NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5138 8.3049 120.3266 54.6635 33.0794 175.4869 2 K 4.4112 8.1711 123.8712 55.6953 36.3241 174.6949 3 L 3.9756 8.6530 123.1591 58.2353 42.7450 180.4127 4 S 4.3956 7.7480 111.9132 57.9249 62.3970 174.0138 5 D 4.7723 7.8204 116.4836 54.8992 45.5015 175.8146 6 L 3.9363 8.4169 119.3060 54.6334 40.4200 176.2657 7 R 3.6985 8.8901 121.8421 55.6313 31.1253 174.9972 8 P 4.6705 0.0000 0.0000 61.6210 32.7040 175.1930 9 N 4.7733 8.3970 117.9713 52.4188 40.0969 174.5742 10 P 3.6365 0.0000 0.0000 63.6360 31.6579 176.8584 11 G 3.8187 8.8730 109.3715 47.0352 0.0000 172.6040 12 A 4.0954 8.8154 124.8802 52.6570 16.0099 178.9333 13 N 4.8163 7.4888 111.4124 53.4022 39.0594 175.4197 14 K 3.7002 8.7093 119.0818 60.2310 31.7470 180.8713 15 R 2.5898 8.4454 112.6406 54.7707 33.3282 177.0822 16 R 3.6980 6.8138 117.7036 57.3272 26.3185 176.2162 17 K 4.4582 7.6188 119.2432 55.4773 34.2630 177.4800 18 R 4.4924 7.9665 123.7815 56.8252 29.6584 174.8371 19 V 4.2105 7.8495 120.9757 64.3511 34.3187 172.6281 20 G 4.7072 8.3533 106.1873 45.0690 0.0000 174.5234 21 R 4.5086 7.8394 128.3424 55.5591 29.3872 177.1367 22 G 4.1065 8.4566 114.5556 45.7122 0.0000 170.2095 23 P 4.4886 0.0000 0.0000 61.8760 32.9065 175.4781 24 G 3.8867 8.4929 107.4981 43.9102 0.0000 173.5878 25 S 5.9652 8.9488 128.5431 58.7853 65.1524 179.3128 26 G 3.4913 6.4984 113.1572 48.3311 0.0000 177.8086 27 H 3.8597 7.1845 117.0628 56.9482 26.7235 172.4738 28 G 4.6792 8.2316 109.4746 44.8699 0.0000 175.1012 29 K 3.5169 9.0372 119.9086 58.1137 32.9346 176.6530 30 T 3.8720 5.7900 107.6050 63.6673 70.0515 176.3075 31 A 4.0790 8.1721 126.9769 53.4392 15.4066 177.2616 32 T 3.5476 7.8536 109.6813 62.2645 66.7042 172.4971 33 R 4.1704 7.7348 118.0727 56.2266 31.5308 176.4641 34 G 3.5768 8.3938 105.0856 46.8485 0.0000 170.3506 35 H 3.9991 6.9897 115.2856 53.4167 28.4599 179.6588 36 K 3.5054 7.8751 122.0425 59.1177 32.8228 173.8259 37 G 3.7279 8.4579 106.5251 47.8213 0.0000 171.5337 38 Q 4.2245 8.3362 135.0000 54.9475 28.1856 174.4395 39 K 3.8462 8.0604 123.0834 59.4444 32.6399 177.7006 40 S 4.5379 8.1002 111.7103 58.2128 62.9400 173.4415 41 R 4.4583 9.9027 120.2525 54.3497 31.8265 175.9273 42 S 4.1346 8.1268 113.3399 60.8641 62.7708 175.2841 43 G 3.9128 7.9720 111.8487 46.9422 0.0000 174.9226 44 G 3.9236 7.4437 106.6444 45.8600 0.0000 171.8410 45 L 4.4879 8.1591 126.2497 54.7031 42.5190 176.7985 46 K 4.3325 7.8727 117.7838 56.9548 32.6840 175.4399 47 D 4.3101 8.2505 122.0288 53.4656 38.8804 171.6442 48 P 4.4958 0.0000 0.0000 64.0968 31.7060 178.0784 49 R 4.3231 8.4203 114.2668 56.4709 29.9307 176.4550 50 R 4.4837 7.8255 116.4483 58.0336 33.3955 175.2936 51 F 4.5147 8.2270 118.9434 58.4507 39.6084 174.3550 52 E 4.3770 7.6934 125.5764 56.0607 30.5842 177.1206 53 G 3.8084 5.7192 105.1199 45.4169 0.0000 175.2707 54 G 3.9599 6.9057 106.9401 44.6523 0.0000 174.2728 55 R 3.9351 6.6320 119.7136 55.5107 30.5780 176.2695 56 S 4.1660 8.4583 120.4825 58.7571 62.0569 174.5932 57 T 4.8523 8.0626 116.6532 61.6257 68.5133 173.7878 58 T 4.7298 8.3117 114.3195 63.8691 67.9688 174.6098 59 L 4.5379 7.5157 118.8023 55.1872 42.6882 175.8579 60 M 4.3671 7.3250 115.0558 55.9393 32.4992 177.1566 61 R 3.9867 7.8132 117.1980 58.2216 30.6556 176.5431 62 L 3.9809 8.1649 117.6274 55.5631 40.2438 171.8465 63 P 4.7143 0.0000 0.0000 61.8662 32.7793 175.5794 64 K 4.5142 8.2321 117.0599 56.2508 34.4936 177.7788 65 R 4.0476 8.6594 115.7508 58.0121 29.8487 175.6638 66 G 3.7474 8.4640 105.3908 45.7334 0.0000 174.5003 67 M 3.6402 8.6816 124.7778 56.5707 30.0759 174.9383 68 Q 4.3264 7.9356 120.5713 54.6686 30.6798 176.4822 69 G 4.1326 8.1297 105.0145 44.8366 0.0000 172.9655 70 Q 4.7442 8.1283 119.9736 53.9680 31.6565 178.2341 71 V 3.4230 7.9210 120.2868 64.3735 32.4177 175.8758 72 P 4.2751 0.0000 0.0000 64.6162 31.6889 175.0164 73 G 3.7220 7.8959 103.1680 43.9608 0.0000 172.0777 74 E 4.0608 8.5883 122.1720 55.5117 30.2125 177.3137 75 I 3.8739 8.2375 120.3336 59.9916 38.0029 175.6635 76 K 4.0543 8.6107 125.9782 56.3712 31.7571 176.4868 77 R 4.7003 8.0778 119.6275 52.9983 32.6123 173.1535 78 P 4.0860 0.0000 0.0000 63.4701 31.6189 175.5256 79 R 4.6771 8.2497 120.2531 54.6177 32.8035 174.2963 80 Y 5.7389 8.5612 120.5039 55.5707 40.7572 174.8604 81 Q 4.3079 8.5713 123.7701 53.9477 31.6541 174.8371 82 G 4.5499 8.6938 114.3732 45.3967 0.0000 172.8955 83 V 4.5737 7.9691 121.2458 59.8391 34.6947 174.7748 84 N 5.7779 8.5582 120.8797 52.1952 39.6116 176.2485 85 L 3.9558 8.6014 120.8760 58.0688 41.5885 179.7359 86 K 3.8242 7.7613 117.2507 60.5654 32.4809 178.3555 87 D 4.3841 7.8191 119.3313 57.0233 40.8519 178.2509 88 L 3.7704 8.0464 118.4808 57.3975 40.6281 178.4026 89 A 4.0022 8.3001 121.8744 55.0831 18.2665 178.1915 90 R 3.2854 7.2544 114.2208 59.6261 30.2570 175.7941 91 F 4.5799 5.6999 115.7185 56.5419 39.5230 175.1407 92 E 4.7545 8.7672 122.3642 56.1229 30.8921 176.6295 93 G 4.3135 7.9317 113.3382 45.0071 0.0000 175.4951 94 E 4.3660 8.8999 121.2965 54.7176 31.2044 172.3755 95 V 3.3783 8.6944 127.6328 62.3641 32.6766 170.3184 96 T 4.5141 7.7405 114.1259 60.0386 70.8537 171.0485 97 P 4.4981 0.0000 0.0000 63.7741 32.2018 175.6663 98 E 4.2355 8.9780 123.1766 57.3883 28.8778 176.0034 99 L 3.8602 7.8018 117.5967 58.0641 42.3631 178.5174 100 L 4.2474 7.8729 119.0280 57.9401 41.5339 179.6327 101 V 3.5396 7.9591 118.5313 65.3515 30.7502 178.2330 102 R 4.0308 8.2971 116.9406 57.8196 30.0043 177.6521 103 A 4.5420 8.5050 119.5824 51.8392 19.3890 177.7802 104 G 3.9054 8.2702 106.3197 44.7720 0.0000 173.6518 105 L 4.6262 8.6798 118.6603 54.1121 43.7973 175.5855 106 L 5.2419 9.6364 133.0933 56.1802 39.6792 174.5295 107 K 4.3670 7.7043 113.1895 56.1732 30.2131 175.4361 108 K 4.0900 7.8491 119.4616 58.6646 32.3242 179.8813 109 G 3.8426 7.7605 112.3083 45.7742 0.0000 172.3131 110 Y 5.0779 8.8675 117.3533 55.7624 41.2537 175.9399 111 R 4.2284 9.3002 123.9114 55.0575 31.6863 175.7970 112 L 4.3148 8.8110 126.8054 55.2913 43.6374 175.5616 113 K 5.3909 8.9982 126.8369 53.2940 34.1437 175.1726 114 I 4.4552 7.7380 121.0831 60.5820 39.5470 175.0028 115 L 4.1075 8.9711 123.3586 56.7862 44.0739 173.6566 116 G 3.8520 8.9199 105.5019 45.5014 0.0000 172.7585 117 E 4.3100 8.6628 119.0228 55.4481 31.4113 174.8768 118 G 3.8608 7.9928 104.4863 44.1132 0.0000 172.2049 119 E 4.5100 8.3778 118.9838 54.2200 30.8615 176.8908 120 A 4.2891 8.4554 128.1280 51.8391 16.2196 175.3364 121 K 4.0090 8.0855 121.3760 55.5034 33.2290 176.5880 122 P 4.6740 0.0000 0.0000 61.8789 28.6312 174.0973 123 L 4.6204 7.2837 125.4887 55.0744 44.5093 175.5138 124 K 4.5201 8.6263 120.3167 57.0499 33.0963 177.4281 125 V 4.5152 7.9668 121.0257 61.3243 32.3813 171.3452 126 V 4.3186 8.3809 127.5078 62.9839 32.0408 174.7172 127 A 4.7183 9.3652 129.1112 50.7778 22.5228 176.2274 128 H 4.7587 9.1289 116.2550 58.4224 29.6511 176.0205 129 A 4.7373 7.5464 117.7511 50.7710 22.4852 175.3656 130 F 5.1694 8.5478 117.7640 53.8754 42.5239 176.1132 131 S 4.3014 8.5101 118.5561 57.6322 64.4331 174.5925 132 K 3.8037 8.6947 127.2725 60.2660 31.8356 178.9679 133 S 4.2122 8.0949 112.1411 60.9147 61.9552 175.6113 134 A 4.0280 7.9228 123.3072 55.7369 18.1777 178.4919 135 L 3.8382 8.6133 118.5772 58.6442 41.7668 180.0248 136 E 3.6031 7.9391 116.7217 58.8930 29.7064 179.4157 137 K 3.8738 8.2463 119.6047 60.1134 32.1500 178.5229 138 L 4.1551 8.1088 119.0685 58.1089 40.9260 178.8773 139 K 4.3504 8.4032 121.9658 55.6653 31.9146 177.3975 140 A 4.5607 8.7697 115.5160 49.9133 20.3965 175.5762 141 A 3.9825 7.2352 129.0487 51.1968 17.1468 177.2668 142 G 4.2621 7.4980 104.0975 43.5355 0.0000 171.7842 143 G 4.0071 8.7983 109.5394 45.2195 0.0000 173.7353 144 E 4.2418 8.0055 117.3265 53.8891 30.4544 174.4550 145 P 4.4171 0.0000 0.0000 63.0639 32.6236 176.4233 146 V 4.6976 8.3333 125.1686 60.6019 32.6565 177.2216 147 L 4.2651 8.4848 126.9814 54.1622 42.8897 176.7855 148 L 4.1549 8.5047 117.5802 55.0185 40.7332 173.4451 149 E 5.5372 9.4288 133.3501 57.0429 30.1479 177.0806 150 A 4.0448 7.9379 125.6404 52.4269 18.6423 177.6929 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 4.51 0.00 2.02 1.77 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 K 8.17 4.41 0.00 1.85 1.64 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.52 7.81 3 L 8.65 3.98 0.00 1.70 1.72 0.92 0.85 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 4 S 7.75 4.40 0.00 3.98 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 5 D 7.82 4.77 0.00 2.57 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 6 L 8.42 3.94 0.00 1.81 1.44 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.89 3.70 0.00 2.06 1.98 0.00 3.02 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 8 P 0.00 4.67 0.00 2.06 2.01 0.00 3.66 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 9 N 8.40 4.77 0.00 2.80 2.80 0.00 0.00 6.34 7.75 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 10 P 0.00 3.64 0.00 2.27 1.92 0.00 3.59 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 2.04 2.06 0.00 11 G 8.87 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 12 A 8.82 4.10 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 N 7.49 4.82 0.00 2.57 2.97 0.00 0.00 7.14 6.56 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 14 K 8.71 3.70 0.00 1.75 1.84 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.39 7.81 15 R 8.45 2.59 0.00 2.03 2.10 0.00 3.20 0.00 0.00 3.17 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 16 R 6.81 3.70 0.00 1.93 2.06 0.00 3.43 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.64 0.00 17 K 7.62 4.46 0.00 1.74 1.79 0.00 1.79 0.00 0.00 2.36 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.42 7.81 18 R 7.97 4.49 0.00 1.76 1.66 0.00 2.96 0.00 0.00 3.05 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 19 V 7.85 4.21 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 0.70 0.00 0.00 0.95 0.00 0.00 20 G 8.35 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 21 R 7.84 4.51 0.00 1.94 1.64 0.00 3.19 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 22 G 8.46 4.11 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 0.00 0.00 0.00 23 P 0.00 4.49 0.00 2.18 2.07 0.00 3.92 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 24 G 8.49 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 0.00 0.00 0.00 25 S 8.95 5.97 0.00 4.05 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 26 G 6.50 3.49 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 27 H 7.18 3.86 0.00 3.45 3.52 0.00 5.42 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 28 G 8.23 4.68 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 29 K 9.04 3.52 0.00 1.80 1.61 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.35 1.41 7.81 30 T 5.79 3.87 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 1.12 0.00 0.00 31 A 8.17 4.08 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 T 7.85 3.55 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 1.19 0.00 0.00 33 R 7.73 4.17 0.00 1.86 1.94 0.00 3.35 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 34 G 8.39 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 6.99 4.00 0.00 3.32 3.33 0.00 5.98 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 36 K 7.88 3.51 0.00 1.83 1.97 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.38 7.81 37 G 8.46 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 38 Q 8.34 4.22 0.00 2.18 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 39 K 8.06 3.85 0.00 1.77 1.86 0.00 1.84 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 40 S 8.10 4.54 0.00 4.04 4.06 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 0.00 0.00 0.00 0.00 41 R 9.90 4.46 0.00 1.96 1.85 0.00 3.29 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 42 S 8.13 4.13 0.00 3.82 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 43 G 7.97 3.91 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 0.00 0.00 0.00 44 G 7.44 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 45 L 8.16 4.49 0.00 1.64 1.58 1.02 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 46 K 7.87 4.33 0.00 1.41 1.29 0.00 0.91 0.00 0.00 1.29 0.00 0.00 2.61 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.00 0.71 7.81 47 D 8.25 4.31 0.00 2.91 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 48 P 0.00 4.50 0.00 2.24 2.11 0.00 3.66 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 2.11 0.00 49 R 8.42 4.32 0.00 1.91 2.05 0.00 3.03 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.58 0.00 50 R 7.83 4.48 0.00 1.90 1.96 0.00 3.35 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 51 F 8.23 4.51 0.00 3.06 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 52 E 7.69 4.38 0.00 1.78 1.68 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 2.20 2.35 0.00 53 G 5.72 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 0.00 0.00 0.00 0.00 54 G 6.91 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 55 R 6.63 3.94 0.00 1.67 1.84 0.00 3.22 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 56 S 8.46 4.17 0.00 3.88 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 57 T 8.06 4.85 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 1.25 0.00 0.00 58 T 8.31 4.73 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 59 L 7.52 4.54 0.00 1.61 1.62 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 60 M 7.32 4.37 0.00 2.01 2.28 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 61 R 7.81 3.99 0.00 1.84 1.96 0.00 3.24 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 62 L 8.16 3.98 0.00 1.84 2.06 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.71 0.00 2.20 2.08 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 64 K 8.23 4.51 0.00 1.71 1.74 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.40 1.35 7.81 65 R 8.66 4.05 0.00 1.81 1.93 0.00 3.33 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 66 G 8.46 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 0.00 0.00 0.00 67 M 8.68 3.64 0.00 2.05 2.40 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 2.41 2.44 0.00 68 Q 7.94 4.33 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 69 G 8.13 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 Q 8.13 4.74 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.52 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 71 V 7.92 3.42 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 0.71 0.00 0.00 0.93 0.00 0.00 72 P 0.00 4.28 0.00 2.06 2.15 0.00 3.76 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 2.02 2.08 0.00 73 G 7.90 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 0.00 0.00 0.00 74 E 8.59 4.06 0.00 1.94 1.86 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 2.28 2.29 0.00 75 I 8.24 3.87 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 1.42 0.98 0.91 0.00 0.00 76 K 8.61 4.05 0.00 1.75 1.81 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.34 7.81 77 R 8.08 4.70 0.00 1.85 1.83 0.00 3.08 0.00 0.00 3.30 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 78 P 0.00 4.09 0.00 1.82 1.98 0.00 3.71 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 1.98 2.00 0.00 79 R 8.25 4.68 0.00 1.91 2.25 0.00 2.92 0.00 0.00 3.52 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 80 Y 8.56 5.74 0.00 2.87 2.82 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 81 Q 8.57 4.31 0.00 1.51 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.08 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 82 G 8.69 4.55 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 0.00 0.00 0.00 83 V 7.97 4.57 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 0.96 0.00 0.00 0.93 0.00 0.00 84 N 8.56 5.78 0.00 3.20 2.93 0.00 0.00 6.88 6.62 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 85 L 8.60 3.96 0.00 1.68 1.72 0.95 0.85 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 86 K 7.76 3.82 0.00 1.89 2.03 0.00 1.58 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.48 7.81 87 D 7.82 4.38 0.00 2.91 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 0.00 88 L 8.05 3.77 0.00 1.81 1.77 1.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 89 A 8.30 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 90 R 7.25 3.29 0.00 1.68 1.06 0.00 3.47 0.00 0.00 3.32 8.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 91 F 5.70 4.58 0.00 3.16 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 92 E 8.77 4.75 0.00 1.98 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 2.31 0.00 93 G 7.93 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.90 4.37 0.00 2.05 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 2.11 2.21 0.00 95 V 8.69 3.38 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 1.13 0.00 0.00 1.27 0.00 0.00 96 T 7.74 4.51 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 1.21 0.00 0.00 97 P 0.00 4.50 0.00 2.09 2.11 0.00 3.73 0.00 0.00 3.83 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 98 E 8.98 4.24 0.00 2.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 99 L 7.80 3.86 0.00 1.54 1.75 0.75 0.63 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 0.00 100 L 7.87 4.25 0.00 1.77 2.03 1.32 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 101 V 7.96 3.54 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 0.99 0.00 0.00 1.02 0.00 0.00 102 R 8.30 4.03 0.00 2.00 2.03 0.00 3.13 0.00 0.00 3.42 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 103 A 8.50 4.54 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 104 G 8.27 3.91 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 0.00 0.00 0.00 105 L 8.68 4.63 0.00 1.61 1.60 1.13 0.95 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 0.00 106 L 9.64 5.24 0.00 1.82 1.86 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 107 K 7.70 4.37 0.00 2.26 2.31 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.57 1.64 7.81 108 K 7.85 4.09 0.00 1.82 1.61 0.00 1.57 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.48 7.81 109 G 7.76 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 0.00 110 Y 8.87 5.08 0.00 2.99 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 0.00 111 R 9.30 4.23 0.00 1.21 1.66 0.00 2.86 0.00 0.00 2.50 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.32 0.00 112 L 8.81 4.31 0.00 1.77 1.63 0.84 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 113 K 9.00 5.39 0.00 1.72 1.62 0.00 1.43 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.22 1.13 7.81 114 I 7.74 4.46 1.79 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.58 0.66 0.00 0.00 115 L 8.97 4.11 0.00 1.71 1.77 0.90 0.68 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 0.00 116 G 8.92 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 0.00 117 E 8.66 4.31 0.00 2.15 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 0.00 2.31 2.28 0.00 118 G 7.99 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 0.00 119 E 8.38 4.51 0.00 1.94 1.88 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 2.22 2.21 0.00 120 A 8.46 4.29 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 0.00 121 K 8.09 4.01 0.00 1.71 1.76 0.00 1.85 0.00 0.00 1.76 0.00 0.00 3.13 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.52 7.81 122 P 0.00 4.67 0.00 2.23 2.09 0.00 3.44 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.92 0.00 123 L 7.28 4.62 0.00 1.78 1.83 1.02 0.54 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 0.00 124 K 8.63 4.52 0.00 1.82 1.91 0.00 1.83 0.00 0.00 1.96 0.00 0.00 2.77 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.46 7.81 125 V 7.97 4.52 2.23 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 1.00 0.00 0.00 1.10 0.00 0.00 126 V 8.38 4.32 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 0.76 0.00 0.00 0.96 0.00 0.00 127 A 9.37 4.72 0.71 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 0.00 128 H 9.13 4.76 0.00 3.51 3.67 0.00 5.69 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 0.00 129 A 7.55 4.74 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 0.00 130 F 8.55 5.17 0.00 2.98 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 0.00 131 S 8.51 4.30 0.00 3.88 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 0.00 132 K 8.69 3.80 0.00 1.83 1.82 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.47 7.81 133 S 8.09 4.21 0.00 3.93 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 0.00 134 A 7.92 4.03 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.61 3.84 0.00 1.71 1.57 0.79 0.29 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 0.00 136 E 7.94 3.60 0.00 2.29 1.88 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 2.49 2.58 0.00 137 K 8.25 3.87 0.00 1.91 1.83 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.17 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.61 7.81 138 L 8.11 4.16 0.00 1.90 1.97 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 139 K 8.40 4.35 0.00 1.68 1.96 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.59 7.81 140 A 8.77 4.56 1.24 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 0.00 141 A 7.24 3.98 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 0.00 142 G 7.50 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 0.00 0.00 0.00 0.00 143 G 8.80 4.01 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 0.00 0.00 0.00 144 E 8.01 4.24 0.00 1.68 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 1.95 2.17 0.00 145 P 0.00 4.42 0.00 2.15 2.04 0.00 3.88 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 146 V 8.33 4.70 2.16 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 0.75 0.00 0.00 1.02 0.00 0.00 147 L 8.48 4.27 0.00 1.38 1.53 0.89 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.50 4.15 0.00 1.73 2.08 0.99 0.92 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 0.00 149 E 9.43 5.54 0.00 2.08 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 2.10 2.04 0.00 150 A 7.94 4.04 1.32 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 0.00 0.00 0.00