NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9014 8.0544 120.3861 62.7147 32.5417 175.3959 2 H 4.2523 8.6313 125.5867 55.3272 28.5418 172.4346 3 L 4.7294 7.7587 125.6879 52.4379 45.8474 176.8339 4 T 4.1244 8.4829 114.0205 60.5116 69.2859 173.7253 5 P 4.4719 0.0000 0.0000 64.5732 31.6473 177.6682 6 E 4.2749 7.8608 116.4092 57.3696 30.7654 178.1501 7 E 4.0015 7.8951 119.0847 58.8845 29.5108 179.1512 8 K 3.9226 8.6089 119.3351 59.0024 31.5736 179.5559 9 S 4.0255 7.7735 114.1328 61.4111 63.0343 176.1979 10 A 3.9934 7.8352 125.1112 54.7069 18.0510 179.5820 11 V 3.3327 7.7993 116.4504 66.5446 31.6085 178.2603 12 T 3.9517 7.8893 115.0170 66.5882 68.1035 176.3256 13 A 4.0288 8.2096 121.9298 55.3570 18.7380 179.1643 14 L 3.9275 8.0263 118.2916 57.5887 42.1555 178.8030 15 W 4.3239 8.8342 128.8740 60.1623 30.4362 177.9954 16 G 3.9490 8.3044 104.7642 46.6997 0.0000 174.5900 17 K 4.4239 7.6023 118.5435 55.2912 32.9856 176.4114 18 V 3.6076 7.2832 120.8290 62.0047 32.1859 175.8552 19 N 4.5183 8.1504 125.3669 51.9455 38.7973 175.2886 20 V 3.5185 8.1034 127.6861 66.3048 31.7212 177.2574 21 D 4.3640 8.0943 117.6983 57.2233 40.5496 178.3380 22 E 3.8373 7.9993 119.2316 59.4324 29.7260 179.1157 23 V 3.6035 8.1500 118.8598 65.5489 31.5432 178.3074 24 G 3.6393 8.5845 106.2717 47.8468 0.0000 176.0949 25 G 3.7132 7.9727 108.1630 46.5646 0.0000 175.6497 26 E 3.9772 7.7658 121.0361 59.2464 29.7200 178.8878 27 A 3.9273 8.0365 120.8619 55.0721 18.5832 179.4790 28 L 4.0008 7.9374 118.9446 57.9906 42.1239 179.4602 29 G 3.5242 7.7813 105.8033 48.0232 0.0000 176.0255 30 R 3.9031 7.8852 121.0834 58.3774 29.9583 178.9584 31 L 4.0056 7.8249 120.2631 58.3444 41.6726 179.1996 32 L 4.0672 7.7548 119.6271 56.7714 41.2170 179.5245 33 V 3.6411 7.2825 117.6140 65.4002 31.7203 177.8479 34 V 3.5363 7.9318 117.2315 64.0884 32.7929 175.6534 35 Y 3.7146 7.1643 116.4834 53.9207 37.8064 174.1257 36 P 4.4422 0.0000 0.0000 64.2436 31.5182 178.2366 37 W 4.4077 7.7660 116.3747 59.2107 28.2793 177.9137 38 T 4.2581 7.8392 110.9027 64.2730 68.1568 176.1496 39 Q 4.4669 8.0871 121.2999 58.0990 28.4694 178.0270 40 R 3.9217 7.6526 116.8819 58.4538 29.2177 177.5999 41 F 4.4525 7.2475 115.5086 56.9741 40.2864 175.6519 42 F 4.5580 8.1039 118.8237 56.7953 39.2060 176.7678 43 E 4.2617 8.1559 119.8490 58.1669 29.9013 178.3710 44 S 4.5474 7.9911 111.9826 59.2231 63.7135 174.8757 45 F 4.5370 8.1893 119.4499 58.6043 39.9775 176.4670 46 G 3.9937 8.0981 106.1889 44.4373 0.0000 174.7652 47 D 4.5209 8.5922 126.6209 54.1744 40.9720 175.4944 48 L 4.8904 8.3381 126.2541 54.4033 42.9417 178.1020 49 S 4.2774 8.4474 116.9838 60.6699 63.1880 174.5916 50 T 4.7428 7.4601 109.8559 58.2361 73.0891 172.7883 51 P 4.1921 0.0000 0.0000 66.0276 31.3484 178.7975 52 D 4.4232 8.0666 116.8861 57.1125 40.5250 178.5689 53 A 3.9727 7.4967 120.1320 54.9912 18.6169 179.6339 54 V 3.6617 8.0606 117.0105 66.5187 31.4828 178.1257 55 M 3.9784 8.2740 117.5411 58.3356 31.8462 177.9697 56 G 3.7091 7.9934 104.4969 45.8809 0.0000 173.5532 57 N 4.2784 7.8108 119.6972 53.0854 39.6663 173.3063 58 P 4.3351 0.0000 0.0000 65.9294 31.1721 178.4554 59 K 3.6696 8.5009 118.7058 58.7005 31.8606 179.4456 60 V 3.6332 7.6862 118.0208 65.9106 31.4754 177.9245 61 K 3.8558 8.3456 118.3514 59.6305 32.0953 179.1742 62 A 3.9801 7.9926 120.8012 55.4015 18.1909 179.2037 63 H 4.4552 8.4029 117.0485 59.3071 30.0361 177.7435 64 G 3.6165 8.3866 107.7813 47.6349 0.0000 175.5600 65 K 4.0777 7.9144 121.9082 58.8305 32.2888 179.0054 66 K 4.0003 7.5924 119.4261 59.2118 32.1911 179.0232 67 V 3.6338 7.8957 118.5484 66.2258 31.4623 178.1423 68 L 4.3319 8.2147 118.8013 57.4756 41.1704 179.6868 69 G 3.7521 8.0943 105.1054 47.7470 0.0000 175.2767 70 A 4.2304 8.0425 123.0505 54.8731 18.4959 179.1259 71 F 4.2022 8.4739 119.1976 62.0610 39.1550 177.4452 72 S 4.1136 8.5362 113.3271 61.9999 63.0172 176.3378 73 D 4.5865 8.3183 121.4333 56.8264 40.5051 179.0390 74 G 3.4087 7.7794 106.2050 47.6673 0.0000 175.4866 75 L 4.0096 7.3273 119.9170 56.6337 41.5663 178.4079 76 A 4.4431 7.2978 118.6978 51.9079 19.7780 176.8455 77 H 4.8461 8.5624 116.2607 54.6459 29.8780 175.3976 78 L 3.7127 8.0058 119.8995 57.5639 41.8417 178.4366 79 D 4.6917 7.8866 115.7611 54.6136 41.6565 176.0556 80 N 5.0132 8.6246 119.8608 51.4106 39.4556 176.1335 81 L 3.9949 8.1149 120.5391 57.7278 42.0012 178.8934 82 K 3.9220 8.0902 118.0574 59.5593 31.8333 179.3497 83 G 3.6208 7.9377 103.7394 48.0710 0.0000 175.2355 84 T 3.8035 7.8206 117.3287 66.0567 68.7126 175.8796 85 F 4.6904 8.1847 117.4630 57.1818 38.9430 177.3126 86 A 4.1945 7.7243 123.3961 55.9383 18.2309 180.5563 87 T 3.8976 7.8907 107.3271 64.8913 68.8553 176.5284 88 L 4.1445 7.9961 121.4625 57.3985 41.7573 179.0964 89 S 4.4203 8.3193 114.7173 61.0125 62.3056 176.0942 90 E 3.8556 7.9751 121.2351 59.1086 29.1813 179.0378 91 L 3.8870 7.7615 119.8107 58.7358 42.2215 178.9487 92 H 4.2539 8.5132 115.9783 59.1000 28.2426 176.7822 93 C 3.6004 7.7572 121.1452 61.9248 31.0527 175.2495 94 D 4.1539 8.2529 121.5629 56.7187 40.6866 177.8886 95 K 4.1897 7.6122 116.7660 58.3863 33.0461 177.9246 96 L 4.0772 7.7208 117.0430 55.7294 41.8756 176.7305 97 H 4.1685 7.3640 113.4863 56.8473 26.0808 175.2499 98 V 3.7551 7.9323 119.9537 61.3495 31.6425 174.9912 99 D 4.3364 8.7818 127.7258 53.7699 41.6536 175.0130 100 P 2.9700 0.0000 0.0000 65.2260 31.7614 177.8367 101 E 3.8433 7.9559 118.2960 59.4155 29.2690 178.5911 102 N 4.2939 8.0843 116.7024 56.2943 38.6338 177.3149 103 F 4.5238 7.4230 119.2063 60.5715 39.0602 177.9913 104 R 4.0345 7.9088 117.4375 59.0380 30.0682 178.8286 105 L 3.8376 7.8258 118.8766 57.6940 41.5180 179.3340 106 L 4.1225 8.1488 120.4160 57.8930 41.9812 179.2887 107 G 3.6159 7.9557 105.5039 47.9304 0.0000 175.5238 108 N 4.4468 8.0935 118.8066 55.9202 38.5497 177.7651 109 V 3.6299 7.8274 119.5855 65.7493 31.5781 177.7432 110 L 3.8699 8.1395 120.3427 58.2466 42.0419 179.0749 111 V 3.6139 7.7553 117.9922 66.4102 31.4537 177.8322 112 C 4.2014 8.0959 116.3720 62.4498 27.8891 176.3714 113 V 3.4706 7.7070 120.0776 66.0104 31.1221 178.1371 114 L 3.7305 8.0072 118.8689 57.4265 41.2681 179.5382 115 A 3.6500 7.2250 120.4684 55.2783 18.1527 179.1002 116 H 4.0675 7.8410 115.5710 59.5577 29.9169 176.5894 117 H 4.0075 7.8045 119.0639 58.5161 30.1097 176.5006 118 F 4.7140 8.2212 117.9243 57.3717 39.6477 177.1849 119 G 3.7180 8.6220 108.8048 46.2617 0.0000 176.5159 120 K 4.2144 8.8230 121.9108 58.4506 32.0798 177.4135 121 E 4.1372 8.3679 119.2615 57.9864 29.8877 177.0196 122 F 4.6983 8.2572 123.0155 57.2057 37.9022 175.5827 123 T 4.2112 7.4910 115.7780 60.0287 71.2938 173.4392 124 P 4.1647 0.0000 0.0000 65.6841 31.0364 177.2469 125 P 4.3095 0.0000 0.0000 64.9604 31.2630 178.8737 126 V 3.6289 7.1768 116.4548 65.5439 31.3468 177.6870 127 Q 3.5725 7.7458 119.2237 59.1924 28.4862 177.9952 128 A 3.9674 7.8907 121.4283 55.4570 18.2674 179.5606 129 A 3.8969 7.6752 117.6175 55.5251 18.5022 179.5183 130 Y 3.8729 8.1179 115.2711 61.2361 38.0038 178.8553 131 Q 4.2704 8.6524 119.4967 58.8822 28.8014 178.9059 132 K 4.0539 7.8614 119.2136 59.1234 32.0468 179.7160 133 V 3.5003 7.7050 118.6514 66.2120 31.5716 178.6632 134 V 3.8846 8.5258 112.2909 64.2255 31.3015 178.5416 135 A 4.1362 8.1376 120.7987 55.0714 18.2659 179.8901 136 G 3.5319 8.1710 104.3212 47.9493 0.0000 176.1438 137 V 3.4139 7.9628 120.4523 65.4695 31.3527 178.0175 138 A 3.9881 8.0956 120.6004 55.2997 18.0257 179.4213 139 N 4.3101 8.1464 113.7696 56.3396 38.6464 177.2756 140 A 4.1596 8.0658 122.2921 55.0953 18.2331 179.5867 141 L 3.9254 8.0579 116.7937 56.6404 41.6413 178.3422 142 A 4.6904 7.6202 119.8030 52.2775 19.3232 178.3173 143 H 4.2827 8.0996 112.9056 57.9117 28.7118 176.5582 144 K 4.3452 8.0536 117.6356 56.2174 32.1235 176.3342 145 Y 4.1297 7.9917 118.0673 58.2452 38.4411 175.5722 146 H 4.4870 8.2751 117.7670 56.0997 28.4363 173.1936 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 V 8.05 3.90 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 0.97 0.00 0.00 0.88 0.00 0.00 2 H 8.63 4.25 0.00 3.21 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.76 4.73 0.00 1.52 1.40 0.78 0.83 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 4 T 8.48 4.12 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 1.20 0.00 0.00 5 P 0.00 4.47 0.00 2.22 2.32 0.00 3.66 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 2.05 1.94 0.00 6 E 7.86 4.27 0.00 2.11 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 0.00 2.28 2.20 0.00 7 E 7.90 4.00 0.00 2.19 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 2.26 2.28 0.00 8 K 8.61 3.92 0.00 1.69 1.78 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.51 7.81 9 S 7.77 4.03 0.00 4.03 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.84 3.99 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 11 V 7.80 3.33 1.87 0.00 0.00 0.00 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 0.44 0.00 0.00 12 T 7.89 3.95 4.27 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 1.26 0.00 0.00 13 A 8.21 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 14 L 8.03 3.93 0.00 1.75 1.94 0.72 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.83 4.32 0.00 3.83 3.32 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 16 G 8.30 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 17 K 7.60 4.42 0.00 1.93 2.05 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.54 7.81 18 V 7.28 3.61 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 -0.05 0.00 0.00 0.74 0.00 0.00 19 N 8.15 4.52 0.00 2.71 2.68 0.00 0.00 6.81 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 8.10 3.52 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 1.15 0.00 0.00 1.03 0.00 0.00 21 D 8.09 4.36 0.00 2.70 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 22 E 8.00 3.84 0.00 1.99 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 2.24 2.26 0.00 23 V 8.15 3.60 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 0.84 0.00 0.00 0.72 0.00 0.00 24 G 8.58 3.64 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 0.00 0.00 0.00 25 G 7.97 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 26 E 7.77 3.98 0.00 2.21 1.93 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 2.27 2.40 0.00 27 A 8.04 3.93 1.26 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 28 L 7.94 4.00 0.00 1.87 1.64 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.78 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 3.90 0.00 1.84 1.91 0.00 3.32 0.00 0.00 3.02 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 31 L 7.82 4.01 0.00 1.92 1.88 1.01 0.72 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 32 L 7.75 4.07 0.00 2.02 1.67 0.89 0.21 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 33 V 7.28 3.64 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 0.71 0.00 0.00 0.89 0.00 0.00 34 V 7.93 3.54 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 -0.04 0.00 0.00 0.78 0.00 0.00 35 Y 7.16 3.71 0.00 2.58 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 4.44 0.00 2.31 2.29 0.00 3.59 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 2.25 1.93 0.00 37 W 7.77 4.41 0.00 3.58 3.52 0.00 0.00 0.00 0.00 0.00 0.00 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 7.84 4.26 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 39 Q 8.09 4.47 0.00 2.31 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 40 R 7.65 3.92 0.00 1.64 1.95 0.00 2.98 0.00 0.00 2.70 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.50 0.00 41 F 7.25 4.45 0.00 1.85 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 8.10 4.56 0.00 2.92 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.16 4.26 0.00 1.96 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 2.32 2.26 0.00 44 S 7.99 4.55 0.00 4.14 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 8.19 4.54 0.00 3.30 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 46 G 8.10 3.99 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 0.00 0.00 0.00 47 D 8.59 4.52 0.00 2.67 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 8.34 4.89 0.00 1.67 1.63 1.09 1.05 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 49 S 8.45 4.28 0.00 4.00 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 50 T 7.46 4.74 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 51 P 0.00 4.19 0.00 2.15 2.10 0.00 3.58 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 2.08 2.14 0.00 52 D 8.07 4.42 0.00 2.67 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 53 A 7.50 3.97 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 54 V 8.06 3.66 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 1.02 0.00 0.00 1.02 0.00 0.00 55 M 8.27 3.98 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.76 0.00 56 G 7.99 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 57 N 7.81 4.28 0.00 3.02 2.86 0.00 0.00 6.84 8.99 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 58 P 0.00 4.34 0.00 2.23 2.26 0.00 3.70 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 2.00 2.02 0.00 59 K 8.50 3.67 0.00 1.40 0.74 0.00 1.72 0.00 0.00 1.28 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.17 1.23 7.81 60 V 7.69 3.63 2.30 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 1.15 0.00 0.00 1.05 0.00 0.00 61 K 8.35 3.86 0.00 1.89 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.58 7.81 62 A 7.99 3.98 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 63 H 8.40 4.46 0.00 3.63 3.64 0.00 5.79 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 64 G 8.39 3.62 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 0.00 0.00 0.00 65 K 7.91 4.08 0.00 1.80 1.99 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.54 7.81 66 K 7.59 4.00 0.00 2.03 2.01 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.50 7.81 67 V 7.90 3.63 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.89 0.00 0.00 68 L 8.21 4.33 0.00 2.03 1.86 1.08 0.81 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 69 G 8.09 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 70 A 8.04 4.23 1.59 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 71 F 8.47 4.20 0.00 3.32 3.38 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 72 S 8.54 4.11 0.00 4.32 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 0.00 73 D 8.32 4.59 0.00 2.75 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 74 G 7.78 3.41 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 0.00 75 L 7.33 4.01 0.00 1.36 1.49 0.37 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.30 4.44 1.14 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 0.00 0.00 77 H 8.56 4.85 0.00 3.02 3.14 0.00 5.83 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 8.01 3.71 0.00 1.53 1.67 0.82 1.04 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 79 D 7.89 4.69 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 8.62 5.01 0.00 2.68 2.63 0.00 0.00 7.14 6.76 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 81 L 8.11 3.99 0.00 1.74 1.80 0.88 0.99 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 82 K 8.09 3.92 0.00 1.71 1.63 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.46 7.81 83 G 7.94 3.62 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 0.00 0.00 0.00 84 T 7.82 3.80 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 85 F 8.18 4.69 0.00 3.23 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 86 A 7.72 4.19 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 87 T 7.89 3.90 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 88 L 8.00 4.14 0.00 2.09 1.90 1.23 0.94 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 89 S 8.32 4.42 0.00 4.10 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 90 E 7.98 3.86 0.00 2.12 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 2.30 2.46 0.00 91 L 7.76 3.89 0.00 1.90 1.90 0.91 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.51 4.25 0.00 3.52 3.68 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.76 3.60 0.00 1.23 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 94 D 8.25 4.15 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 95 K 7.61 4.19 0.00 1.82 1.79 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.36 7.81 96 L 7.72 4.08 0.00 1.74 1.64 0.68 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.36 4.17 0.00 3.48 3.53 0.00 5.65 0.00 0.00 0.00 0.00 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.93 3.76 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 0.18 0.00 0.00 0.49 0.00 0.00 99 D 8.78 4.34 0.00 2.80 2.59 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 0.00 100 P 0.00 2.97 0.00 1.87 1.72 0.00 3.36 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 1.39 0.52 0.00 101 E 7.96 3.84 0.00 1.97 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 2.40 0.00 102 N 8.08 4.29 0.00 2.47 2.74 0.00 0.00 6.94 8.89 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 0.00 103 F 7.42 4.52 0.00 3.08 2.90 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 0.00 0.00 0.00 104 R 7.91 4.03 0.00 1.96 1.97 0.00 3.25 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 105 L 7.83 3.84 0.00 1.76 1.42 0.66 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.15 4.12 0.00 1.83 1.86 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 107 G 7.96 3.62 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 0.00 0.00 0.00 108 N 8.09 4.45 0.00 2.82 2.94 0.00 0.00 6.70 7.07 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 0.00 109 V 7.83 3.63 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 1.05 0.00 0.00 1.16 0.00 0.00 110 L 8.14 3.87 0.00 1.79 1.82 0.87 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.76 3.61 2.36 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 1.29 0.00 0.00 1.18 0.00 0.00 112 C 8.10 4.20 0.00 3.18 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 7.71 3.47 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 0.91 0.00 0.00 0.94 0.00 0.00 114 L 8.01 3.73 0.00 0.76 1.10 0.50 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.23 3.65 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 0.00 116 H 7.84 4.07 0.00 3.21 3.41 0.00 5.77 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.80 4.01 0.00 2.91 2.67 0.00 5.81 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 8.22 4.71 0.00 3.38 3.14 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 0.00 119 G 8.62 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 0.00 120 K 8.82 4.21 0.00 1.81 1.94 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.47 7.81 121 E 8.37 4.14 0.00 2.06 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 2.33 2.28 0.00 122 F 8.26 4.70 0.00 3.06 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 7.49 4.21 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 1.27 0.00 0.00 124 P 0.00 4.16 0.00 2.16 2.15 0.00 3.58 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 2.12 2.20 0.00 125 P 0.00 4.31 0.00 2.12 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 2.09 2.11 0.00 126 V 7.18 3.63 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.89 0.00 0.00 127 Q 7.75 3.57 0.00 1.79 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.49 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 128 A 7.89 3.97 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 0.00 129 A 7.68 3.90 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 8.12 3.87 0.00 3.37 3.29 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 0.00 131 Q 8.65 4.27 0.00 2.25 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.70 2.62 0.00 132 K 7.86 4.05 0.00 1.95 1.82 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.63 7.81 133 V 7.71 3.50 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 0.86 0.00 0.00 0.74 0.00 0.00 134 V 8.53 3.88 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 1.14 0.00 0.00 1.14 0.00 0.00 135 A 8.14 4.14 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 0.00 136 G 8.17 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 7.96 3.41 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 0.58 0.00 0.00 0.59 0.00 0.00 138 A 8.10 3.99 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 0.00 139 N 8.15 4.31 0.00 2.84 2.90 0.00 0.00 7.05 6.95 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 0.00 140 A 8.07 4.16 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 0.00 141 L 8.06 3.93 0.00 1.15 0.78 -0.05 0.31 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 0.00 142 A 7.62 4.69 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 8.10 4.28 0.00 3.32 3.67 0.00 5.55 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.05 4.35 0.00 1.73 1.82 0.00 1.67 0.00 0.00 1.58 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.86 1.65 7.81 145 Y 7.99 4.13 0.00 3.12 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 0.00 146 H 8.28 4.49 0.00 3.19 3.24 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