NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0238 8.0549 120.3896 62.6616 33.3444 175.8429 2 L 4.1478 7.6889 118.9646 52.3785 42.2918 176.1462 3 S 4.4589 10.0616 120.8783 57.1310 66.3232 173.2594 4 P 4.1937 0.0000 0.0000 65.8201 30.9485 178.8093 5 A 3.9725 7.9298 118.9417 55.0905 18.4031 179.0232 6 D 4.5672 8.3924 119.1415 56.9892 40.9732 179.3827 7 K 3.9886 7.9799 118.6620 59.6519 32.0068 179.5925 8 T 3.8319 7.8069 115.8666 66.6993 68.4205 176.4049 9 N 4.3051 8.3367 118.5804 56.3193 38.4855 177.5372 10 I 3.5218 7.9352 121.3545 64.2564 37.2130 178.5735 11 K 3.8866 7.9215 119.1642 59.5492 31.9021 179.3842 12 S 4.1050 8.1478 113.2163 61.7230 62.4671 176.3110 13 T 3.8902 7.9847 118.4197 66.5051 68.0944 176.5749 14 W 4.0671 8.5633 130.4236 60.3237 30.4545 177.5841 15 D 4.3456 8.1717 117.6474 56.9647 40.7253 177.7679 16 K 4.0876 7.8955 119.8906 59.3661 32.5113 178.6048 17 I 3.8230 7.8204 113.2621 61.1968 37.8060 177.8776 18 G 3.6358 8.2252 109.3666 46.4971 0.0000 176.0160 19 G 3.6875 8.5697 113.0060 46.8585 0.0000 173.9944 20 H 4.0162 7.9325 117.1979 56.8225 28.5656 176.9220 21 A 3.7638 7.2824 123.6752 55.1039 18.0132 179.6202 22 G 3.6345 7.9389 103.3376 48.2383 0.0000 175.2413 23 D 4.3676 7.8476 121.0970 57.3456 40.8382 178.4937 24 Y 4.4818 7.8806 117.2468 60.8845 37.7908 178.7663 25 G 3.7991 8.5581 107.2008 47.7638 0.0000 175.9451 26 G 3.6254 7.9225 108.1074 47.4597 0.0000 175.3731 27 E 3.9243 8.3928 121.8862 58.8870 29.6087 178.6796 28 A 3.9488 8.3802 121.2051 55.0339 18.3485 179.6050 29 L 3.3222 7.6928 117.3235 57.7238 41.6847 178.9972 30 D 4.4371 8.0210 117.8873 57.6759 41.0279 178.6295 31 R 3.8639 8.3427 118.6117 59.5393 29.7947 179.2331 32 T 4.0031 7.8057 115.5500 66.7449 68.4397 176.8095 33 F 4.5850 8.0261 120.0718 60.7147 38.6832 177.9022 34 Q 4.1105 8.1042 116.7531 59.1682 28.6673 178.5596 35 S 4.1087 8.0194 115.2324 59.7333 64.1314 174.6034 36 F 4.9645 8.0249 120.5951 53.8360 39.4493 173.3914 37 P 4.6645 0.0000 0.0000 64.8277 31.5077 177.8134 38 T 4.0595 8.1483 108.4907 64.7770 68.7221 176.4131 39 T 4.2796 8.3594 112.7974 64.6623 68.6498 176.5405 40 K 4.0437 8.3839 121.3568 59.1252 31.7789 178.8145 41 T 3.9704 7.7551 108.5110 63.9553 68.7880 175.4521 42 Y 4.0396 7.9446 118.1982 58.8686 39.2193 175.1871 43 F 4.6789 8.2275 119.2932 55.9064 39.5137 175.0399 44 P 4.3770 0.0000 0.0000 65.6113 31.8122 177.5130 45 H 4.5418 8.3510 112.9711 56.9176 29.1126 175.2242 46 F 4.6618 7.7475 119.8686 56.3961 39.6549 174.8802 47 D 4.4368 9.5401 125.6675 54.4925 41.0904 175.7726 48 L 4.6197 8.3562 125.6706 54.3754 42.1813 176.7110 49 S 4.4175 7.8832 114.4960 56.8661 63.7655 171.8155 50 P 4.1737 0.0000 0.0000 64.2799 31.3629 176.9350 51 G 3.8513 8.9045 109.6806 46.3475 0.0000 173.8517 52 S 4.0532 7.6778 114.3576 58.3655 63.2970 174.9811 53 A 3.9908 8.5699 130.8396 55.2322 18.2138 179.4772 54 Q 3.6100 7.8085 116.1567 58.9561 28.6755 179.0997 55 V 3.7474 7.5504 118.7725 65.7849 31.5051 177.8769 56 K 3.8885 7.9961 119.0507 59.5726 31.8802 178.5806 57 A 4.0038 8.1788 121.1043 55.5093 18.2951 179.1325 58 H 4.4225 8.7050 117.1284 59.3098 29.9612 177.5854 59 G 3.7107 8.6390 108.1114 47.8221 0.0000 175.7428 60 K 4.0322 7.9505 120.4191 59.2120 32.0917 179.6168 61 K 4.0285 7.7828 118.7315 59.3987 31.9967 179.5785 62 V 3.6063 7.9705 118.3274 65.9645 31.4051 177.8731 63 A 4.3129 8.2487 120.5094 55.5182 18.2778 179.3488 64 D 4.4237 8.5190 117.2476 57.4471 40.8856 178.9097 65 A 4.0914 8.2622 121.3447 55.2349 18.4060 179.7365 66 L 4.0079 8.1907 117.5562 58.1065 41.4297 179.8109 67 T 3.9187 8.2106 115.1422 66.9653 68.6080 176.3646 68 T 4.0748 8.1707 117.3449 66.6583 68.5061 176.4117 69 A 4.0839 8.1367 122.6045 55.3238 18.1928 179.7909 70 V 3.1968 7.6646 115.4252 65.8470 31.5848 177.5381 71 A 4.2095 7.5803 118.4473 53.4011 19.1516 176.7953 72 H 4.9959 8.2507 115.3816 54.9593 29.9196 175.6000 73 L 4.1069 8.1308 120.1876 57.5209 41.8408 178.3672 74 D 4.6362 7.9562 115.9608 55.0286 42.0917 176.2701 75 D 4.7760 7.9308 118.9775 52.1315 42.0346 175.5766 76 L 4.0400 7.8796 123.9019 57.4473 42.0290 177.4095 77 P 4.2949 0.0000 0.0000 65.4344 31.3348 178.6542 78 G 3.7350 8.2350 103.6914 47.9547 0.0000 175.8284 79 A 4.1554 7.8869 122.4257 53.5166 18.5100 178.1510 80 L 4.7444 7.9540 116.6652 54.5859 42.6695 178.6288 81 S 4.2538 8.2276 117.2847 61.1585 62.6431 176.1386 82 A 3.9859 7.9692 123.9908 54.7461 18.1114 179.4511 83 L 4.1388 7.9376 117.0404 57.6458 41.7553 179.4598 84 S 4.2919 8.3595 113.5124 61.3805 62.4983 175.4558 85 D 4.5145 8.1725 120.7909 57.4020 40.8963 178.1867 86 L 3.9416 7.9693 120.4942 58.7554 42.2437 178.6640 87 H 4.5359 8.7050 115.8808 57.9016 28.5021 177.3652 88 A 4.1688 8.3459 122.0026 54.2470 19.3699 178.0101 89 Y 4.1449 7.7832 113.1785 60.3915 38.6453 177.1471 90 K 4.3209 8.1273 116.9726 58.6734 32.9463 178.1523 91 L 4.0793 8.4654 117.4239 55.6421 42.2925 177.4263 92 R 3.7473 8.0174 116.0232 57.0767 27.4140 176.7791 93 V 3.9079 7.9188 116.4485 62.2572 32.7725 175.0342 94 D 4.5032 9.0332 127.4226 53.7602 41.6218 175.1657 95 P 4.4198 0.0000 0.0000 65.7430 32.0305 178.6702 96 V 3.6377 8.4652 118.6559 65.1590 30.9328 178.2829 97 N 4.2934 8.3503 116.8399 55.8682 38.1799 177.4283 98 F 3.8601 8.1469 119.4004 60.3192 38.9784 177.7925 99 K 3.9974 8.0731 117.7335 59.3289 31.9864 179.2852 100 L 3.6044 7.6091 118.7984 57.5563 41.4250 179.3130 101 L 3.9366 7.7837 121.6645 57.6293 42.0033 179.0675 102 S 3.7172 8.2357 115.4351 61.7405 62.7343 176.1339 103 H 4.2499 8.2990 120.7937 59.7046 29.6195 177.1716 104 C 4.1173 8.0844 117.9630 62.3075 27.8960 176.1307 105 L 3.9081 7.9993 121.2461 57.5946 41.0508 179.3329 106 L 4.2305 8.0280 118.9430 57.8808 41.5601 179.6835 107 V 3.3450 7.7719 118.0906 66.2753 30.9202 178.1473 108 T 3.6899 7.8618 115.3387 66.6315 68.1925 176.6625 109 L 3.7562 7.8716 120.5743 57.5686 41.4006 179.4273 110 A 3.3152 7.2002 119.9031 55.0940 18.2280 179.1973 111 C 4.0237 7.8314 114.3304 62.4626 28.1625 175.0902 112 H 4.6152 7.3288 115.1021 55.7274 31.2348 174.7785 113 H 4.9627 8.1500 117.3825 53.3032 29.0478 172.1717 114 P 4.3786 0.0000 0.0000 65.9759 32.0717 179.0261 115 T 4.0638 8.0209 114.7049 66.4997 68.5894 175.3690 116 E 4.1215 8.2217 119.5510 59.1500 30.2736 177.6322 117 F 4.4800 8.1063 122.2868 57.3736 37.9672 175.0376 118 T 4.2421 7.2437 115.1271 60.4628 71.5925 173.6203 119 P 4.1346 0.0000 0.0000 65.7837 31.3015 178.8566 120 A 3.9241 7.8110 118.9660 55.0409 18.3596 179.7380 121 V 3.4365 7.6007 116.6537 66.1687 31.6077 177.3905 122 H 3.5689 8.1360 118.2432 59.3192 29.6379 176.8582 123 A 3.9473 7.9300 122.0927 55.3727 18.2184 179.8524 124 S 4.2873 7.9634 114.9720 61.1657 62.7975 176.9602 125 L 3.8268 8.3484 122.2359 57.5965 41.3382 178.9909 126 D 4.4897 8.2081 118.1009 57.3896 41.1019 178.5289 127 K 4.0148 7.9848 118.5987 59.1712 32.0290 179.0139 128 F 4.2423 8.2752 121.1869 61.5902 39.2692 177.2918 129 F 4.2168 8.1056 117.3882 60.3918 38.6677 177.5909 130 A 3.9824 8.2952 120.3281 54.9903 18.1821 179.5364 131 A 3.8767 8.2146 119.5437 55.2766 18.5069 180.0059 132 V 3.4340 7.5858 116.6964 66.2181 31.6679 178.3624 133 S 3.7354 8.1471 114.9059 61.7819 62.4198 176.8271 134 T 3.7021 7.5582 117.2199 66.4570 68.4124 176.5487 135 V 3.6757 7.4383 119.5589 66.1355 31.4238 178.1870 136 L 4.1560 7.7202 117.0686 56.8893 41.5020 178.4349 137 T 4.2091 7.1492 107.1944 60.8001 69.6478 174.6055 138 S 4.5689 7.2413 117.9375 57.3278 64.3309 174.0621 139 K 4.4614 8.4931 123.7825 55.2727 32.1173 175.2369 140 Y 4.9656 8.1200 121.7372 56.3609 38.8700 176.0406 141 R 4.0351 7.8056 124.0696 57.4271 30.1024 176.4828 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 4.02 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 0.97 0.00 0.00 0.91 0.00 0.00 2 L 7.69 4.15 0.00 1.75 1.58 0.96 0.59 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 3 S 10.06 4.46 0.00 3.99 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 4 P 0.00 4.19 0.00 2.16 2.13 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 2.10 2.14 0.00 5 A 7.93 3.97 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 6 D 8.39 4.57 0.00 2.90 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 7 K 7.98 3.99 0.00 1.92 1.80 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.60 7.81 8 T 7.81 3.83 4.35 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 1.19 0.00 0.00 9 N 8.34 4.31 0.00 2.86 2.82 0.00 0.00 7.09 8.20 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 10 I 7.94 3.52 1.56 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.53 -0.10 0.00 0.00 11 K 7.92 3.89 0.00 1.77 1.84 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.45 7.81 12 S 8.15 4.11 0.00 3.92 3.90 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 13 T 7.98 3.89 4.38 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 1.35 0.00 0.00 14 W 8.56 4.07 0.00 3.51 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 15 D 8.17 4.35 0.00 2.89 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 16 K 7.90 4.09 0.00 1.90 1.95 0.00 1.75 0.00 0.00 1.77 0.00 0.00 3.19 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.59 1.47 7.81 17 I 7.82 3.82 1.84 0.00 0.00 -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 1.09 0.03 0.83 0.00 0.00 18 G 8.23 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 19 G 8.57 3.69 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 0.00 0.00 0.00 20 H 7.93 4.02 0.00 2.77 2.04 0.00 5.65 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 21 A 7.28 3.76 1.11 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 22 G 7.94 3.63 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 0.00 0.00 0.00 23 D 7.85 4.37 0.00 2.62 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 24 Y 7.88 4.48 0.00 3.06 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.56 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 0.00 0.00 0.00 0.00 26 G 7.92 3.63 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 0.00 0.00 0.00 27 E 8.39 3.92 0.00 2.12 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 0.00 2.28 2.33 0.00 28 A 8.38 3.95 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 29 L 7.69 3.32 0.00 1.78 1.29 0.98 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.02 4.44 0.00 2.90 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 8.34 3.86 0.00 1.92 1.90 0.00 3.10 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.79 0.00 32 T 7.81 4.00 3.87 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 0.00 0.00 0.00 1.19 0.00 0.00 33 F 8.03 4.59 0.00 3.03 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 34 Q 8.10 4.11 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.42 2.73 0.00 35 S 8.02 4.11 0.00 3.24 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 36 F 8.02 4.96 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 37 P 0.00 4.66 0.00 2.22 2.16 0.00 3.98 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 2.15 2.04 0.00 38 T 8.15 4.06 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 1.28 0.00 0.00 39 T 8.36 4.28 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 40 K 8.38 4.04 0.00 2.01 1.82 0.00 1.89 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.20 1.66 7.81 41 T 7.76 3.97 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 1.21 0.00 0.00 42 Y 7.94 4.04 0.00 3.07 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 43 F 8.23 4.68 0.00 2.68 2.38 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 44 P 0.00 4.38 0.00 2.19 2.17 0.00 3.88 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.91 0.00 45 H 8.35 4.54 0.00 3.42 3.52 0.00 5.54 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 7.75 4.66 0.00 3.09 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 47 D 9.54 4.44 0.00 2.54 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 48 L 8.36 4.62 0.00 1.54 1.46 0.49 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 49 S 7.88 4.42 0.00 3.98 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 50 P 0.00 4.17 0.00 2.06 2.04 0.00 3.74 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 2.03 2.10 0.00 51 G 8.90 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 7.68 4.05 0.00 4.02 3.78 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 53 A 8.57 3.99 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 54 Q 7.81 3.61 0.00 1.68 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.86 0.00 0.00 0.00 0.00 0.00 1.96 2.15 0.00 55 V 7.55 3.75 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 1.20 0.00 0.00 1.10 0.00 0.00 56 K 8.00 3.89 0.00 1.90 1.94 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.47 7.81 57 A 8.18 4.00 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 58 H 8.71 4.42 0.00 3.71 3.67 0.00 5.80 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 59 G 8.64 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 60 K 7.95 4.03 0.00 2.02 1.90 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.69 7.81 61 K 7.78 4.03 0.00 1.97 1.94 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.72 1.71 7.81 62 V 7.97 3.61 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 1.01 0.00 0.00 0.83 0.00 0.00 63 A 8.25 4.31 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 0.00 0.00 0.00 0.00 0.00 64 D 8.52 4.42 0.00 2.94 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 65 A 8.26 4.09 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 66 L 8.19 4.01 0.00 2.14 1.46 1.19 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.21 3.92 4.62 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 1.41 0.00 0.00 68 T 8.17 4.07 4.49 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 1.29 0.00 0.00 69 A 8.14 4.08 1.52 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 70 V 7.66 3.20 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 0.68 0.00 0.00 -0.04 0.00 0.00 71 A 7.58 4.21 1.23 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 0.00 0.00 72 H 8.25 5.00 0.00 3.24 3.24 0.00 5.82 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.13 4.11 0.00 1.60 1.73 0.76 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 74 D 7.96 4.64 0.00 2.66 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 75 D 7.93 4.78 0.00 2.72 2.51 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 76 L 7.88 4.04 0.00 1.70 1.70 0.95 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 77 P 0.00 4.29 0.00 1.87 1.51 0.00 3.56 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.90 0.00 78 G 8.23 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 7.89 4.16 1.22 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 80 L 7.95 4.74 0.00 1.83 1.70 0.93 0.72 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 81 S 8.23 4.25 0.00 4.04 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 0.00 82 A 7.97 3.99 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 83 L 7.94 4.14 0.00 1.94 1.86 1.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 84 S 8.36 4.29 0.00 4.17 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 85 D 8.17 4.51 0.00 2.72 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 86 L 7.97 3.94 0.00 1.84 1.83 0.90 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 87 H 8.71 4.54 0.00 3.63 3.58 0.00 5.85 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 88 A 8.35 4.17 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Y 7.78 4.14 0.00 3.25 3.02 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 90 K 8.13 4.32 0.00 1.93 1.86 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.50 7.81 91 L 8.47 4.08 0.00 1.66 1.78 0.74 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 92 R 8.02 3.75 0.00 1.96 1.97 0.00 3.20 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 93 V 7.92 3.91 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 0.27 0.00 0.00 0.81 0.00 0.00 94 D 9.03 4.50 0.00 2.88 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.42 0.00 2.21 2.06 0.00 3.69 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 96 V 8.47 3.64 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 0.88 0.00 0.00 0.89 0.00 0.00 97 N 8.35 4.29 0.00 2.67 2.65 0.00 0.00 7.02 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 98 F 8.15 3.86 0.00 3.22 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 99 K 8.07 4.00 0.00 1.93 1.82 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.70 7.81 100 L 7.61 3.60 0.00 1.62 1.13 0.66 -0.78 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 0.00 101 L 7.78 3.94 0.00 1.53 1.43 0.72 0.45 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 0.00 102 S 8.24 3.72 0.00 4.10 4.04 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 0.00 0.00 0.00 103 H 8.30 4.25 0.00 3.29 3.58 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 C 8.08 4.12 0.00 3.12 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 0.00 105 L 8.00 3.91 0.00 1.30 1.35 0.27 0.77 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 8.03 4.23 0.00 2.02 1.90 1.21 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.77 3.35 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 0.98 0.00 0.00 0.75 0.00 0.00 108 T 7.86 3.69 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 1.07 0.00 0.00 109 L 7.87 3.76 0.00 1.84 1.79 1.39 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 110 A 7.20 3.32 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 0.00 111 C 7.83 4.02 0.00 2.90 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 0.00 112 H 7.33 4.62 0.00 2.60 3.01 0.00 5.60 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 H 8.15 4.96 0.00 3.26 3.40 0.00 5.62 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.38 0.00 2.20 2.18 0.00 3.76 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 115 T 8.02 4.06 4.29 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 1.24 0.00 0.00 116 E 8.22 4.12 0.00 2.20 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 2.33 2.39 0.00 117 F 8.11 4.48 0.00 3.11 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 0.00 118 T 7.24 4.24 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 1.29 0.00 0.00 119 P 0.00 4.13 0.00 2.13 2.10 0.00 3.56 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 2.10 2.15 0.00 120 A 7.81 3.92 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 0.00 121 V 7.60 3.44 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 0.98 0.00 0.00 0.94 0.00 0.00 122 H 8.14 3.57 0.00 2.29 3.12 0.00 5.64 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 0.00 123 A 7.93 3.95 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 0.00 124 S 7.96 4.29 0.00 3.95 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 0.00 125 L 8.35 3.83 0.00 1.82 1.54 1.16 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.21 4.49 0.00 3.06 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 0.00 127 K 7.98 4.01 0.00 2.04 1.85 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.58 7.81 128 F 8.28 4.24 0.00 2.88 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.11 4.22 0.00 3.09 2.91 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 0.00 130 A 8.30 3.98 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 A 8.21 3.88 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 0.00 132 V 7.59 3.43 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 0.96 0.00 0.00 0.41 0.00 0.00 133 S 8.15 3.74 0.00 3.99 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 0.00 134 T 7.56 3.70 4.29 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 1.12 0.00 0.00 135 V 7.44 3.68 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 1.12 0.00 0.00 0.86 0.00 0.00 136 L 7.72 4.16 0.00 1.27 1.71 0.98 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 137 T 7.15 4.21 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 0.62 0.00 0.00 138 S 7.24 4.57 0.00 4.11 3.93 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 0.00 139 K 8.49 4.46 0.00 1.63 1.62 0.00 1.40 0.00 0.00 1.04 0.00 0.00 2.32 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.55 1.10 7.81 140 Y 8.12 4.97 0.00 3.03 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 0.00 141 R 7.81 4.04 0.00 1.88 1.84 0.00 2.75 0.00 0.00 2.97 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.24 0.00