NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.5572 8.2033 120.8403 59.2186 33.0435 174.2710 2 T 3.5845 8.5218 124.2361 66.4445 68.0950 175.8968 3 F 4.4252 8.5254 120.4914 60.6966 39.4749 177.2059 4 C 4.2244 8.1737 115.9533 62.9077 27.9646 176.2053 5 S 4.4343 8.2285 118.2174 61.2132 62.4153 176.8353 6 I 4.2998 7.6858 123.8759 63.9131 36.5969 178.5373 7 I 4.0858 8.0476 120.2246 64.3322 37.0457 177.3133 8 N 4.6883 8.1664 114.1204 52.3476 38.6469 175.1432 9 R 3.9286 7.7391 118.2294 57.5689 27.8764 176.8726 10 E 4.4706 8.6546 117.6021 56.4998 30.7646 175.9976 11 L 4.7311 7.3821 120.1704 52.5751 45.3220 174.7729 12 E 4.0640 8.7703 126.3265 56.4614 30.2232 176.1831 13 G 3.9784 8.0606 111.1861 44.9069 0.0000 172.3689 14 Y 4.5125 8.4353 120.9004 56.2026 39.1878 174.9036 15 F 4.7935 9.1834 123.9182 57.5918 39.4522 176.1247 16 V 4.5688 8.9366 115.1414 61.5473 33.6935 175.1698 17 Y 4.8424 7.8439 120.4739 56.6522 42.1658 172.7165 18 E 5.1313 7.2533 123.8401 55.7668 31.7763 174.0458 19 D 4.6924 8.7475 124.8251 52.1495 42.4285 175.4021 20 E 4.1885 9.0098 117.0614 59.1784 29.6473 177.7026 21 K 4.5527 8.1773 112.5625 55.8332 34.7631 175.8309 22 F 5.4278 9.7510 118.5587 56.1691 44.0981 173.2012 23 A 5.4000 9.1039 119.7295 51.2941 23.1944 175.1756 24 A 5.1539 9.4182 121.0325 50.2847 22.3990 175.4783 25 I 4.9530 8.7665 122.8909 58.9713 41.3324 175.2117 26 L 4.4846 8.7162 126.3083 54.7526 42.2183 176.6480 27 D 4.5047 8.8698 123.9710 54.1332 41.2219 176.4926 28 K 4.1272 9.0105 126.6502 58.8574 33.0369 175.8282 29 Y 5.2249 8.5587 114.9889 53.9801 38.0299 173.5941 30 P 4.5038 0.0000 0.0000 63.2445 32.3201 178.6320 31 V 3.8763 8.9914 121.8677 65.4540 32.0499 175.6619 32 S 4.7929 7.8111 112.0141 55.9657 65.9832 172.6518 33 L 3.4467 7.4804 123.0478 56.7371 41.6328 177.1703 34 G 3.8555 9.1309 115.0284 44.7596 0.0000 172.5011 35 H 4.4244 8.2481 120.5899 57.5147 30.6671 174.1523 36 T 5.2118 9.2015 121.2037 61.7850 73.2470 172.6646 37 L 5.1394 9.0342 123.8442 53.0261 44.8097 175.5294 38 V 4.8527 8.7194 124.4031 61.1917 33.6281 174.5439 39 I 5.0012 9.0428 120.6254 58.6370 41.2343 172.7637 40 P 4.4191 0.0000 0.0000 62.0936 31.7071 176.7216 41 K 4.1747 8.7054 123.2527 59.1792 32.5993 178.2966 42 K 3.8626 7.7321 120.2509 56.1326 32.7258 175.4127 43 H 4.1118 8.3233 125.6282 55.5031 30.4634 174.3844 44 F 4.9342 7.9692 124.6329 55.3948 42.4272 175.5840 45 E 4.2610 9.4506 124.4268 58.8777 29.7441 176.1924 46 N 4.8284 7.7293 113.2958 52.2091 39.6343 173.9442 47 Y 3.9550 8.7734 118.1570 60.9555 38.7766 178.3343 48 L 4.1697 8.2106 118.2963 57.0062 41.8090 177.6381 49 E 4.2700 7.9722 115.8117 56.6455 30.0376 176.4060 50 A 2.5800 6.9032 122.1306 50.5672 19.4486 177.6652 51 D 4.5056 7.4738 120.8733 52.8910 41.7222 177.5483 52 E 3.8867 8.5258 119.7409 59.7199 29.4400 179.4135 53 D 4.3549 8.0938 118.4616 57.5534 40.8458 178.8215 54 T 4.1087 8.2722 116.2874 66.7401 68.4965 176.8302 55 L 3.8336 7.8009 120.7067 57.5018 41.0867 179.5030 56 A 3.9314 8.2308 121.0572 55.2335 18.3870 179.3926 57 E 3.7508 8.1716 117.8867 58.9465 29.5572 178.6267 58 L 3.4572 8.1468 120.7238 57.9532 42.1880 178.8090 59 A 3.9551 7.9396 120.6320 55.1500 18.3350 179.8277 60 K 3.8543 7.5129 116.4395 59.4127 31.9998 179.8599 61 V 3.2354 7.5680 118.6358 65.7167 31.3017 178.1685 62 V 3.4571 7.9025 118.4217 65.7259 31.2077 177.8867 63 K 3.8028 7.8308 119.1499 59.3405 32.0578 178.3298 64 L 3.8176 7.5440 120.3224 58.3343 41.9522 179.1592 65 V 3.5072 7.7703 118.2497 65.9555 31.3059 178.1369 66 S 4.0612 8.2449 115.1511 61.5754 62.6952 176.5974 67 L 4.0325 8.1698 121.9984 57.6649 41.2800 179.8561 68 G 3.5936 8.1953 105.6140 47.9129 0.0000 175.8432 69 I 3.7088 8.0899 123.1091 63.8231 37.1523 178.3310 70 K 3.7767 8.2393 120.7795 59.5358 31.8174 178.3223 71 D 4.2849 8.1192 117.8929 57.2838 41.0040 177.9594 72 A 4.0532 8.0220 121.0939 55.1662 18.4231 178.6424 73 V 4.5552 8.0767 105.6858 60.3809 32.2642 176.2326 74 K 3.9070 7.6611 118.4419 57.4127 29.9446 175.1974 75 A 3.6282 7.9329 119.8835 52.0121 19.3997 177.8655 76 D 4.5986 7.9990 120.0848 55.9092 42.0718 176.4170 77 G 4.1139 7.1160 103.1522 45.4920 0.0000 171.8379 78 L 5.0144 8.0707 118.1534 53.1886 45.9919 175.9824 79 R 4.5586 8.8654 121.9469 54.4674 32.3969 174.9072 80 L 5.7159 8.5866 123.9095 52.2113 44.0002 175.7454 81 L 4.5735 8.1764 121.5516 55.2682 43.7281 173.7423 82 T 4.9184 8.2357 113.7791 60.7559 70.5186 172.4878 83 N 4.9279 8.8014 124.8554 51.4448 40.8991 174.4540 84 I 4.4600 8.5435 122.6200 62.3319 39.0773 176.1913 85 G 4.2164 9.5689 113.0267 45.3804 0.0000 173.8248 86 R 4.4286 9.0609 117.1373 58.4410 29.6047 178.7992 87 S 4.2140 8.1788 111.0574 59.7978 63.2335 174.2421 88 A 4.4339 8.0509 123.1232 51.9539 19.0641 177.4768 89 G 3.9539 8.2231 104.9625 45.2137 0.0000 173.7981 90 Q 4.1158 7.8984 121.4614 55.7472 29.6328 176.6487 91 V 4.0751 8.0684 115.8290 60.5265 34.1410 175.3697 92 I 4.1811 7.3758 119.8147 59.5613 38.2870 176.5154 93 F 4.6664 8.4641 129.6279 56.3342 37.9295 176.1484 94 H 4.9460 7.8085 118.8545 54.1548 32.4397 171.9196 95 L 4.1664 8.7733 129.7200 56.1766 42.1257 176.0809 96 H 5.1234 8.7485 120.2717 54.2526 31.7839 172.6079 97 V 4.5248 8.6975 121.0428 61.6142 33.7834 174.2711 98 H 5.0757 9.5273 125.6339 55.3722 30.6206 174.4955 99 I 4.5316 9.0077 123.4691 59.8184 40.0102 174.7930 100 I 4.5871 8.4925 129.7298 58.5882 38.9842 173.9872 101 P 4.5368 0.0000 0.0000 62.5803 32.0853 176.0508 102 T 4.5984 7.9676 111.8792 59.8338 72.6147 172.6179 103 W 5.5333 8.5670 120.4830 55.2197 32.7466 175.5787 104 E 4.3249 9.9398 122.8055 58.2091 30.9086 178.0976 105 G 4.0189 8.3301 102.5103 45.5341 0.0000 175.2711 106 D 4.7719 8.8774 117.5060 51.6635 44.5655 174.9245 107 Y 3.1529 7.0175 118.8529 55.4509 38.7201 173.5985 108 P 4.2981 0.0000 0.0000 62.5554 32.3933 177.2606 109 D 4.3842 8.6374 120.8414 57.4000 41.0279 177.9228 110 I 3.5897 7.6797 118.8538 63.8309 37.1741 175.9813 111 F 4.7767 7.3446 118.3215 56.3390 40.0857 176.1201 112 K 4.6695 8.3921 124.5447 54.9185 34.3444 175.8959 113 S 4.2456 8.7188 113.5763 59.9335 62.9559 173.5668 114 F 4.7613 8.7186 124.1414 56.3519 42.2533 174.3289 115 K 4.1393 7.8609 127.7101 53.3418 31.7440 173.3398 116 P 4.1922 0.0000 0.0000 64.2414 31.6799 176.9939 117 R 3.9430 9.1241 120.0207 56.5946 28.1447 175.6219 118 K 4.7694 7.3404 116.8353 53.8476 35.4835 174.8866 119 E 4.3664 8.5987 120.2551 55.8227 30.0000 176.2591 120 Q 4.2865 8.4282 125.1720 54.1131 30.8437 175.1963 121 E 4.3203 8.1960 117.8613 55.8369 30.6167 177.9830 122 K 4.0683 8.9982 121.9987 60.3490 32.0229 178.5638 123 E 4.0211 8.4075 117.9584 59.6467 29.2845 178.6077 124 Y 3.9558 8.0563 119.2898 61.0181 38.8630 177.9150 125 Y 3.5146 7.5415 116.9640 60.7470 37.9234 178.3022 126 E 4.0722 7.9874 119.2767 59.2605 29.5638 179.2097 127 L 3.9251 7.8851 120.2379 58.2017 42.2188 178.8847 128 L 3.8827 7.6625 118.9864 57.6985 41.4086 179.2966 129 Q 4.0102 7.9861 119.3664 59.2190 29.0657 178.5767 130 K 4.0274 8.0018 119.4649 59.5117 32.1204 179.4780 131 I 3.8241 8.0303 113.5280 64.0188 37.5149 178.3976 132 I 3.7635 8.0339 121.6768 64.1148 36.8526 178.5351 133 R 3.9836 8.2414 119.0521 59.3282 29.8301 178.6281 134 E 4.3633 8.1655 120.3439 58.9817 29.6563 179.1562 135 S 4.1777 8.1944 115.1785 61.5662 62.8806 176.7359 136 I 3.7762 8.0526 122.6882 64.3280 36.7119 178.2102 137 E 4.0145 8.5243 119.7810 59.5679 29.3064 178.9902 138 N 4.2813 8.0232 116.7230 56.6818 39.0217 176.9366 139 L 4.0186 7.8464 120.2506 57.6600 41.7979 179.5726 140 K 4.1159 8.1038 118.3710 58.8800 31.8946 179.1004 141 R 4.0812 7.8111 119.2986 57.8092 29.8509 177.5728 142 K 4.2914 7.8482 116.8640 56.9433 33.6475 177.0674 143 I 4.5223 7.6241 110.3738 60.3037 38.8945 175.3117 144 G 4.3442 7.7243 110.6662 44.3374 0.0000 174.4847 145 D 4.2319 8.4605 118.0769 56.5834 40.7620 176.6937 146 Y 4.9883 7.0279 117.1830 57.0189 38.8848 176.0604 147 K 4.4959 8.1916 118.0009 57.4091 33.2812 176.8170 148 W 4.9888 8.7543 113.7311 56.1088 32.4709 174.9206 149 G 3.7035 7.8732 113.4852 45.8617 0.0000 173.8230 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 C 8.20 4.56 0.00 3.04 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 2 T 8.52 3.58 3.80 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 0.00 0.00 0.83 0.00 0.00 3 F 8.53 4.43 0.00 2.77 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 4 C 8.17 4.22 0.00 3.03 3.03 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 5 S 8.23 4.43 0.00 4.06 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 6 I 7.69 4.30 2.08 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 1.69 1.78 0.84 0.00 0.00 7 I 8.05 4.09 2.13 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.82 0.99 0.00 0.00 8 N 8.17 4.69 0.00 2.72 2.85 0.00 0.00 7.08 7.28 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 9 R 7.74 3.93 0.00 1.95 2.00 0.00 3.46 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 10 E 8.65 4.47 0.00 1.97 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 2.25 2.26 0.00 11 L 7.38 4.73 0.00 1.64 1.42 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.77 4.06 0.00 1.91 1.78 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 2.20 2.14 0.00 13 G 8.06 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.44 4.51 0.00 3.06 3.06 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 15 F 9.18 4.79 0.00 2.87 3.06 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 16 V 8.94 4.57 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 0.74 0.00 0.00 1.07 0.00 0.00 17 Y 7.84 4.84 0.00 3.14 2.84 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 18 E 7.25 5.13 0.00 2.11 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 2.08 2.31 0.00 19 D 8.75 4.69 0.00 2.93 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 9.01 4.19 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 21 K 8.18 4.55 0.00 1.81 1.44 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.44 7.81 22 F 9.75 5.43 0.00 3.26 3.08 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 23 A 9.10 5.40 1.46 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 0.00 0.00 0.00 24 A 9.42 5.15 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 25 I 8.77 4.95 1.78 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.21 0.87 0.00 0.00 26 L 8.72 4.48 0.00 1.76 1.83 0.88 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 27 D 8.87 4.50 0.00 2.54 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 28 K 9.01 4.13 0.00 1.65 1.46 0.00 1.48 0.00 0.00 1.49 0.00 0.00 2.62 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.34 1.01 7.81 29 Y 8.56 5.22 0.00 2.95 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 30 P 0.00 4.50 0.00 2.74 2.42 0.00 3.91 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.78 0.00 31 V 8.99 3.88 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 0.90 0.00 0.00 1.03 0.00 0.00 32 S 7.81 4.79 0.00 4.23 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.48 3.45 0.00 0.27 1.01 -0.02 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 34 G 9.13 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 35 H 8.25 4.42 0.00 3.53 3.34 0.00 5.55 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 9.20 5.21 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 1.28 0.00 0.00 37 L 9.03 5.14 0.00 1.42 1.41 1.22 0.86 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 38 V 8.72 4.85 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 1.14 0.00 0.00 0.90 0.00 0.00 39 I 9.04 5.00 1.74 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.74 0.14 0.00 0.00 40 P 0.00 4.42 0.00 2.17 1.85 0.00 3.85 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.35 0.00 41 K 8.71 4.17 0.00 1.56 1.85 0.00 1.90 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.52 1.41 7.81 42 K 7.73 3.86 0.00 1.55 1.51 0.00 1.66 0.00 0.00 1.51 0.00 0.00 2.47 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.49 1.09 7.81 43 H 8.32 4.11 0.00 3.08 3.07 0.00 5.92 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 F 7.97 4.93 0.00 3.03 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 45 E 9.45 4.26 0.00 2.08 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 2.44 2.30 0.00 46 N 7.73 4.83 0.00 3.03 3.07 0.00 0.00 5.87 7.57 0.00 0.00 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 Y 8.77 3.95 0.00 3.00 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 48 L 8.21 4.17 0.00 1.89 1.77 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.97 4.27 0.00 2.20 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 2.56 2.49 0.00 50 A 6.90 2.58 0.42 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 51 D 7.47 4.51 0.00 2.84 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 52 E 8.53 3.89 0.00 2.00 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 0.00 2.35 2.36 0.00 53 D 8.09 4.35 0.00 2.90 2.76 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 0.00 0.00 0.00 54 T 8.27 4.11 4.21 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 1.31 0.00 0.00 55 L 7.80 3.83 0.00 1.69 1.51 0.48 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.23 3.93 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 57 E 8.17 3.75 0.00 2.12 1.94 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 2.36 1.52 0.00 58 L 8.15 3.46 0.00 2.11 1.88 1.09 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 59 A 7.94 3.96 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 60 K 7.51 3.85 0.00 1.81 1.75 0.00 1.77 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.55 7.81 61 V 7.57 3.24 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 0.75 0.00 0.00 0.58 0.00 0.00 62 V 7.90 3.46 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 0.98 0.00 0.00 0.98 0.00 0.00 63 K 7.83 3.80 0.00 1.82 1.86 0.00 1.65 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.39 7.81 64 L 7.54 3.82 0.00 1.69 1.54 0.89 0.80 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 65 V 7.77 3.51 1.96 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 1.02 0.00 0.00 0.70 0.00 0.00 66 S 8.24 4.06 0.00 4.02 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 67 L 8.17 4.03 0.00 1.80 1.68 0.88 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.20 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 69 I 8.09 3.71 1.83 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 1.41 0.71 0.86 0.00 0.00 70 K 8.24 3.78 0.00 1.79 1.90 0.00 1.56 0.00 0.00 1.52 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.45 7.81 71 D 8.12 4.28 0.00 2.85 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 72 A 8.02 4.05 1.46 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 0.00 0.00 0.00 73 V 8.08 4.56 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 0.65 0.00 0.00 1.11 0.00 0.00 74 K 7.66 3.91 0.00 2.08 2.01 0.00 1.78 0.00 0.00 1.86 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.61 7.81 75 A 7.93 3.63 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 76 D 8.00 4.60 0.00 2.54 2.71 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 77 G 7.12 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 78 L 8.07 5.01 0.00 1.38 1.41 0.83 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 79 R 8.87 4.56 0.00 1.66 1.77 0.00 3.04 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 80 L 8.59 5.72 0.00 1.46 1.54 0.88 0.97 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 81 L 8.18 4.57 0.00 1.64 1.68 0.85 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.24 4.92 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 1.08 0.00 0.00 83 N 8.80 4.93 0.00 2.71 2.77 0.00 0.00 6.79 7.45 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 84 I 8.54 4.46 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.65 0.99 0.00 0.00 85 G 9.57 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 86 R 9.06 4.43 0.00 2.13 2.46 0.00 3.19 0.00 0.00 3.41 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.65 0.00 87 S 8.18 4.21 0.00 4.02 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 88 A 8.05 4.43 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 89 G 8.22 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 0.00 0.00 0.00 90 Q 7.90 4.12 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.61 0.00 0.00 0.00 0.00 0.00 1.39 2.10 0.00 91 V 8.07 4.08 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 0.80 0.00 0.00 0.89 0.00 0.00 92 I 7.38 4.18 1.81 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.47 0.63 0.00 0.00 93 F 8.46 4.67 0.00 3.21 3.30 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 94 H 7.81 4.95 0.00 3.23 3.52 0.00 5.97 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.77 4.17 0.00 1.74 1.74 1.10 0.94 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 96 H 8.75 5.12 0.00 2.91 2.81 0.00 5.54 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.70 4.52 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 1.06 0.00 0.00 1.00 0.00 0.00 98 H 9.53 5.08 0.00 3.08 3.25 0.00 5.61 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 9.01 4.53 1.88 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 1.20 0.91 0.86 0.00 0.00 100 I 8.49 4.59 1.77 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.66 0.83 0.00 0.00 101 P 0.00 4.54 0.00 1.53 1.40 0.00 3.55 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.93 0.00 102 T 7.97 4.60 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 103 W 8.57 5.53 0.00 3.29 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 0.00 104 E 9.94 4.32 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 2.28 0.00 105 G 8.33 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 D 8.88 4.77 0.00 2.39 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 0.00 0.00 0.00 0.00 107 Y 7.02 3.15 0.00 2.08 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 P 0.00 4.30 0.00 2.46 2.09 0.00 3.84 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.34 0.00 109 D 8.64 4.38 0.00 2.63 2.71 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 0.00 110 I 7.68 3.59 1.16 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.18 0.55 0.00 0.00 111 F 7.34 4.78 0.00 3.20 2.76 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 0.00 0.00 0.00 112 K 8.39 4.67 0.00 1.82 1.86 0.00 1.81 0.00 0.00 1.80 0.00 0.00 3.24 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.52 7.81 113 S 8.72 4.25 0.00 4.01 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 F 8.72 4.76 0.00 2.74 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 0.00 115 K 7.86 4.14 0.00 1.50 1.52 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.83 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.25 1.21 7.81 116 P 0.00 4.19 0.00 2.06 2.17 0.00 3.74 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 2.17 2.51 0.00 117 R 9.12 3.94 0.00 1.92 2.06 0.00 3.12 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 118 K 7.34 4.77 0.00 1.81 1.66 0.00 1.58 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.44 7.81 119 E 8.60 4.37 0.00 1.99 1.89 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 2.33 2.10 0.00 120 Q 8.43 4.29 0.00 1.40 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.71 0.00 0.00 0.00 0.00 0.00 1.58 1.16 0.00 121 E 8.20 4.32 0.00 2.04 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 2.39 2.26 0.00 122 K 9.00 4.07 0.00 1.93 1.93 0.00 1.82 0.00 0.00 2.06 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.66 1.75 7.81 123 E 8.41 4.02 0.00 2.15 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 2.45 2.49 0.00 124 Y 8.06 3.96 0.00 2.94 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 0.00 125 Y 7.54 3.51 0.00 2.20 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.99 4.07 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.67 0.00 127 L 7.89 3.93 0.00 1.77 1.68 0.91 0.50 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 0.00 128 L 7.66 3.88 0.00 1.22 1.40 0.65 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 129 Q 7.99 4.01 0.00 2.38 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.49 2.77 0.00 130 K 8.00 4.03 0.00 2.04 1.88 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.18 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.67 7.81 131 I 8.03 3.82 1.94 0.00 0.00 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 1.84 0.79 0.94 0.00 0.00 132 I 8.03 3.76 1.98 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 1.54 0.69 0.96 0.00 0.00 133 R 8.24 3.98 0.00 2.13 2.04 0.00 3.21 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 1.85 1.85 0.00 134 E 8.17 4.36 0.00 2.15 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 2.32 2.24 0.00 135 S 8.19 4.18 0.00 4.13 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 0.00 136 I 8.05 3.78 2.09 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.78 1.06 0.00 0.00 137 E 8.52 4.01 0.00 2.17 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 2.39 2.65 0.00 138 N 8.02 4.28 0.00 2.78 2.97 0.00 0.00 7.25 8.00 0.00 0.00 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 L 7.85 4.02 0.00 1.95 1.69 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.10 4.12 0.00 2.07 1.94 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.14 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.54 1.68 7.81 141 R 7.81 4.08 0.00 1.79 1.89 0.00 2.64 0.00 0.00 2.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.31 0.00 142 K 7.85 4.29 0.00 1.87 1.76 0.00 1.55 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.36 7.81 143 I 7.62 4.52 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 1.40 0.67 0.88 0.00 0.00 144 G 7.72 4.34 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 0.00 145 D 8.46 4.23 0.00 2.02 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 0.00 0.00 0.00 146 Y 7.03 4.99 0.00 3.05 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.19 4.50 0.00 1.98 2.07 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.48 7.81 148 W 8.75 4.99 0.00 3.55 3.18 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 0.00 149 G 7.87 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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