NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3101 0.0000 0.0000 62.3786 32.0512 176.9836 3 K 3.9380 8.5793 116.2979 55.6013 31.2063 174.5939 4 K 3.8552 8.7505 125.7441 57.0945 33.6473 174.6680 5 V 5.0566 8.3758 125.4324 61.1309 34.5155 174.3175 6 L 4.7980 9.1740 127.1437 53.1595 45.3462 175.9269 7 T 4.5956 8.5754 113.5686 60.3092 68.9788 173.2062 8 G 4.2918 8.4513 116.2917 44.8049 0.0000 169.0222 9 V 4.7428 8.2941 112.2858 58.9397 34.9063 176.0044 10 V 4.1654 8.3812 125.3743 63.3967 31.9327 176.3426 11 V 4.2620 8.3737 126.5999 61.3804 32.8640 175.8233 12 S 4.5170 7.5367 116.0541 57.2406 65.6243 174.2741 13 D 5.1750 8.6286 129.0292 53.3611 39.6846 176.0273 14 K 4.4414 8.3054 116.1172 57.5125 32.3134 175.9316 15 M 4.7224 7.6283 117.9698 53.2361 34.8465 175.1215 16 Q 4.1673 8.4370 118.7448 56.0203 29.0050 176.5459 17 K 4.1845 8.9192 120.7453 57.1916 30.0227 174.7010 18 T 5.2667 7.5134 113.1775 61.9483 72.0908 174.0328 19 V 4.6571 8.3968 117.1748 60.1245 36.2467 174.8427 20 T 4.7703 8.9859 122.5586 63.3198 70.1489 174.0532 21 V 4.8024 8.8048 124.5393 61.2703 35.1974 173.8519 22 L 4.9609 8.8730 130.0790 54.3149 44.1810 175.9178 23 V 4.5358 8.2381 117.2867 59.9126 35.4514 174.1228 24 E 4.7823 8.8858 126.2375 55.2240 30.6086 176.1442 25 R 4.7908 9.0588 121.6468 54.3568 32.0459 174.7034 26 Q 5.0902 8.6349 121.9198 54.9040 31.1255 174.5486 27 F 4.8663 8.1263 113.4762 55.3907 41.6265 171.4332 28 P 4.7262 0.0000 0.0000 62.6959 32.0661 175.9270 29 H 4.2805 8.9501 124.8207 55.5934 30.2486 174.4254 30 P 4.3325 0.0000 0.0000 65.0949 31.1301 176.6352 31 L 4.3838 8.1918 117.6513 55.4979 44.2351 176.1283 32 Y 4.5442 7.9183 113.3105 56.8191 38.6429 176.3017 33 G 4.0962 8.2530 107.2666 45.9367 0.0000 173.6587 34 K 4.0907 7.6821 120.6899 55.8351 33.4634 177.1155 35 V 4.7381 8.2252 127.1419 62.7873 29.2578 175.2821 36 I 4.0555 8.0602 118.6250 59.8310 39.7412 175.3920 37 K 4.9587 8.3394 123.7321 55.0282 34.7503 175.0718 38 R 4.9854 8.5038 125.8190 55.0763 34.9062 173.5247 39 S 5.1754 8.2483 112.7370 59.4921 65.4254 173.2648 40 K 4.5781 8.4805 118.2127 55.7639 35.3233 174.1630 41 K 4.9108 8.5241 123.9160 55.2649 33.7817 175.5287 42 Y 4.6058 8.9870 121.3749 56.0790 41.9390 174.5901 43 L 5.0157 8.6085 122.0621 53.3844 43.3820 176.0602 44 A 4.8536 9.1286 126.6797 50.9350 22.1541 175.1103 45 H 4.8316 8.5537 119.3545 54.9441 31.6911 172.6958 46 D 5.2365 8.8495 127.9006 51.1137 40.7878 174.3791 47 P 4.3157 0.0000 0.0000 64.3969 32.0770 177.9120 48 E 4.2212 8.1889 118.1795 55.9990 30.2361 177.3568 49 E 3.9176 8.4004 115.8743 56.4990 27.7964 175.5046 50 K 3.9577 7.5114 118.6096 59.4626 32.7536 177.0456 51 Y 4.2410 8.1645 118.4614 57.1320 38.2061 175.2286 52 K 4.5743 8.4255 125.0873 54.7409 35.4710 175.5600 53 L 3.9672 8.2118 119.7040 56.5141 42.3792 178.4806 54 G 3.9073 8.8492 111.7967 45.8933 0.0000 173.5086 55 D 4.6763 7.6832 120.5613 53.7452 41.7313 176.0330 56 V 4.0530 8.2566 125.5552 63.4427 32.6724 175.4834 57 V 5.2553 8.6902 120.3239 58.9378 36.6095 173.8070 58 E 5.1079 8.5286 119.1802 54.9883 32.8418 175.6169 59 I 4.9787 8.7041 122.7705 59.5495 41.3900 174.1441 60 I 4.9995 8.4950 126.0945 58.6392 41.0378 173.6882 61 E 2.8287 9.2328 130.4116 57.0465 29.9076 175.7099 62 S 4.7409 7.6819 122.5851 56.0804 67.1961 173.9502 63 R 3.8157 8.4682 120.3067 55.8707 30.1539 174.1916 64 P 4.3027 0.0000 0.0000 63.5623 31.4786 175.9462 65 I 4.0148 8.4368 125.2898 62.8945 37.7231 176.2784 66 S 4.6714 7.3527 111.6066 56.0643 65.4615 172.2014 67 K 3.3072 8.1825 117.2467 60.4690 32.4561 177.2146 68 R 4.2798 7.6993 122.6925 54.1100 29.7012 178.2847 69 K 4.4375 7.3010 120.3800 56.2828 33.9416 174.9848 70 R 5.0434 8.6217 128.7994 55.6347 31.6009 174.8336 71 F 5.2565 8.4061 115.1201 56.1576 44.1198 174.1291 72 R 4.8528 8.5793 118.8688 54.2306 34.5310 175.3014 73 V 3.6988 7.8115 121.0994 63.2420 32.1298 173.9636 74 L 4.7882 8.1274 122.5210 54.8782 43.3218 175.8797 75 R 4.8924 7.3211 112.1634 54.9450 32.7885 173.3085 76 L 4.6068 8.7811 122.4303 55.5152 42.4258 176.3140 77 V 4.4229 8.5786 124.0427 63.8373 33.8247 175.7267 78 E 4.4736 7.5580 113.9398 56.0167 31.3938 176.5354 79 S 4.3525 9.2903 118.4569 60.5744 63.2105 174.0040 80 G 3.7480 7.7350 116.7842 46.3933 0.0000 173.8614 81 R 4.7395 8.1656 127.0001 54.3503 31.7793 177.7217 82 M 4.1494 8.4263 120.9856 58.2859 31.3455 177.5548 83 D 4.4144 8.1684 119.1672 56.6521 39.1927 178.7543 84 L 4.0220 7.8207 119.8786 57.4694 41.5938 179.2956 85 V 3.6207 7.8549 117.7309 66.2109 31.1613 177.5200 86 E 3.9676 8.2188 118.0088 59.6067 29.2747 179.1994 87 K 3.7168 7.7262 117.1649 59.9966 32.1447 178.5707 88 Y 4.0293 7.8813 119.3548 60.6432 38.7608 177.5861 89 L 3.9276 8.4858 120.2413 58.1669 41.8449 179.6909 90 I 3.6086 8.5049 120.4931 64.3057 36.7495 178.4381 91 R 3.5577 7.3029 118.7052 59.2520 30.2883 178.3834 92 R 4.0935 7.4279 117.7009 59.5503 30.1064 178.5297 93 Q 3.9514 8.0752 117.6720 59.6265 28.8987 179.2399 94 N 4.2848 8.0839 116.8584 56.5366 38.4487 177.0192 95 Y 4.4006 7.4696 117.8492 61.3715 37.8005 178.4604 96 Q 4.1220 8.0800 119.0803 58.5692 29.0175 177.6141 97 S 4.6763 7.5611 112.9281 58.2440 63.4716 174.4659 98 L 4.5548 8.0869 123.5287 55.6807 43.2890 177.2623 99 S 4.5938 7.7299 113.0812 57.3928 65.1559 174.2201 100 K 4.1790 8.4241 119.2716 57.2163 32.6511 175.8549 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 2 P 0.00 4.31 0.00 2.19 2.08 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.99 0.00 3 K 8.58 3.94 0.00 1.73 1.82 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.47 7.81 4 K 8.75 3.86 0.00 1.92 1.90 0.00 1.56 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.60 1.59 7.81 5 V 8.38 5.06 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 0.93 0.00 0.00 0.99 0.00 0.00 6 L 9.17 4.80 0.00 1.24 1.27 0.19 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.58 4.60 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 1.18 0.00 0.00 8 G 8.45 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 0.00 0.00 0.00 9 V 8.29 4.74 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 0.71 0.00 0.00 0.95 0.00 0.00 10 V 8.38 4.17 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 1.06 0.00 0.00 1.00 0.00 0.00 11 V 8.37 4.26 1.79 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 0.30 0.00 0.00 0.02 0.00 0.00 12 S 7.54 4.52 0.00 3.80 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 13 D 8.63 5.17 0.00 2.78 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 14 K 8.31 4.44 0.00 1.76 1.87 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.52 7.81 15 M 7.63 4.72 0.00 1.98 2.11 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 2.50 2.52 0.00 16 Q 8.44 4.17 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.29 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 17 K 8.92 4.18 0.00 1.98 1.81 0.00 1.62 0.00 0.00 1.84 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.45 7.81 18 T 7.51 5.27 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 1.27 0.00 0.00 19 V 8.40 4.66 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 0.73 0.00 0.00 0.91 0.00 0.00 20 T 8.99 4.77 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 1.22 0.00 0.00 21 V 8.80 4.80 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 0.91 0.00 0.00 0.86 0.00 0.00 22 L 8.87 4.96 0.00 1.75 1.47 1.07 0.98 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 23 V 8.24 4.54 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 0.50 0.00 0.00 0.90 0.00 0.00 24 E 8.89 4.78 0.00 1.87 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 2.31 2.33 0.00 25 R 9.06 4.79 0.00 1.93 2.05 0.00 2.83 0.00 0.00 3.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 26 Q 8.63 5.09 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.85 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 27 F 8.13 4.87 0.00 3.16 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 28 P 0.00 4.73 0.00 2.06 2.08 0.00 3.91 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 2.10 2.14 0.00 29 H 8.95 4.28 0.00 3.25 3.25 0.00 5.61 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.33 0.00 2.18 2.21 0.00 3.45 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 1.73 1.94 0.00 31 L 8.19 4.38 0.00 1.31 1.16 0.71 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.92 4.54 0.00 2.90 2.80 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 33 G 8.25 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 0.00 0.00 0.00 34 K 7.68 4.09 0.00 1.87 1.69 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.37 7.81 35 V 8.23 4.74 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 0.84 0.00 0.00 0.93 0.00 0.00 36 I 8.06 4.06 1.70 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 -0.15 0.86 0.00 0.00 37 K 8.34 4.96 0.00 1.71 1.67 0.00 1.72 0.00 0.00 1.91 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.32 1.45 7.81 38 R 8.50 4.99 0.00 1.90 1.89 0.00 3.26 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 39 S 8.25 5.18 0.00 4.00 3.89 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 0.00 0.00 0.00 0.00 40 K 8.48 4.58 0.00 1.88 1.84 0.00 0.63 0.00 0.00 1.36 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.15 1.34 7.81 41 K 8.52 4.91 0.00 1.66 1.71 0.00 1.78 0.00 0.00 2.02 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.54 7.81 42 Y 8.99 4.61 0.00 2.66 2.54 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 43 L 8.61 5.02 0.00 1.66 1.65 0.91 0.84 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 44 A 9.13 4.85 1.21 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 0.00 0.00 0.00 45 H 8.55 4.83 0.00 3.27 3.24 0.00 5.72 0.00 0.00 0.00 0.00 6.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.85 5.24 0.00 2.80 2.55 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 47 P 0.00 4.32 0.00 2.23 2.20 0.00 3.89 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 48 E 8.19 4.22 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 49 E 8.40 3.92 0.00 2.15 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 0.00 2.25 2.24 0.00 50 K 7.51 3.96 0.00 1.71 1.79 0.00 1.68 0.00 0.00 1.34 0.00 0.00 2.46 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.15 0.32 7.81 51 Y 8.16 4.24 0.00 3.07 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.43 4.57 0.00 1.86 1.85 0.00 1.65 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.53 1.35 7.81 53 L 8.21 3.97 0.00 1.93 1.58 0.92 1.01 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 54 G 8.85 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 7.68 4.68 0.00 2.91 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 56 V 8.26 4.05 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 0.95 0.00 0.00 0.93 0.00 0.00 57 V 8.69 5.26 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 1.30 0.00 0.00 0.75 0.00 0.00 58 E 8.53 5.11 0.00 1.85 1.78 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 2.26 2.27 0.00 59 I 8.70 4.98 1.71 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.42 1.07 0.00 0.00 60 I 8.49 5.00 1.89 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.79 0.95 0.00 0.00 61 E 9.23 2.83 0.00 1.85 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.89 0.00 62 S 7.68 4.74 0.00 3.66 3.67 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 63 R 8.47 3.82 0.00 1.72 1.78 0.00 3.22 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 64 P 0.00 4.30 0.00 2.05 2.00 0.00 3.68 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 65 I 8.44 4.01 1.88 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.74 0.84 0.00 0.00 66 S 7.35 4.67 0.00 3.92 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 67 K 8.18 3.31 0.00 1.74 1.75 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.47 7.81 68 R 7.70 4.28 0.00 1.80 1.85 0.00 3.29 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 69 K 7.30 4.44 0.00 1.83 1.76 0.00 1.77 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.74 7.81 70 R 8.62 5.04 0.00 1.86 1.68 0.00 3.23 0.00 0.00 3.37 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 71 F 8.41 5.26 0.00 2.96 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 72 R 8.58 4.85 0.00 1.68 1.81 0.00 3.19 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 73 V 7.81 3.70 1.79 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 -0.54 0.00 0.00 0.83 0.00 0.00 74 L 8.13 4.79 0.00 1.69 1.49 0.99 1.39 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 75 R 7.32 4.89 0.00 1.96 2.03 0.00 3.04 0.00 0.00 3.29 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 76 L 8.78 4.61 0.00 1.82 1.68 1.17 0.88 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 77 V 8.58 4.42 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 0.86 0.00 0.00 0.96 0.00 0.00 78 E 7.56 4.47 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 79 S 9.29 4.35 0.00 3.86 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 80 G 7.73 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 81 R 8.17 4.74 0.00 2.09 1.86 0.00 3.67 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 82 M 8.43 4.15 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 83 D 8.17 4.41 0.00 2.87 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 84 L 7.82 4.02 0.00 1.83 1.77 0.92 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.85 3.62 2.28 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 1.17 0.00 0.00 1.00 0.00 0.00 86 E 8.22 3.97 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 87 K 7.73 3.72 0.00 2.02 1.92 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.64 7.81 88 Y 7.88 4.03 0.00 3.06 3.15 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 0.00 0.00 0.00 89 L 8.49 3.93 0.00 1.88 1.75 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.50 3.61 1.81 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.82 0.85 0.00 0.00 91 R 7.30 3.56 0.00 1.79 1.73 0.00 3.20 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.43 0.00 92 R 7.43 4.09 0.00 1.95 1.92 0.00 3.31 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.38 0.00 93 Q 8.08 3.95 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 94 N 8.08 4.28 0.00 2.57 2.77 0.00 0.00 7.15 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 95 Y 7.47 4.40 0.00 3.31 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 Q 8.08 4.12 0.00 2.09 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.17 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 97 S 7.56 4.68 0.00 4.10 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 98 L 8.09 4.55 0.00 1.79 1.80 1.11 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.73 4.59 0.00 3.98 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 0.00 100 K 8.42 4.18 0.00 1.71 1.69 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.33 7.81