NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5092 8.3049 120.3387 55.5506 33.9165 175.9538 2 S 4.2406 8.2231 120.2230 57.0122 61.6553 171.3105 3 F 5.0336 8.1133 119.6856 55.6772 44.6204 175.0489 4 N 4.4373 9.0179 117.7079 54.3442 38.8524 178.2837 5 A 3.8438 8.3878 120.1664 52.9977 17.9473 176.5737 6 N 5.1703 8.0836 114.6927 52.6916 36.6648 172.5538 7 L 4.6551 7.9288 132.2631 54.3243 44.7516 174.9112 8 D 4.1467 7.6602 118.1639 58.0509 40.8514 178.6089 9 T 3.6815 7.6645 109.1542 64.6283 68.5946 175.9735 10 L 3.9356 7.7650 121.4831 57.7934 41.7361 178.6977 11 Y 4.3264 8.2529 116.8475 58.7016 38.2559 177.6909 12 R 3.5614 7.4606 121.6983 59.5293 30.2615 178.2561 13 Q 3.9468 8.2406 119.4583 58.7486 28.9341 178.4866 14 V 3.5424 7.4005 119.6973 66.1120 31.5067 177.9391 15 I 3.9383 8.2662 116.9653 63.7570 38.2014 177.3574 16 M 4.2557 8.2087 120.0049 58.2426 31.7538 178.0705 17 D 4.4098 8.5705 118.6066 57.4396 41.4133 177.5454 18 H 5.1758 8.3526 119.7332 58.1474 29.6118 176.5936 19 Y 4.0135 7.6750 120.7046 60.6732 38.7056 177.2494 20 K 3.9724 7.4982 118.6136 59.1981 32.6425 176.9197 21 N 4.6866 7.8451 116.3677 51.0545 39.9256 172.4260 22 P 4.6180 0.0000 0.0000 63.2640 32.4575 177.2258 23 R 4.5763 7.9933 124.2271 57.1356 29.6117 178.3225 24 N 5.3177 8.6860 114.1199 53.4146 38.3812 175.9315 25 K 4.8336 7.7881 117.0228 54.4002 34.0767 176.6109 26 G 4.1172 8.5908 108.2085 45.0174 0.0000 170.2620 27 V 4.7546 8.0773 116.2445 60.0858 35.7638 173.2948 28 L 4.8231 9.0874 124.8509 54.4954 43.7211 174.9425 29 N 5.0561 8.2113 114.1528 52.6096 37.3283 174.6870 30 D 4.5663 8.2671 117.6201 56.8459 41.8976 175.4249 31 S 4.8722 7.3459 113.9971 58.4585 70.0277 173.9394 32 I 4.6053 6.9246 113.6645 59.3227 41.6224 175.6558 33 V 4.5084 8.4433 124.2370 61.3656 33.5330 174.3934 34 V 4.4205 8.7817 129.8883 61.2328 33.1217 174.2072 35 D 5.4872 8.6108 126.8607 51.8715 42.3315 174.9361 36 M 4.8790 9.0226 121.3321 54.2447 35.8527 173.0842 37 N 5.4263 8.8165 122.7223 51.1427 41.0342 173.7222 38 N 4.7591 9.6629 121.4798 51.3786 39.3169 173.4163 39 P 4.4180 0.0000 0.0000 65.4027 31.8174 178.4599 40 T 4.0257 8.0484 114.1109 65.9350 68.7206 174.2257 41 C 4.5153 8.3893 116.4600 62.6044 29.8119 174.6358 42 G 3.8578 8.2718 104.2463 45.0688 0.0000 173.6958 43 D 4.6309 8.1263 121.4541 54.7878 41.8792 175.4615 44 R 5.1749 9.6732 124.4129 54.9544 34.1705 173.6542 45 I 5.1971 9.1346 118.8912 59.3406 41.7974 174.4460 46 R 4.8825 9.4738 123.6598 54.5563 33.1300 174.7424 47 L 4.8376 8.8358 128.7874 54.1814 42.6880 174.7995 48 T 4.9036 8.9561 117.9036 60.5145 70.3759 174.2126 49 M 4.8976 8.9118 126.5308 53.6225 36.1041 175.2314 50 K 4.6377 8.9641 120.8801 55.4271 34.3461 173.9361 51 L 5.4066 8.7733 126.3063 52.2904 41.8379 177.4623 52 D 4.7403 9.1344 130.4978 52.0426 41.5561 174.3545 53 G 4.0852 7.3975 112.6747 44.9589 0.0000 172.6040 54 D 5.1292 9.0232 119.8958 53.6062 44.2725 175.7405 55 I 4.9334 7.7869 111.2943 59.0005 41.3446 174.3205 56 V 4.3352 8.0878 125.0173 61.0512 31.4686 175.1275 57 E 4.4688 9.5682 127.7219 57.1122 30.9340 175.1311 58 D 4.8602 7.8665 116.7730 53.2504 45.1891 174.1986 59 A 4.9302 8.2205 123.1185 51.2323 22.2567 175.8384 60 K 4.4294 9.5637 123.1560 54.5125 35.5082 175.5496 61 F 5.5206 7.2952 118.0425 55.0024 41.4085 173.0606 62 E 5.0351 9.2467 122.6779 54.4799 32.4141 174.7788 63 G 4.5762 9.2074 113.2544 45.0466 0.0000 171.6262 64 E 4.7738 9.5292 124.2536 53.4649 33.4134 173.0631 65 G 4.2168 8.5540 114.3442 45.2177 0.0000 174.5240 66 C 4.3713 10.1078 125.5447 59.0848 29.5967 174.5101 67 S 4.1808 8.4195 118.2735 61.2785 62.6421 176.5726 68 I 3.2706 7.2650 116.2979 63.2648 37.7527 178.3120 69 S 4.1094 7.8947 118.0149 61.0963 62.5779 176.2878 70 M 4.1671 8.0314 118.8771 57.4848 30.8687 178.2193 71 A 4.0131 7.3417 122.3823 54.7961 19.1037 179.6162 72 S 4.0420 8.4252 113.0695 61.3833 63.1366 176.3772 73 A 3.8635 7.7730 124.3020 54.9697 18.1048 179.8750 74 S 3.3776 7.2374 113.4901 60.5350 62.9748 176.4376 75 M 3.8282 7.7343 121.8682 58.8197 32.1871 177.9830 76 M 4.1249 8.2049 118.4701 58.1991 32.3916 178.2564 77 T 3.8651 8.0035 110.9737 64.7526 68.7971 176.4017 78 Q 4.0715 7.4130 121.0482 58.7012 28.9874 177.7634 79 A 4.2748 7.7611 121.0849 54.4512 18.8884 179.2781 80 I 3.7073 8.1617 117.6196 63.7188 37.8651 177.6662 81 K 4.0768 8.7642 121.0082 58.1856 32.4971 176.4927 82 G 4.2440 7.7414 107.1319 45.1972 0.0000 171.3092 83 K 4.6639 7.9926 117.9098 54.6909 36.5545 174.7171 84 D 5.1123 8.1221 118.2182 52.5895 44.2216 177.3124 85 I 3.7358 8.5347 120.1261 64.7663 36.9311 178.3866 86 E 3.9478 8.1076 119.6983 59.5471 29.4716 178.7900 87 T 3.8770 7.8993 115.0437 66.7387 68.4933 176.3967 88 A 4.0314 8.0819 122.6025 54.9625 18.3658 179.6621 89 L 3.9871 8.3921 118.1879 58.1098 41.5567 179.9049 90 S 4.2237 8.2072 115.2270 61.6211 62.7859 176.3011 91 M 3.7921 8.4122 121.3532 58.1348 31.7267 178.0743 92 S 4.6491 7.8899 114.2401 60.6321 63.7807 176.3783 93 K 4.0782 8.2619 123.3100 59.2287 31.9407 179.0003 94 I 3.7638 8.6853 121.1147 64.4512 36.8907 178.0061 95 F 4.1069 8.3066 120.1448 61.2928 39.0815 176.6569 96 S 4.3876 7.9845 112.5697 60.9590 62.3280 175.5673 97 D 4.5354 8.6557 121.1134 57.0572 40.9032 177.6756 98 M 4.9849 8.4130 120.7616 58.5990 32.1227 177.8894 99 M 4.2651 7.8285 116.1074 56.8129 32.1932 177.2317 100 Q 4.5632 7.3901 118.3560 56.9535 30.5592 176.6851 101 G 3.6991 8.7184 108.5713 45.0573 0.0000 174.2692 102 K 4.1786 8.6258 120.3684 56.1322 32.9350 176.0605 103 E 4.2700 7.5710 117.4595 55.2061 32.5243 177.1532 104 Y 4.9287 7.1262 117.9670 57.4763 37.4249 177.6876 105 D 4.7024 9.9512 125.2741 52.5022 41.3926 175.2016 106 D 4.5138 8.7996 127.4205 56.5954 41.2911 177.0455 107 S 4.5482 8.2840 112.0037 58.2985 64.2164 174.6931 108 I 3.3911 8.4177 119.7382 62.0147 34.6243 173.4946 109 D 4.7332 8.5919 122.0306 52.9682 39.8294 175.8079 110 L 4.8515 7.8511 128.7119 53.9662 42.9585 179.5994 111 G 3.9630 8.4235 108.0651 48.0094 0.0000 175.3120 112 D 4.4010 8.0188 120.7437 55.9740 40.1019 178.6614 113 I 3.6807 7.7745 121.0266 63.8490 36.8870 178.1190 114 E 3.8564 8.7013 118.8752 59.5182 29.4595 179.0280 115 A 4.1884 7.5979 120.4866 54.7303 18.4737 178.9416 116 L 4.3255 8.8805 117.2703 55.7278 41.9200 178.8959 117 Q 4.0730 8.2127 118.0313 59.0142 28.4677 177.8006 118 G 3.8180 7.9926 107.7988 47.0370 0.0000 174.9702 119 V 3.7643 7.2118 122.0602 65.6105 31.7610 178.0536 120 S 4.0967 8.3844 113.2979 60.6973 62.2865 174.8280 121 K 4.6223 8.4762 116.1687 55.9437 33.9608 175.5206 122 F 4.6452 8.0792 118.7132 54.9277 40.5828 175.1221 123 P 4.5044 0.0000 0.0000 65.0707 31.2425 176.9723 124 A 4.5251 8.0707 118.3933 52.4693 19.7252 177.3352 125 R 4.6095 8.5545 113.7128 55.5163 31.8448 177.1163 126 I 3.9642 7.7407 119.7717 63.2864 38.6693 177.8716 127 K 4.1230 8.0071 119.2822 58.9894 32.3056 178.3548 128 C 4.3273 7.9412 115.4441 61.3714 28.1648 175.1172 129 A 4.1626 7.8878 122.3105 54.4281 17.8115 179.5570 130 T 4.1073 7.7382 114.8138 66.4044 68.4169 176.3255 131 L 3.9555 7.8716 122.0650 59.0876 41.9781 179.2155 132 S 4.2169 8.6022 114.8938 61.0853 62.9806 176.6014 133 W 4.0736 8.0855 130.6770 60.5241 30.6255 178.2603 134 K 3.0466 7.8848 118.9172 59.1008 31.3232 178.5382 135 A 3.8994 7.3031 119.1151 55.0175 18.4379 179.0715 136 L 3.8998 7.7546 118.8671 58.0854 42.1741 178.8418 137 E 3.5941 8.0105 119.9763 58.5292 29.1979 177.7407 138 K 4.3007 7.7811 117.3245 56.8828 32.2254 177.5570 139 G 3.9241 7.0684 105.2252 46.2684 0.0000 174.7817 140 V 4.2871 7.2631 115.9706 59.9503 31.8946 171.3275 141 A 4.6112 7.6126 121.0643 52.4616 22.4013 175.9709 142 K 4.0820 8.8816 119.4578 55.7977 36.6505 174.1141 143 E 4.0890 8.2876 121.7966 56.1670 29.1238 172.9210 144 E 4.7366 7.6657 116.9401 54.0157 31.8866 176.4124 145 G 3.6766 8.8907 110.7380 47.2344 0.0000 172.7558 146 G 3.8556 7.1491 117.0031 44.2360 0.0000 172.2832 147 N 4.3306 7.9545 120.5207 53.4227 37.3187 174.8541 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 2.47 2.26 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 2 S 8.22 4.24 0.00 3.57 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 3 F 8.11 5.03 0.00 3.01 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 4 N 9.02 4.44 0.00 2.96 2.94 0.00 0.00 6.80 7.43 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 5 A 8.39 3.84 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 6 N 8.08 5.17 0.00 2.72 2.82 0.00 0.00 7.00 8.58 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 7 L 7.93 4.66 0.00 1.76 1.63 1.06 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 8 D 7.66 4.15 0.00 2.82 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 9 T 7.66 3.68 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 10 L 7.76 3.94 0.00 1.95 1.79 0.95 0.86 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 11 Y 8.25 4.33 0.00 3.13 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 7.46 3.56 0.00 1.66 1.91 0.00 3.01 0.00 0.00 2.93 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 13 Q 8.24 3.95 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 14 V 7.40 3.54 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 1.08 0.00 0.00 0.99 0.00 0.00 15 I 8.27 3.94 2.02 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.05 1.05 0.00 0.00 16 M 8.21 4.26 0.00 2.15 2.29 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 17 D 8.57 4.41 0.00 2.86 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 18 H 8.35 5.18 0.00 3.39 3.44 0.00 5.88 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.67 4.01 0.00 3.23 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 20 K 7.50 3.97 0.00 1.91 1.91 0.00 1.89 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.55 1.79 7.81 21 N 7.85 4.69 0.00 2.85 2.80 0.00 0.00 6.72 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 22 P 0.00 4.62 0.00 2.09 2.00 0.00 3.78 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.96 0.00 23 R 7.99 4.58 0.00 1.83 1.78 0.00 3.13 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 24 N 8.69 5.32 0.00 2.76 3.01 0.00 0.00 6.69 7.85 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 25 K 7.79 4.83 0.00 1.55 1.66 0.00 1.79 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.38 7.81 26 G 8.59 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.08 4.75 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 0.66 0.00 0.00 0.90 0.00 0.00 28 L 9.09 4.82 0.00 1.59 1.57 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.21 5.06 0.00 2.77 2.85 0.00 0.00 5.94 8.05 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 30 D 8.27 4.57 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 31 S 7.35 4.87 0.00 3.92 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 32 I 6.92 4.61 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.32 0.90 0.00 0.00 33 V 8.44 4.51 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 0.88 0.00 0.00 1.01 0.00 0.00 34 V 8.78 4.42 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 0.90 0.00 0.00 0.92 0.00 0.00 35 D 8.61 5.49 0.00 2.66 2.57 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 0.00 0.00 0.00 0.00 36 M 9.02 4.88 0.00 2.09 1.86 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 37 N 8.82 5.43 0.00 2.69 2.72 0.00 0.00 6.03 8.04 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 38 N 9.66 4.76 0.00 2.63 2.74 0.00 0.00 7.40 7.60 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 39 P 0.00 4.42 0.00 2.08 2.11 0.00 3.74 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 40 T 8.05 4.03 4.47 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 1.22 0.00 0.00 41 C 8.39 4.52 0.00 3.07 2.92 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 42 G 8.27 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 43 D 8.13 4.63 0.00 2.61 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 9.67 5.17 0.00 1.80 1.70 0.00 3.03 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.71 0.00 45 I 9.13 5.20 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.65 0.91 0.00 0.00 46 R 9.47 4.88 0.00 1.72 1.88 0.00 3.11 0.00 0.00 3.09 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 47 L 8.84 4.84 0.00 1.72 1.57 0.91 0.49 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 48 T 8.96 4.90 4.44 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 1.22 0.00 0.00 49 M 8.91 4.90 0.00 1.95 2.02 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 2.53 2.47 0.00 50 K 8.96 4.64 0.00 1.78 1.85 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.63 7.81 51 L 8.77 5.41 0.00 1.60 1.79 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 52 D 9.13 4.74 0.00 2.68 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 53 G 7.40 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 0.00 0.00 0.00 0.00 54 D 9.02 5.13 0.00 2.56 2.60 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 55 I 7.79 4.93 1.88 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 1.40 1.15 0.96 0.00 0.00 56 V 8.09 4.34 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 0.75 0.00 0.00 0.98 0.00 0.00 57 E 9.57 4.47 0.00 1.96 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 2.25 2.24 0.00 58 D 7.87 4.86 0.00 2.79 2.42 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 59 A 8.22 4.93 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 60 K 9.56 4.43 0.00 1.55 1.42 0.00 1.54 0.00 0.00 1.59 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.17 1.45 7.81 61 F 7.30 5.52 0.00 3.11 3.12 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 0.00 0.00 0.00 0.00 62 E 9.25 5.04 0.00 2.16 1.82 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 2.33 2.37 0.00 63 G 9.21 4.58 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 64 E 9.53 4.77 0.00 2.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 65 G 8.55 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 66 C 10.11 4.37 0.00 2.80 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 67 S 8.42 4.18 0.00 4.08 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 68 I 7.27 3.27 1.56 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.75 -0.18 0.00 0.00 69 S 7.89 4.11 0.00 3.94 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 70 M 8.03 4.17 0.00 2.27 2.36 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.76 0.00 71 A 7.34 4.01 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 0.00 0.00 72 S 8.43 4.04 0.00 4.02 4.12 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 0.00 0.00 0.00 0.00 73 A 7.77 3.86 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 74 S 7.24 3.38 0.00 3.12 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 75 M 7.73 3.83 0.00 2.04 2.15 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 2.60 2.69 0.00 76 M 8.20 4.12 0.00 2.14 2.03 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 2.59 2.83 0.00 77 T 8.00 3.87 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 78 Q 7.41 4.07 0.00 2.18 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 7.10 0.00 0.00 0.00 0.00 0.00 2.62 2.49 0.00 79 A 7.76 4.27 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 80 I 8.16 3.71 2.12 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 1.58 0.96 0.00 0.00 81 K 8.76 4.08 0.00 2.10 1.92 0.00 2.03 0.00 0.00 1.80 0.00 0.00 3.29 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.51 1.64 7.81 82 G 7.74 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 0.00 0.00 0.00 0.00 83 K 7.99 4.66 0.00 1.82 1.72 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.54 7.81 84 D 8.12 5.11 0.00 2.67 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 85 I 8.53 3.74 2.02 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 1.40 0.52 0.91 0.00 0.00 86 E 8.11 3.95 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 87 T 7.90 3.88 4.37 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 1.24 0.00 0.00 88 A 8.08 4.03 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 89 L 8.39 3.99 0.00 1.85 1.75 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 90 S 8.21 4.22 0.00 4.14 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 91 M 8.41 3.79 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.86 0.00 92 S 7.89 4.65 0.00 4.20 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 K 8.26 4.08 0.00 2.22 2.08 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.49 1.67 7.81 94 I 8.69 3.76 2.22 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.58 1.07 0.00 0.00 95 F 8.31 4.11 0.00 3.42 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 96 S 7.98 4.39 0.00 4.25 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 0.00 97 D 8.66 4.54 0.00 2.86 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 98 M 8.41 4.98 0.00 1.82 2.13 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 2.58 2.89 0.00 99 M 7.83 4.27 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.23 0.00 100 Q 7.39 4.56 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.88 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 101 G 8.72 3.70 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 0.00 0.00 0.00 102 K 8.63 4.18 0.00 1.81 2.07 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.38 7.81 103 E 7.57 4.27 0.00 1.93 1.57 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 0.00 2.15 2.17 0.00 104 Y 7.13 4.93 0.00 2.97 2.26 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 0.00 105 D 9.95 4.70 0.00 2.91 2.79 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 0.00 106 D 8.80 4.51 0.00 2.65 2.73 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 0.00 107 S 8.28 4.55 0.00 4.26 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 0.00 108 I 8.42 3.39 1.94 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 1.27 0.70 1.02 0.00 0.00 109 D 8.59 4.73 0.00 2.62 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.85 4.85 0.00 1.63 1.49 0.98 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 111 G 8.42 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 0.00 112 D 8.02 4.40 0.00 2.98 2.97 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 0.00 113 I 7.77 3.68 1.86 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.76 0.75 0.00 0.00 114 E 8.70 3.86 0.00 1.94 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 2.22 2.39 0.00 115 A 7.60 4.19 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 0.00 116 L 8.88 4.33 0.00 2.04 1.81 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 8.21 4.07 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.13 0.00 0.00 0.00 0.00 0.00 2.27 2.64 0.00 118 G 7.99 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 0.00 119 V 7.21 3.76 2.22 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 1.06 0.00 0.00 0.93 0.00 0.00 120 S 8.38 4.10 0.00 3.98 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 0.00 121 K 8.48 4.62 0.00 1.76 1.69 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.34 1.38 7.81 122 F 8.08 4.65 0.00 3.08 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 0.00 123 P 0.00 4.50 0.00 2.08 2.15 0.00 3.73 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 124 A 8.07 4.53 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 0.00 125 R 8.55 4.61 0.00 2.04 1.86 0.00 2.92 0.00 0.00 2.83 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.48 0.00 126 I 7.74 3.96 2.05 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 1.56 1.00 0.00 0.00 127 K 8.01 4.12 0.00 1.84 1.86 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.42 7.81 128 C 7.94 4.33 0.00 3.12 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 0.00 129 A 7.89 4.16 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 0.00 130 T 7.74 4.11 4.43 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 1.25 0.00 0.00 131 L 7.87 3.96 0.00 1.85 1.75 0.99 1.04 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 0.00 132 S 8.60 4.22 0.00 3.94 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 0.00 133 W 8.09 4.07 0.00 3.17 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 0.00 134 K 7.88 3.05 0.00 1.88 1.91 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.26 1.37 7.81 135 A 7.30 3.90 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 L 7.75 3.90 0.00 1.83 1.51 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.01 3.59 0.00 1.16 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 1.97 1.90 0.00 138 K 7.78 4.30 0.00 1.72 1.79 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.37 7.81 139 G 7.07 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 V 7.26 4.29 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 0.62 0.00 0.00 0.92 0.00 0.00 141 A 7.61 4.61 1.12 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 0.00 0.00 0.00 0.00 0.00 0.00 142 K 8.88 4.08 0.00 1.64 1.74 0.00 2.00 0.00 0.00 1.62 0.00 0.00 2.71 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.25 7.81 143 E 8.29 4.09 0.00 2.30 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.42 0.00 144 E 7.67 4.74 0.00 2.28 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 2.22 2.29 0.00 145 G 8.89 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 0.00 146 G 7.15 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 0.00 147 N 7.95 4.33 0.00 2.83 2.74 0.00 0.00 6.66 7.23 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