NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4099 8.3044 120.3474 55.5717 33.4008 174.3487 2 H 4.6349 8.6795 124.3367 53.8054 32.5901 170.8557 3 L 4.7666 7.8544 126.3220 52.5867 45.5262 176.4163 4 T 4.1493 8.0877 112.1172 61.0039 70.8440 174.0449 5 P 4.1871 0.0000 0.0000 65.5872 31.2421 178.9306 6 E 3.9625 8.0669 117.1327 59.3944 29.3764 179.0749 7 E 3.9166 8.2712 118.7166 59.2218 29.4491 179.4312 8 K 3.8179 8.1995 118.7604 59.7118 32.1306 179.4401 9 S 4.0849 8.1493 114.9964 61.6114 62.8287 176.7533 10 A 3.9988 8.3081 123.7997 55.0048 18.1182 179.8864 11 V 3.4571 7.9472 116.9115 66.5557 31.7510 178.4456 12 T 3.9822 8.1920 115.5043 66.5051 68.0212 176.5934 13 A 4.0390 8.0364 121.8920 55.1571 18.7487 179.1668 14 L 3.8797 8.0060 118.6991 57.9810 42.1750 178.9812 15 W 4.3448 8.7675 128.5557 60.2573 30.4205 178.0593 16 G 3.8274 8.1550 104.6317 46.8012 0.0000 174.6488 17 K 4.4826 7.7992 118.4325 55.1869 32.8403 176.1345 18 V 3.7176 6.9966 120.3669 61.6650 32.2782 175.9473 19 N 4.4864 8.1477 125.4246 52.2173 38.6444 175.3992 20 V 3.4911 8.0699 127.8277 66.0904 31.7175 177.1539 21 D 4.3376 8.0883 117.8989 57.3995 40.7379 178.3678 22 E 3.8547 8.3621 119.6943 59.3318 29.6897 179.0675 23 V 3.6203 8.0264 118.7435 65.6224 31.4190 178.3059 24 G 3.7101 8.4801 106.1392 47.7360 0.0000 175.9779 25 G 3.5988 8.1937 108.6112 47.3229 0.0000 175.4322 26 E 3.8940 8.2821 121.5930 58.9692 29.6637 178.8405 27 A 3.9348 8.4524 121.2430 55.3582 18.5904 179.0350 28 Y 3.8934 8.5022 118.6089 60.4955 38.7991 178.3746 29 G 3.6119 8.3599 106.8635 48.0074 0.0000 176.0349 30 R 3.9048 8.2132 120.9995 58.3285 29.9434 178.8831 31 L 3.8619 7.9167 120.5337 58.3168 42.1954 179.1950 32 L 4.0097 7.5462 119.2965 56.5199 41.2298 179.7299 33 V 3.5240 7.2220 117.8913 65.8703 31.7054 177.9777 34 V 3.5477 7.8188 116.7904 64.2427 32.6989 175.5033 35 Y 3.7972 7.2000 116.5359 54.1287 37.8306 174.0815 36 P 4.7847 0.0000 0.0000 64.1869 31.7865 178.2658 37 W 4.2994 8.1669 116.6346 59.1524 27.7087 177.5722 38 T 4.2100 7.6966 110.5448 63.7579 68.2504 175.7596 39 Q 4.4970 8.3302 121.3886 57.3086 28.5591 177.7672 40 R 3.7199 7.4677 116.5758 58.8838 29.2778 177.7170 41 F 4.1604 7.2841 114.4905 58.0043 39.5306 175.6935 42 F 4.5395 7.5634 120.9784 56.6874 39.4021 177.6144 43 E 4.0654 8.2860 122.4613 59.3330 29.4826 178.3953 44 S 4.5786 8.0711 110.5678 58.9068 63.4604 174.4863 45 F 4.5803 8.4935 119.5365 58.2425 39.6853 176.7468 46 G 3.9066 8.1336 106.6347 44.4031 0.0000 173.4141 47 D 4.5055 8.5721 123.8764 54.5000 41.1941 176.2414 48 L 4.9329 8.3323 127.0218 54.4476 43.0231 178.1795 49 S 4.2909 8.5697 117.0350 60.8657 63.2517 174.4725 50 T 4.7472 7.4469 109.6365 58.1266 73.1054 172.8500 51 P 4.1980 0.0000 0.0000 65.9943 31.3872 178.7022 52 D 4.3288 8.1123 116.8493 57.2084 40.5063 178.5702 53 A 3.9807 8.0923 120.7353 55.0927 18.6989 179.5157 54 V 3.7153 8.1048 117.0453 66.6520 31.4423 178.2652 55 M 4.2177 8.1013 117.0784 57.8543 31.8742 178.1934 56 G 3.9443 7.8954 103.4388 44.0481 0.0000 173.3568 57 N 4.3934 7.4945 121.0898 52.8712 39.4396 173.5731 58 P 4.1936 0.0000 0.0000 65.8083 31.3629 178.7837 59 K 3.5430 8.1589 117.2339 59.0400 31.7165 179.6814 60 V 3.7036 7.6630 118.1563 65.8531 31.4944 178.1105 61 K 3.9123 8.1693 118.1142 59.3379 31.9212 179.1108 62 A 3.8978 8.0761 121.2489 55.2364 18.2391 179.4692 63 Q 3.8792 8.1768 118.2154 59.1204 28.9718 178.6814 64 G 3.5052 7.9759 106.8158 47.7237 0.0000 175.8320 65 K 3.9907 8.2402 121.1868 59.0400 32.1647 179.4362 66 K 4.0115 8.0102 119.9548 59.2142 32.1127 179.1656 67 V 3.6613 7.8942 118.6211 66.2559 31.6119 178.1623 68 L 4.3774 8.4432 118.9555 57.4047 41.4664 179.7081 69 G 3.7553 8.3935 105.9647 47.7927 0.0000 175.7085 70 A 4.1345 8.1570 122.9479 54.6575 18.1879 179.4458 71 F 4.1529 8.4045 118.4439 61.5491 39.8263 176.8042 72 S 4.1781 8.9050 113.0231 61.8479 62.3800 176.0335 73 D 4.5192 8.4434 121.3659 57.2005 40.4430 179.0077 74 G 3.6088 8.1021 106.1714 47.3017 0.0000 175.2753 75 L 3.8759 7.2864 119.3040 56.2470 41.6870 178.1248 76 A 4.2324 7.5257 119.3479 52.7706 19.6063 176.6334 77 H 4.9051 8.0368 114.9899 54.9194 29.6137 175.4597 78 L 3.9147 7.9097 119.3435 57.2841 41.9225 178.2653 79 D 4.6956 7.8917 116.4217 54.3733 41.7866 176.3820 80 N 4.9973 8.1399 118.8933 51.3763 39.6148 175.6554 81 L 4.1231 7.9789 121.9389 57.9422 42.1337 179.3095 82 K 4.1064 8.1173 118.1365 59.4069 31.8092 179.4795 83 G 3.5512 7.6873 104.3832 48.1399 0.0000 175.4459 84 T 3.7838 7.6126 117.2300 65.6817 68.6219 175.7248 85 F 4.6438 8.0637 116.7847 57.0007 39.2796 177.3800 86 A 4.0681 7.5816 123.0713 55.9037 18.1677 180.4409 87 T 3.8847 7.8533 113.5132 66.7427 68.5209 176.9091 88 L 4.1131 7.9650 120.5393 57.5198 41.7023 179.3356 89 S 4.4159 8.3503 114.9903 61.0331 62.3773 176.0088 90 E 3.9057 8.2835 121.2554 59.2535 29.2020 179.1879 91 L 3.9005 8.1181 120.3065 58.6464 42.1660 178.8364 92 H 4.1698 8.7175 116.5023 58.9053 28.0836 177.1529 93 C 3.6499 7.8338 120.7651 62.2784 31.1450 175.3766 94 D 4.3726 8.3238 120.6467 56.4172 40.5594 177.4648 95 K 4.2934 7.7359 116.5810 57.4764 33.6624 177.1813 96 L 4.2284 7.7749 116.1088 54.5228 42.2709 176.0658 97 H 4.1783 7.1970 113.7407 56.6423 26.6608 175.0297 98 V 4.0850 7.9562 118.6763 61.2215 32.4487 174.8271 99 D 4.4220 8.7840 127.3400 53.5305 41.8013 175.1115 100 P 3.1135 0.0000 0.0000 64.6931 31.8078 177.9893 101 E 3.8524 8.2757 119.1139 59.2408 29.2420 178.3433 102 N 4.2612 8.0726 116.5830 56.2976 38.4586 177.2921 103 F 4.4842 7.5019 119.2548 60.6259 38.9601 177.9502 104 R 3.9909 7.9093 117.3518 59.1425 29.9364 178.9270 105 L 3.7783 7.8430 118.9452 57.5541 41.4890 179.2600 106 L 4.0433 8.3158 120.7945 57.9890 42.0115 179.2422 107 G 3.6787 8.2547 105.8369 47.9240 0.0000 175.4533 108 N 4.4498 8.3609 118.9760 56.1151 38.4764 177.7699 109 V 3.6554 8.1064 119.7856 65.6092 31.5582 177.8514 110 L 3.8734 8.3249 120.7336 58.1033 41.8716 179.1064 111 V 3.5861 7.8963 118.1050 66.2907 31.4012 177.7025 112 C 4.0646 8.0418 116.3992 62.8541 27.9447 176.3820 113 V 3.5323 7.9589 120.0957 65.8652 31.0228 178.1312 114 L 3.8853 8.1290 119.0156 57.4941 41.3554 179.3158 115 A 3.7294 7.4062 120.8360 55.2472 18.1022 179.1410 116 H 4.1157 8.1350 115.8762 59.6646 30.0181 176.7108 117 H 3.9466 8.3144 119.0668 58.8763 30.1287 176.5567 118 F 4.5922 8.4797 118.1861 56.5091 39.6577 177.2036 119 G 3.8374 8.8149 108.2669 46.1826 0.0000 177.6647 120 K 4.0728 8.8640 122.9729 59.0753 32.5091 177.8762 121 E 4.0486 8.0190 119.6863 58.6096 30.0401 177.0864 122 F 4.5627 8.2991 123.5731 57.0208 37.8484 174.8125 123 T 4.1869 7.3323 116.0761 60.1528 71.3435 173.4812 124 P 4.1520 0.0000 0.0000 65.5587 31.2779 177.2134 125 P 4.2078 0.0000 0.0000 65.3768 31.2814 178.8987 126 V 3.5362 7.4992 116.7175 65.8552 31.4468 177.7938 127 Q 3.4342 7.8382 119.4214 59.0812 28.9797 178.1591 128 A 4.0910 8.0821 121.4887 55.0751 18.3461 179.5119 129 A 3.8931 8.0334 119.2670 55.6372 18.4613 179.5434 130 Y 3.8551 8.2491 115.2487 61.1564 37.9125 178.7335 131 Q 4.1602 8.8628 119.5321 58.9205 28.7278 178.9682 132 K 3.9650 8.0089 119.2223 59.3962 32.0157 179.5745 133 V 3.4795 7.6905 118.3329 66.2291 31.4820 178.6257 134 V 3.8524 8.4426 112.3470 64.2309 31.2620 178.5157 135 A 4.1232 8.3673 121.0060 54.9108 18.1797 179.8626 136 G 3.5101 8.3591 104.6103 48.0235 0.0000 176.1617 137 V 3.2817 8.1118 121.1679 65.3704 31.5498 177.9581 138 A 3.9233 8.1218 120.6414 55.2512 17.9981 179.4109 139 N 4.3183 8.2465 114.0745 56.2537 38.7500 177.2523 140 A 4.1612 8.0876 122.2799 55.2322 18.2336 179.6563 141 L 3.9414 8.1610 117.0258 56.7588 41.7040 178.5621 142 A 4.5268 7.8227 119.7492 53.1539 19.0000 178.4810 143 H 4.2634 7.9217 116.6779 58.4975 29.9740 175.8019 144 K 4.4443 8.1812 117.9482 56.2389 32.2543 176.4619 145 Y 4.1113 7.9532 117.4641 58.5625 38.4069 175.8240 146 H 4.4407 8.3904 117.1664 56.2660 28.1608 173.4032 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 4.41 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 2 H 8.68 4.63 0.00 3.16 3.09 0.00 5.73 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.85 4.77 0.00 1.52 1.43 0.79 0.90 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 4 T 8.09 4.15 4.36 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 1.21 0.00 0.00 5 P 0.00 4.19 0.00 2.16 2.11 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 6 E 8.07 3.96 0.00 2.03 1.98 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 2.39 2.45 0.00 7 E 8.27 3.92 0.00 2.16 1.92 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 2.29 2.32 0.00 8 K 8.20 3.82 0.00 1.86 1.80 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.40 7.81 9 S 8.15 4.08 0.00 4.10 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 10 A 8.31 4.00 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 11 V 7.95 3.46 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 0.67 0.00 0.00 0.45 0.00 0.00 12 T 8.19 3.98 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 1.25 0.00 0.00 13 A 8.04 4.04 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 14 L 8.01 3.88 0.00 1.86 1.93 -0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.77 4.34 0.00 3.83 3.22 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 16 G 8.16 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 0.00 0.00 0.00 17 K 7.80 4.48 0.00 2.12 2.07 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.63 7.81 18 V 7.00 3.72 1.03 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 -0.08 0.00 0.00 0.65 0.00 0.00 19 N 8.15 4.49 0.00 2.68 2.56 0.00 0.00 6.83 7.71 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 20 V 8.07 3.49 2.13 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 1.33 0.00 0.00 0.97 0.00 0.00 21 D 8.09 4.34 0.00 2.85 2.68 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 22 E 8.36 3.85 0.00 1.98 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 2.19 2.24 0.00 23 V 8.03 3.62 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.65 0.00 0.00 24 G 8.48 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.19 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.28 3.89 0.00 2.18 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 2.25 2.33 0.00 27 A 8.45 3.93 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 28 Y 8.50 3.89 0.00 3.16 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 29 G 8.36 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.21 3.90 0.00 1.88 1.90 0.00 3.08 0.00 0.00 3.01 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 31 L 7.92 3.86 0.00 1.65 1.53 0.89 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.55 4.01 0.00 1.88 1.67 0.70 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.22 3.52 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 0.71 0.00 0.00 0.94 0.00 0.00 34 V 7.82 3.55 1.49 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 -0.08 0.00 0.00 0.73 0.00 0.00 35 Y 7.20 3.80 0.00 2.49 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 36 P 0.00 4.78 0.00 2.40 2.30 0.00 3.58 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 2.16 1.97 0.00 37 W 8.17 4.30 0.00 3.53 3.44 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 38 T 7.70 4.21 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 1.03 0.00 0.00 39 Q 8.33 4.50 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 40 R 7.47 3.72 0.00 1.59 1.98 0.00 2.99 0.00 0.00 2.75 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.50 0.00 41 F 7.28 4.16 0.00 1.55 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 42 F 7.56 4.54 0.00 2.90 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 0.00 0.00 0.00 43 E 8.29 4.07 0.00 1.95 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 2.31 2.25 0.00 44 S 8.07 4.58 0.00 4.11 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.49 4.58 0.00 3.40 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.13 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 47 D 8.57 4.51 0.00 2.65 2.63 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 48 L 8.33 4.93 0.00 1.68 1.65 1.06 1.10 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 49 S 8.57 4.29 0.00 4.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.45 4.75 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.10 0.00 3.59 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.11 4.33 0.00 2.67 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 53 A 8.09 3.98 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 54 V 8.10 3.72 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 1.09 0.00 0.00 0.98 0.00 0.00 55 M 8.10 4.22 0.00 2.01 2.10 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 2.61 2.90 0.00 56 G 7.90 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 57 N 7.49 4.39 0.00 2.96 2.85 0.00 0.00 7.07 8.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.19 0.00 2.09 2.03 0.00 3.59 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 59 K 8.16 3.54 0.00 1.25 0.74 0.00 1.53 0.00 0.00 1.26 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.10 1.17 7.81 60 V 7.66 3.70 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 1.21 0.00 0.00 1.12 0.00 0.00 61 K 8.17 3.91 0.00 1.93 1.79 0.00 1.69 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.43 7.81 62 A 8.08 3.90 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.18 3.88 0.00 2.33 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.74 1.23 0.00 64 G 7.98 3.51 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 0.00 65 K 8.24 3.99 0.00 1.96 1.87 0.00 1.64 0.00 0.00 1.86 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.67 7.81 66 K 8.01 4.01 0.00 1.86 1.98 0.00 1.85 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.48 7.81 67 V 7.89 3.66 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.01 0.00 0.00 68 L 8.44 4.38 0.00 2.04 1.89 1.12 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.39 3.76 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 0.00 0.00 0.00 70 A 8.16 4.13 1.56 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 0.00 0.00 71 F 8.40 4.15 0.00 3.16 3.35 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 72 S 8.90 4.18 0.00 4.58 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 73 D 8.44 4.52 0.00 2.74 2.68 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 74 G 8.10 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.29 3.88 0.00 1.46 1.43 -0.40 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.53 4.23 1.13 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 77 H 8.04 4.91 0.00 3.10 3.15 0.00 5.82 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 78 L 7.91 3.91 0.00 1.54 1.64 0.77 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.89 4.70 0.00 2.63 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 80 N 8.14 5.00 0.00 2.71 2.62 0.00 0.00 7.18 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.98 4.12 0.00 1.76 1.83 0.89 1.06 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 82 K 8.12 4.11 0.00 1.75 1.80 0.00 1.57 0.00 0.00 1.51 0.00 0.00 2.70 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.47 7.81 83 G 7.69 3.55 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 84 T 7.61 3.78 4.09 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 0.47 0.00 0.00 85 F 8.06 4.64 0.00 3.19 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 86 A 7.58 4.07 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 87 T 7.85 3.88 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 1.22 0.00 0.00 88 L 7.96 4.11 0.00 2.01 1.86 1.13 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.35 4.42 0.00 4.18 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.28 3.91 0.00 2.22 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 2.32 2.41 0.00 91 L 8.12 3.90 0.00 1.76 1.84 0.90 0.92 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 92 H 8.72 4.17 0.00 3.59 3.79 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.83 3.65 0.00 1.23 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.32 4.37 0.00 2.69 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 95 K 7.74 4.29 0.00 1.76 1.80 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.35 7.81 96 L 7.77 4.23 0.00 1.67 1.57 0.68 0.93 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 97 H 7.20 4.18 0.00 3.48 3.47 0.00 5.64 0.00 0.00 0.00 0.00 8.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.96 4.09 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 0.42 0.00 0.00 0.34 0.00 0.00 99 D 8.78 4.42 0.00 2.78 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 0.00 100 P 0.00 3.11 0.00 1.92 1.89 0.00 3.34 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.54 0.00 101 E 8.28 3.85 0.00 2.03 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 102 N 8.07 4.26 0.00 2.54 2.77 0.00 0.00 6.94 7.67 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 0.00 103 F 7.50 4.48 0.00 3.11 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 0.00 104 R 7.91 3.99 0.00 1.96 1.97 0.00 3.23 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 105 L 7.84 3.78 0.00 1.62 1.17 0.72 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.32 4.04 0.00 1.73 1.87 0.89 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.25 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.36 4.45 0.00 2.95 2.97 0.00 0.00 6.68 7.29 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 0.00 109 V 8.11 3.66 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 1.08 0.00 0.00 1.09 0.00 0.00 110 L 8.32 3.87 0.00 1.76 1.80 0.92 0.24 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 0.00 111 V 7.90 3.59 2.32 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 1.42 0.00 0.00 1.20 0.00 0.00 112 C 8.04 4.06 0.00 3.16 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.96 3.53 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 0.88 0.00 0.00 0.90 0.00 0.00 114 L 8.13 3.89 0.00 0.94 1.14 0.68 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.41 3.73 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 0.00 116 H 8.14 4.12 0.00 3.15 3.41 0.00 5.78 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.31 3.95 0.00 2.88 3.03 0.00 5.99 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 0.00 118 F 8.48 4.59 0.00 3.28 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 0.00 119 G 8.81 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 0.00 120 K 8.86 4.07 0.00 1.92 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.47 7.81 121 E 8.02 4.05 0.00 2.07 2.32 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 2.27 2.26 0.00 122 F 8.30 4.56 0.00 3.01 3.16 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 0.00 123 T 7.33 4.19 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 1.29 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.21 0.00 2.11 2.06 0.00 3.50 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.50 3.54 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 1.04 0.00 0.00 0.90 0.00 0.00 127 Q 7.84 3.43 0.00 1.54 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 128 A 8.08 4.09 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.03 3.89 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 0.00 130 Y 8.25 3.86 0.00 3.39 3.33 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 0.00 131 Q 8.86 4.16 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.76 2.62 0.00 132 K 8.01 3.96 0.00 2.00 1.83 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.59 7.81 133 V 7.69 3.48 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 0.90 0.00 0.00 0.73 0.00 0.00 134 V 8.44 3.85 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 1.02 0.00 0.00 1.15 0.00 0.00 135 A 8.37 4.12 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 0.00 136 G 8.36 3.51 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 0.00 137 V 8.11 3.28 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 0.51 0.00 0.00 0.64 0.00 0.00 138 A 8.12 3.92 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 0.00 139 N 8.25 4.32 0.00 2.89 2.90 0.00 0.00 7.03 8.10 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 0.00 140 A 8.09 4.16 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 0.00 141 L 8.16 3.94 0.00 0.89 0.73 0.08 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.82 4.53 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.92 4.26 0.00 3.32 3.52 0.00 5.75 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.18 4.44 0.00 1.84 1.85 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.17 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.75 7.81 145 Y 7.95 4.11 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 0.00 146 H 8.39 4.44 0.00 3.22 3.23 0.00 5.75 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