NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2417 8.3044 120.3452 55.5638 33.1975 174.6691 2 H 4.3704 8.7598 126.6800 54.7303 29.3678 172.4720 3 L 4.7959 7.6564 126.5816 52.2595 45.9450 177.1667 4 T 4.0965 8.4362 113.0107 60.8513 70.8952 174.0715 5 P 4.2135 0.0000 0.0000 65.6255 31.3584 178.9429 6 E 3.9287 8.0303 117.1188 59.4262 29.4765 179.0281 7 E 3.9262 7.8738 118.6977 59.2915 29.4374 179.4791 8 K 3.8489 8.0939 118.5471 59.6879 32.0449 179.6012 9 S 4.0906 8.0975 115.1275 61.3612 62.7080 176.6028 10 A 3.9831 7.8920 123.3361 55.0136 18.1651 179.8523 11 V 3.3567 7.6849 116.6648 66.4109 31.7382 178.2593 12 T 3.9057 8.1409 115.4285 66.6197 68.1233 176.3005 13 A 4.0196 7.9599 121.1651 55.3119 18.6918 179.1671 14 L 3.8773 7.8931 118.3063 57.9250 42.0614 178.7814 15 W 4.4110 8.5343 128.5034 60.5689 30.4057 178.0414 16 G 3.7404 8.1058 104.3594 47.0903 0.0000 174.6841 17 K 4.3796 7.8670 118.4196 55.6993 33.0333 176.8768 18 V 3.6130 7.1286 120.3285 62.1678 32.1125 175.6120 19 N 4.5605 8.2471 124.9957 52.1194 39.2890 175.5597 20 V 3.4829 8.1244 128.4713 66.1370 31.7967 177.3409 21 D 4.3370 8.0722 117.9603 57.2819 40.8197 178.2326 22 E 3.8421 8.4307 119.6141 59.4446 29.6683 179.0262 23 V 3.5769 8.0019 118.6456 65.6420 31.4648 178.1731 24 G 3.7064 8.2990 105.7884 47.8175 0.0000 175.8778 25 G 3.6486 7.9319 108.5702 47.3002 0.0000 175.6022 26 E 3.9203 8.1147 120.6163 59.0985 29.4926 179.3383 27 A 3.9565 8.1347 120.9377 55.1127 18.4857 179.5099 28 L 4.0030 8.0534 119.0693 58.0502 42.2065 179.2626 29 G 3.6203 8.2363 105.8262 48.0843 0.0000 175.9107 30 R 3.9591 8.3980 121.2671 58.5100 29.9037 178.8884 31 L 4.1194 8.1801 120.3949 58.4066 41.6991 179.1942 32 L 4.1454 7.9169 120.0473 56.9162 41.2265 179.7539 33 V 3.6368 7.4993 117.5729 65.8608 31.7179 178.0372 34 V 3.6286 7.8650 116.9850 64.4166 32.8135 175.5877 35 Y 4.7993 7.9228 116.9480 54.5505 37.9214 174.0500 36 P 4.5820 0.0000 0.0000 64.5395 31.7605 177.5317 37 A 4.0063 8.2004 119.4959 55.1144 18.2493 179.2339 38 T 4.1915 8.2157 107.9058 64.4080 68.7653 176.3833 39 Q 4.4659 8.4197 121.5714 58.0475 28.4522 178.0072 40 R 3.6652 7.6599 117.0528 59.0379 29.1109 177.9269 41 F 4.2297 7.0382 114.7473 57.5681 39.3861 176.2345 42 F 4.5043 7.4819 117.6135 56.9052 39.3094 177.3434 43 E 4.0306 8.3017 123.1407 59.2648 29.2705 178.2247 44 S 4.5220 7.9999 110.8681 59.2418 63.5967 174.7875 45 F 4.6225 8.3528 119.8583 58.8280 39.8314 176.0064 46 G 4.0137 8.1006 106.0183 44.3891 0.0000 174.8705 47 D 4.6018 8.5854 126.6513 53.8387 41.0441 175.5962 48 L 4.9311 8.3114 126.9934 54.4252 43.0637 178.1627 49 S 4.2652 8.5292 117.0244 61.0134 63.1549 174.2574 50 T 4.7193 7.4387 109.7103 58.2963 73.0255 172.6648 51 P 4.2195 0.0000 0.0000 65.9159 31.2584 178.6762 52 D 4.3182 8.0668 116.8355 57.3464 40.5869 178.5676 53 A 4.0034 7.7498 120.1668 54.9763 18.5147 179.6682 54 V 3.6979 8.1348 117.0569 66.6229 31.5104 178.3407 55 M 4.1899 8.2884 117.3116 57.6133 31.8484 178.0233 56 G 4.0230 7.7276 103.3121 43.5237 0.0000 173.2589 57 N 4.4728 7.6260 122.0003 52.5453 39.4221 173.9026 58 P 4.2765 0.0000 0.0000 65.8381 31.2747 178.6841 59 K 3.6133 8.3384 118.6215 58.7944 31.7886 179.4162 60 V 3.7331 7.7859 118.0514 66.0305 31.5873 177.9190 61 K 3.8803 8.0423 117.8857 59.5728 31.9981 179.1659 62 A 3.9861 8.0363 120.8808 55.4158 18.1817 179.2124 63 H 4.3734 8.4939 117.0112 59.3229 29.8923 177.7515 64 G 3.6070 8.6149 108.1014 47.6254 0.0000 175.8067 65 K 3.9968 8.1225 120.8220 59.0668 32.0759 179.2522 66 K 3.9355 7.8918 119.3151 59.5155 32.1601 178.9773 67 V 3.6202 7.9911 118.6172 66.2370 31.5682 178.1062 68 L 4.4027 8.4832 119.0074 57.4003 41.3439 179.7413 69 G 3.7524 8.5596 106.2141 47.7561 0.0000 175.6643 70 A 4.0843 8.0456 122.9907 54.7604 18.2149 179.3706 71 F 4.1012 8.2044 118.1435 61.5838 39.8086 176.8277 72 S 4.1713 8.9092 113.0392 61.7885 62.3600 176.0217 73 D 4.5108 8.4562 121.5740 57.1317 40.5176 178.9870 74 G 3.5878 7.9797 106.3871 47.4007 0.0000 175.5128 75 L 3.8150 7.1158 119.1058 56.5540 41.5948 178.4442 76 A 4.1792 7.4405 119.2324 53.1092 19.1778 177.0631 77 H 4.9066 7.7683 115.5410 54.8733 29.7118 176.0365 78 L 4.1124 8.1282 121.0881 57.9233 41.6439 178.5928 79 D 4.5838 7.9057 116.0376 55.8266 41.9307 175.9879 80 N 5.0167 8.4667 118.5423 51.4874 39.4716 175.1304 81 L 4.1169 7.8481 122.3485 57.8347 42.2025 179.3616 82 K 4.0757 8.1294 118.1934 59.4279 31.8074 179.3942 83 G 3.5910 8.0365 104.0836 48.2399 0.0000 175.3947 84 T 3.7675 7.6496 117.2186 65.3145 68.6363 175.7714 85 F 4.7221 8.0609 116.8732 56.8688 39.5163 177.2213 86 A 4.0879 7.7206 122.7320 55.9060 18.1887 180.2153 87 T 3.8834 7.8539 113.4339 66.7958 68.5528 176.9265 88 L 4.1371 7.9608 120.4901 57.4735 41.7495 179.2759 89 S 4.4006 8.4285 115.0991 60.9653 62.4141 175.9433 90 E 3.8809 8.1972 121.1871 59.3384 29.1954 179.0721 91 L 3.8941 8.0188 120.1254 58.7392 42.1279 178.8601 92 H 4.1553 8.5010 116.0293 58.7450 28.0878 177.3359 93 C 3.4488 7.6381 120.4728 62.3004 31.1866 175.4206 94 D 4.1249 8.2665 119.8539 56.3641 40.5209 177.3974 95 K 4.3260 7.8904 117.0493 57.3640 34.0130 177.4743 96 L 4.0724 7.7334 116.9145 55.2938 42.3792 176.1745 97 H 4.0382 7.1055 114.1422 56.6815 26.4568 175.3283 98 V 4.0791 7.9296 118.3674 60.8810 32.6282 174.7420 99 D 4.3311 8.7695 127.3204 53.8235 41.5522 175.1138 100 P 3.0896 0.0000 0.0000 64.4335 31.8851 177.9049 101 E 3.8200 8.0752 119.2198 59.3180 29.2221 178.4705 102 N 4.2791 7.9041 116.4285 56.0913 38.4486 177.3281 103 F 4.4594 7.3319 119.4203 60.5650 38.9175 177.9409 104 R 3.9507 7.8706 117.3260 59.0930 29.9024 178.7955 105 L 3.7617 7.6024 118.2964 57.6761 41.6163 179.3438 106 L 4.0745 8.2779 120.5879 58.1043 42.0378 179.0749 107 G 3.7295 8.2783 105.7035 48.1417 0.0000 175.4057 108 N 4.4715 8.2448 118.9418 55.9183 38.5578 177.8093 109 V 3.6657 8.2099 120.0853 65.6558 31.5526 177.7509 110 L 3.8670 8.4997 120.5361 58.2263 41.9334 179.1008 111 V 3.5464 7.7516 118.0006 66.2923 31.4267 177.6854 112 C 4.0984 8.0507 116.3430 62.7717 27.8763 176.3013 113 V 3.5319 7.8487 119.7606 66.0040 31.0988 178.0896 114 L 3.8458 7.8535 118.5492 57.5257 41.3557 179.3493 115 A 3.6611 7.3929 120.6467 55.2937 18.1064 179.1490 116 H 4.1044 7.9889 115.5004 59.7545 29.9960 176.9510 117 H 3.8708 8.2562 117.2609 58.2816 28.8861 177.0597 118 F 4.6336 8.6522 118.3213 56.1934 39.7356 177.3772 119 G 3.8172 8.8104 108.3903 45.9908 0.0000 177.6280 120 K 3.9978 8.9515 122.8894 59.4305 32.2554 177.8715 121 E 4.1507 8.1515 118.1190 58.3001 29.7812 177.4485 122 F 4.5031 8.0269 123.5426 56.9882 37.8982 175.3804 123 T 4.2238 7.3273 116.0238 59.9171 71.3916 173.5776 124 P 4.1547 0.0000 0.0000 65.6012 31.3518 177.2353 125 P 4.1972 0.0000 0.0000 65.3299 31.2882 178.9310 126 V 3.5068 7.3690 117.2148 65.8039 31.4359 177.7155 127 Q 3.5862 8.0239 119.3336 59.1512 28.9312 178.0829 128 A 4.0107 8.0890 121.4837 55.2975 18.4411 179.4558 129 A 3.8873 7.9335 118.8894 55.6558 18.4477 179.5654 130 Y 3.8767 8.2480 115.2031 61.0484 37.8907 178.6385 131 Q 4.1280 8.7843 119.6210 58.9537 28.7900 179.0529 132 K 3.9422 7.9973 119.2515 59.3883 32.0235 179.5206 133 V 3.4934 7.6080 118.1605 66.2494 31.4922 178.5617 134 V 3.7733 8.4048 112.2863 64.3189 31.2564 178.5178 135 A 4.1386 8.2153 120.9347 54.8169 18.1170 179.7975 136 G 3.5473 8.4299 104.7607 48.0591 0.0000 176.0693 137 V 3.2641 7.9560 121.1685 65.3126 31.6383 177.8781 138 A 3.9092 7.9799 120.4736 55.1996 18.0916 179.3559 139 N 4.2599 8.3887 114.8794 56.4967 38.4409 177.4643 140 A 4.0202 7.9371 121.0433 55.2599 18.7031 179.4124 141 L 3.9736 8.0280 116.9448 56.8678 41.7537 178.5857 142 A 4.4414 7.7697 119.1976 52.8356 18.8861 178.3558 143 H 4.1115 7.8574 117.3384 59.0507 29.9261 175.9845 144 K 4.4309 8.3105 115.6246 56.2662 32.0952 176.4585 145 Y 4.1795 7.9471 117.5029 58.5483 38.3920 175.8105 146 H 4.4415 8.3600 117.3874 56.2289 28.1968 173.3580 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 4.24 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.53 0.00 2 H 8.76 4.37 0.00 3.21 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.66 4.80 0.00 1.51 1.40 0.80 0.92 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 4 T 8.44 4.10 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 1.19 0.00 0.00 5 P 0.00 4.21 0.00 2.15 2.12 0.00 3.57 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 2.10 2.16 0.00 6 E 8.03 3.93 0.00 2.02 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 2.38 2.44 0.00 7 E 7.87 3.93 0.00 2.03 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 0.00 2.28 2.30 0.00 8 K 8.09 3.85 0.00 1.89 1.80 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.39 7.81 9 S 8.10 4.09 0.00 4.01 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 10 A 7.89 3.98 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 11 V 7.68 3.36 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 0.65 0.00 0.00 0.47 0.00 0.00 12 T 8.14 3.91 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 7.96 4.02 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 14 L 7.89 3.88 0.00 2.04 1.82 0.67 -0.42 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 15 W 8.53 4.41 0.00 3.84 3.31 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 16 G 8.11 3.74 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 0.00 0.00 0.00 17 K 7.87 4.38 0.00 2.03 2.12 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.61 7.81 18 V 7.13 3.61 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 -0.11 0.00 0.00 0.73 0.00 0.00 19 N 8.25 4.56 0.00 2.72 2.62 0.00 0.00 6.82 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 8.12 3.48 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 1.19 0.00 0.00 0.94 0.00 0.00 21 D 8.07 4.34 0.00 2.84 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 8.43 3.84 0.00 2.01 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 2.27 2.29 0.00 23 V 8.00 3.58 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 0.92 0.00 0.00 0.63 0.00 0.00 24 G 8.30 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 7.93 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.11 3.92 0.00 2.27 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 2.48 0.00 27 A 8.13 3.96 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 L 8.05 4.00 0.00 1.79 1.65 0.93 1.08 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 29 G 8.24 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 30 R 8.40 3.96 0.00 1.94 1.98 0.00 3.10 0.00 0.00 3.04 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 31 L 8.18 4.12 0.00 1.91 1.93 1.07 0.65 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 32 L 7.92 4.15 0.00 2.09 1.73 1.03 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.50 3.64 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.98 0.00 0.00 34 V 7.86 3.63 1.81 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 0.07 0.00 0.00 0.84 0.00 0.00 35 Y 7.92 4.80 0.00 3.17 2.82 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 36 P 0.00 4.58 0.00 2.17 2.13 0.00 3.92 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 2.12 2.02 0.00 37 A 8.20 4.01 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.22 4.19 4.53 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 1.37 0.00 0.00 39 Q 8.42 4.47 0.00 2.23 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.75 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 40 R 7.66 3.67 0.00 1.61 1.93 0.00 2.87 0.00 0.00 2.60 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 7.04 4.23 0.00 1.56 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 0.00 0.00 0.00 0.00 42 F 7.48 4.50 0.00 2.87 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.30 4.03 0.00 1.94 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 2.29 2.23 0.00 44 S 8.00 4.52 0.00 4.10 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 8.35 4.62 0.00 3.17 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 46 G 8.10 4.01 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 0.00 0.00 0.00 47 D 8.59 4.60 0.00 2.66 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 8.31 4.93 0.00 1.67 1.64 1.01 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.53 4.27 0.00 4.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.44 4.72 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 4.22 0.00 2.16 2.12 0.00 3.59 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 2.10 2.17 0.00 52 D 8.07 4.32 0.00 2.68 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 7.75 4.00 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 54 V 8.13 3.70 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 1.09 0.00 0.00 1.00 0.00 0.00 55 M 8.29 4.19 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.93 0.00 56 G 7.73 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.63 4.47 0.00 2.95 2.85 0.00 0.00 6.85 7.72 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 58 P 0.00 4.28 0.00 2.24 2.26 0.00 3.72 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.34 3.61 0.00 1.62 0.74 0.00 1.45 0.00 0.00 1.43 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.16 1.16 7.81 60 V 7.79 3.73 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.11 0.00 0.00 61 K 8.04 3.88 0.00 1.97 1.83 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.67 7.81 62 A 8.04 3.99 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 63 H 8.49 4.37 0.00 3.61 3.50 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 8.61 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 65 K 8.12 4.00 0.00 2.01 1.97 0.00 1.68 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.71 7.81 66 K 7.89 3.94 0.00 2.04 1.99 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.51 7.81 67 V 7.99 3.62 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 1.03 0.00 0.00 0.91 0.00 0.00 68 L 8.48 4.40 0.00 2.01 1.87 1.21 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.56 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 8.05 4.08 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.20 4.10 0.00 3.12 3.37 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 72 S 8.91 4.17 0.00 4.60 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 0.00 73 D 8.46 4.51 0.00 2.71 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 74 G 7.98 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.12 3.82 0.00 1.38 1.43 0.23 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.44 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.77 4.91 0.00 3.12 3.15 0.00 5.83 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.13 4.11 0.00 1.53 1.66 0.73 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.91 4.58 0.00 2.64 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 80 N 8.47 5.02 0.00 2.65 2.60 0.00 0.00 7.06 6.53 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 7.85 4.12 0.00 1.77 1.86 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.13 4.08 0.00 1.74 1.73 0.00 1.23 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.46 7.81 83 G 8.04 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.65 3.77 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 0.46 0.00 0.00 85 F 8.06 4.72 0.00 3.16 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 7.72 4.09 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 4.25 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 1.22 0.00 0.00 88 L 7.96 4.14 0.00 2.01 1.86 1.12 0.94 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 8.43 4.40 0.00 4.17 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 90 E 8.20 3.88 0.00 2.24 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 2.33 2.53 0.00 91 L 8.02 3.89 0.00 1.77 1.85 0.90 0.96 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 92 H 8.50 4.16 0.00 3.71 3.76 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 7.64 3.45 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 8.27 4.12 0.00 2.68 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 95 K 7.89 4.33 0.00 1.77 1.78 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.49 7.81 96 L 7.73 4.07 0.00 1.71 1.62 0.70 1.03 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 97 H 7.11 4.04 0.00 3.30 3.41 0.00 5.64 0.00 0.00 0.00 0.00 8.22 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 4.08 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 0.22 0.00 0.00 0.40 0.00 0.00 99 D 8.77 4.33 0.00 2.74 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 0.00 100 P 0.00 3.09 0.00 1.90 1.76 0.00 3.36 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.44 0.00 101 E 8.08 3.82 0.00 2.08 1.81 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 2.22 2.29 0.00 102 N 7.90 4.28 0.00 2.51 2.75 0.00 0.00 6.95 7.50 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 0.00 103 F 7.33 4.46 0.00 3.07 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 7.87 3.95 0.00 1.96 1.94 0.00 3.08 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 105 L 7.60 3.76 0.00 1.72 1.34 0.64 -0.30 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 0.00 106 L 8.28 4.07 0.00 1.81 1.88 0.95 1.50 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 0.00 107 G 8.28 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 0.00 108 N 8.24 4.47 0.00 2.82 2.95 0.00 0.00 6.69 7.78 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 0.00 109 V 8.21 3.67 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 1.07 0.00 0.00 1.23 0.00 0.00 110 L 8.50 3.87 0.00 1.71 1.84 0.88 0.25 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 0.00 111 V 7.75 3.55 2.31 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 1.32 0.00 0.00 1.18 0.00 0.00 112 C 8.05 4.10 0.00 3.20 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 0.00 113 V 7.85 3.53 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 1.05 0.00 0.00 0.95 0.00 0.00 114 L 7.85 3.85 0.00 1.09 1.11 0.67 0.87 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 7.39 3.66 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 7.99 4.10 0.00 3.19 3.46 0.00 5.78 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 0.00 117 H 8.26 3.87 0.00 2.96 2.28 0.00 5.89 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 8.65 4.63 0.00 3.25 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 0.00 119 G 8.81 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 0.00 120 K 8.95 4.00 0.00 1.92 2.02 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.53 7.81 121 E 8.15 4.15 0.00 2.17 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 0.00 2.44 2.55 0.00 122 F 8.03 4.50 0.00 3.07 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.33 4.22 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 1.27 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.15 0.00 3.57 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 2.11 2.19 0.00 125 P 0.00 4.20 0.00 2.11 2.06 0.00 3.47 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 7.37 3.51 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 0.93 0.00 0.00 0.88 0.00 0.00 127 Q 8.02 3.59 0.00 1.78 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 128 A 8.09 4.01 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 0.00 129 A 7.93 3.89 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 0.00 130 Y 8.25 3.88 0.00 3.48 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 8.78 4.13 0.00 2.23 2.21 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 2.73 2.62 0.00 132 K 8.00 3.94 0.00 1.96 1.83 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.61 7.81 133 V 7.61 3.49 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 0.91 0.00 0.00 0.75 0.00 0.00 134 V 8.40 3.77 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.17 0.00 0.00 135 A 8.22 4.14 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 8.43 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 0.00 137 V 7.96 3.26 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 0.62 0.00 0.00 0.72 0.00 0.00 138 A 7.98 3.91 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 0.00 139 N 8.39 4.26 0.00 2.95 2.87 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 0.00 140 A 7.94 4.02 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 0.00 141 L 8.03 3.97 0.00 0.99 0.81 -0.02 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.77 4.44 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 7.86 4.11 0.00 3.25 3.64 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.31 4.43 0.00 1.84 1.83 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.14 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.51 1.79 7.81 145 Y 7.95 4.18 0.00 3.09 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 0.00 146 H 8.36 4.44 0.00 3.21 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