 4.2950 8.4397 113.2956 61.5630 62.1129 176.3751 57 V 3.7295 8.0883 120.9419 65.9297 31.2134 177.7684 58 L 3.9467 8.0836 118.8514 57.7432 41.2805 179.4912 59 W 4.7065 8.2729 126.9989 60.7114 30.8331 177.8584 60 S 4.0354 8.7576 113.3271 60.3285 62.8138 175.0401 61 D 4.7617 8.2195 120.7771 55.7313 42.0862 177.3056 62 Y 3.4501 7.5337 118.4597 60.1027 39.0584 175.6070 63 F 4.1831 7.8934 118.1087 57.1611 39.6581 174.9088 64 K 4.6485 7.8991 122.2411 53.0753 36.2100 175.3294 65 P 4.4410 0.0000 0.0000 65.7434 31.1413 177.1472 66 P 4.2524 0.0000 0.0000 66.1569 30.9226 178.1447 67 H 4.3965 7.9993 116.2471 58.7471 28.3822 177.6968 68 F 4.4351 7.5285 118.1416 60.0423 38.8119 177.0440 69 E 4.1052 8.1130 118.7893 59.2077 29.5971 178.4095 70 K 4.0743 7.9659 118.3743 57.7739 33.5354 176.2613 71 Y 4.7948 8.2770 117.8018 54.0200 37.5838 174.2174 72 P 4.5834 0.0000 0.0000 64.5637 31.9123 178.0514 73 E 4.2719 8.1632 116.4714 57.4280 30.5920 178.2677 74 L 4.0216 8.2898 122.4353 58.5262 42.0854 178.2172 75 H 4.2935 8.2360 115.7053 59.2233 28.7151 177.4571 76 Q 3.8743 8.0571 120.6565 58.7252 28.8275 177.6122 77 L 3.8674 8.1382 121.8375 58.1818 42.1209 179.2299 78 V 3.4071 7.7786 118.1728 65.8120 31.4122 177.3783 79 N 3.9571 7.8187 116.7679 56.7799 38.6725 176.5288 80 D 4.0816 8.1663 120.5547 57.4133 40.7751 178.9501 81 T 3.4753 7.6273 116.3680 66.5183 68.4334 176.7036 82 L 3.9382 7.7916 120.8514 57.7774 41.5401 179.8278 83 K 3.9237 8.0709 118.1646 59.1949 31.8859 179.3087 84 A 4.0114 8.0328 121.4552 55.3332 18.1744 179.6206 85 M 4.0580 8.0269 117.3933 58.4776 32.1444 179.0610 86 S 4.0775 8.2858 115.3156 61.5778 62.7608 176.6288 87 A 4.0165 8.0010 122.4633 55.0091 18.4736 179.2641 88 A 4.2255 8.1559 120.8083 54.5419 18.2101 179.7037 89 K 3.9246 8.1306 116.6436 59.7705 32.3388 179.0199 90 G 3.8230 7.7346 101.7298 44.7724 0.0000 173.2454 91 S 4.7380 7.3215 114.2455 56.4188 65.3813 173.7905 92 K 4.2249 8.5108 123.7442 56.7121 32.7023 176.2815 93 D 4.5541 8.2325 120.9276 52.8388 41.2167 175.1154 94 P 4.9080 0.0000 0.0000 64.7224 31.1812 178.2586 95 A 4.0166 8.5497 120.3805 55.1821 18.0432 179.7610 96 T 3.9579 8.3162 108.9170 64.9132 68.9458 177.1945 97 G 3.6269 8.1952 108.2460 47.5211 0.0000 175.2783 98 Q 3.9774 8.4845 122.3042 58.7018 29.0891 178.0911 99 K 3.8262 8.3467 120.6945 59.5495 32.2207 178.6187 100 A 4.2251 8.0407 120.7399 55.1653 18.2434 179.5654 101 L 3.9820 8.0279 117.5937 58.1168 41.5580 179.5006 102 D 4.3318 8.5037 119.2236 57.4551 40.7168 178.4521 103 Y 4.2167 8.0103 117.2529 61.2422 37.9244 178.5793 104 I 3.7752 8.1370 120.5539 64.4474 37.2007 178.3438 105 A 4.1944 8.3036 121.6114 55.1921 18.0078 179.7650 106 Q 4.0151 7.9046 116.9109 59.0690 28.7257 178.8860 107 I 3.7537 7.8940 120.8951 64.4731 37.1968 177.9316 108 D 4.3657 8.7663 119.1942 57.1934 41.0988 178.1587 109 K 4.1087 8.3141 120.1277 59.6375 32.1588 178.8665 110 I 3.4664 7.5723 120.0507 64.1684 36.8314 177.7960 111 F 4.0057 8.6194 121.9123 61.5732 39.0943 177.4469 112 W 4.3712 8.4478 118.0271 59.5417 28.6859 178.5217 113 E 4.1194 8.3795 119.1225 59.5972 28.7897 179.1097 114 T 4.2161 7.9850 107.6216 63.6006 68.9655 175.9384 115 K 4.1860 7.3814 120.8993 58.3021 32.4927 178.4405 116 K 4.0966 8.0524 118.3219 57.8127 32.1033 176.6532 117 A 4.1183 7.3336 123.6607 53.1073 20.5069 175.8405 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 H 8.43 4.45 0.00 3.22 3.30 0.00 5.48 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 2 C 7.74 4.20 0.00 3.14 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 3 D 8.38 4.60 0.00 2.88 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 8.02 4.08 0.00 1.60 1.75 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.55 0.00 2.26 2.08 0.00 3.81 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 2.00 1.97 0.00 6 C 8.52 4.18 0.00 3.00 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 7 G 8.19 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 8 V 7.17 4.30 1.91 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 0.87 0.00 0.00 0.90 0.00 0.00 9 Y 8.20 4.81 0.00 2.80 2.50 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 10 D 8.08 3.90 0.00 2.64 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 0.00 0.00 0.00 0.00 11 P 0.00 4.08 0.00 2.23 1.88 0.00 2.98 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 1.66 1.17 0.00 12 A 8.62 3.98 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 13 Q 8.01 3.75 0.00 1.81 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.22 2.21 0.00 14 A 7.82 4.07 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 15 R 8.26 3.82 0.00 1.95 1.94 0.00 3.12 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 16 I 7.98 3.81 1.87 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 1.53 1.19 0.97 0.00 0.00 17 E 8.01 3.95 0.00 2.18 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 0.00 2.56 2.55 0.00 18 A 8.27 4.06 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 19 E 8.76 3.96 0.00 2.12 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 2.54 2.47 0.00 20 S 8.30 4.11 0.00 4.05 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 21 V 7.89 3.54 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 0.99 0.00 0.00 0.98 0.00 0.00 22 K 8.16 4.14 0.00 1.89 1.79 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.60 7.81 23 A 8.29 4.15 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 24 V 8.19 3.53 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 1.00 0.00 0.00 1.00 0.00 0.00 25 Q 8.20 4.02 0.00 2.32 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.57 0.00 26 E 8.45 4.00 0.00 2.20 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 2.34 2.53 0.00 27 K 8.48 4.13 0.00 2.05 2.15 0.00 1.78 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.75 7.81 28 M 8.12 4.30 0.00 2.04 2.33 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.49 0.00 29 A 8.00 4.36 1.38 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 0.00 0.00 30 G 7.83 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 31 N 7.75 4.48 0.00 2.31 2.30 0.00 0.00 7.08 8.47 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 32 D 8.61 4.70 0.00 2.83 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 33 D 8.49 4.41 0.00 2.90 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 34 P 0.00 4.28 0.00 2.24 2.12 0.00 3.70 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 35 H 8.35 4.15 0.00 3.26 3.59 0.00 5.87 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.42 4.08 0.00 3.11 3.20 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 37 Q 8.53 3.91 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 38 T 8.04 3.80 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 1.18 0.00 0.00 39 R 7.95 3.75 0.00 1.71 1.83 0.00 3.02 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 40 A 7.76 3.72 0.92 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 41 T 7.82 3.74 4.33 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 1.18 0.00 0.00 42 V 7.84 3.53 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 0.99 0.00 0.00 0.95 0.00 0.00 43 I 7.83 3.91 1.86 0.00 0.00 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 1.37 0.41 0.88 0.00 0.00 44 K 8.40 3.81 0.00 1.80 1.98 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.15 3.89 0.00 2.27 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 2.29 2.38 0.00 46 Q 7.95 3.96 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 47 R 8.26 3.98 0.00 1.81 2.09 0.00 3.28 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.78 0.00 48 A 8.26 3.99 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 49 E 8.16 3.86 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 2.29 2.38 0.00 50 L 7.97 3.93 0.00 1.92 1.66 0.92 0.69 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 51 A 8.15 4.04 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 52 K 8.24 3.87 0.00 1.99 1.87 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.64 7.81 53 H 8.25 4.10 0.00 3.23 3.41 0.00 5.79 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 54 H 8.25 4.22 0.00 3.36 3.29 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.09 3.63 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 1.00 0.00 0.00 1.01 0.00 0.00 56 S 8.44 4.30 0.00 4.03 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 57 V 8.09 3.73 2.25 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 1.28 0.00 0.00 0.84 0.00 0.00 58 L 8.08 3.95 0.00 2.09 1.78 0.81 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.27 4.71 0.00 3.45 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 60 S 8.76 4.04 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 61 D 8.22 4.76 0.00 3.05 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 62 Y 7.53 3.45 0.00 1.43 2.49 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 63 F 7.89 4.18 0.00 3.26 2.25 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 64 K 7.90 4.65 0.00 1.39 1.49 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.66 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.24 1.10 7.81 65 P 0.00 4.44 0.00 2.14 2.17 0.00 3.54 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 2.13 2.25 0.00 66 P 0.00 4.25 0.00 2.13 2.23 0.00 3.41 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 1.73 1.91 0.00 67 H 8.00 4.40 0.00 2.82 3.26 0.00 5.63 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 7.53 4.44 0.00 3.04 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 69 E 8.11 4.11 0.00 1.98 2.15 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 2.30 2.33 0.00 70 K 7.97 4.07 0.00 1.70 1.53 0.00 1.65 0.00 0.00 1.48 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.36 1.11 7.81 71 Y 8.28 4.79 0.00 3.12 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 72 P 0.00 4.58 0.00 2.21 2.22 0.00 3.78 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 73 E 8.16 4.27 0.00 2.19 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 2.41 2.30 0.00 74 L 8.29 4.02 0.00 1.86 1.94 0.62 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.24 4.29 0.00 3.23 3.31 0.00 5.67 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 76 Q 8.06 3.87 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.90 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 77 L 8.14 3.87 0.00 1.89 1.89 1.16 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 78 V 7.78 3.41 1.60 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 0.55 0.00 0.00 1.03 0.00 0.00 79 N 7.82 3.96 0.00 2.59 2.69 0.00 0.00 7.25 8.11 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 80 D 8.17 4.08 0.00 2.34 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 0.00 0.00 0.00 81 T 7.63 3.48 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 82 L 7.79 3.94 0.00 1.66 1.62 0.76 0.80 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 83 K 8.07 3.92 0.00 1.80 1.78 0.00 1.56 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.45 7.81 84 A 8.03 4.01 1.47 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 0.00 0.00 85 M 8.03 4.06 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.84 0.00 86 S 8.29 4.08 0.00 4.01 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 A 8.00 4.02 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 88 A 8.16 4.23 1.38 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 0.00 0.00 89 K 8.13 3.92 0.00 1.94 2.01 0.00 1.69 0.00 0.00 1.93 0.00 0.00 3.20 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.62 7.81 90 G 7.73 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 S 7.32 4.74 0.00 3.86 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 92 K 8.51 4.22 0.00 1.79 1.84 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.41 7.81 93 D 8.23 4.55 0.00 2.68 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 4.91 0.00 2.20 2.10 0.00 3.94 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 95 A 8.55 4.02 1.34 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 0.00 0.00 96 T 8.32 3.96 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 97 G 8.20 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 98 Q 8.48 3.98 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 99 K 8.35 3.83 0.00 1.98 1.99 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.30 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.58 1.38 7.81 100 A 8.04 4.23 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 0.00 101 L 8.03 3.98 0.00 1.91 1.75 0.93 1.14 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 0.00 102 D 8.50 4.33 0.00 2.69 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.01 4.22 0.00 3.23 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 0.00 104 I 8.14 3.78 2.06 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.80 0.93 0.00 0.00 105 A 8.30 4.19 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 0.00 106 Q 7.90 4.02 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 107 I 7.89 3.75 2.08 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 1.46 0.90 1.11 0.00 0.00 108 D 8.77 4.37 0.00 2.88 2.94 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 0.00 109 K 8.31 4.11 0.00 1.96 2.01 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.58 7.81 110 I 7.57 3.47 1.83 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.39 -0.01 0.00 0.00 111 F 8.62 4.01 0.00 3.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.45 4.37 0.00 3.57 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 0.00 113 E 8.38 4.12 0.00 2.33 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 2.67 0.00 114 T 7.98 4.22 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 1.37 0.00 0.00 115 K 7.38 4.19 0.00 2.00 2.02 0.00 1.61 0.00 0.00 1.21 0.00 0.00 2.87 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.61 0.79 7.81 116 K 8.05 4.10 0.00 1.87 1.94 0.00 1.90 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.92 7.81 117 A 7.33 4.12 1.28 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