NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.1394 8.3344 116.7697 57.9144 65.2787 173.0840 5 V 3.6539 7.6485 129.5641 61.4996 31.6973 170.7647 6 V 4.2024 8.8839 128.3253 61.5385 33.6050 174.0974 7 K 4.7485 8.1235 122.0270 54.2419 35.3871 177.8874 8 S 4.0691 8.6925 115.7212 61.9798 62.7515 176.4899 9 E 4.3301 8.0632 115.3084 56.6927 29.8848 176.1994 10 D 4.6827 7.4401 117.5203 54.7244 41.3822 177.8902 11 Y 4.1682 7.3812 117.7860 59.4705 37.8225 177.0962 12 A 4.3057 7.0738 121.0547 52.3296 19.1775 176.5843 13 L 4.8243 7.1164 115.0474 51.5031 44.6601 174.7435 14 P 4.2925 0.0000 0.0000 63.2884 31.6728 175.7103 15 S 4.8249 8.2997 114.9946 56.5843 66.2631 172.0659 16 Y 4.5697 8.3887 120.8577 56.1621 39.7691 174.9184 17 V 4.2761 7.0831 118.4873 59.7391 35.4493 175.3414 18 D 4.5354 8.4736 124.2147 52.7692 40.1303 175.1744 19 R 4.4971 7.8176 122.4832 53.8555 32.9047 176.8479 20 R 3.3651 8.7526 122.9290 59.4524 30.0458 177.1920 21 D 4.7550 7.9959 112.8929 53.9539 39.0615 176.0590 22 Y 4.8078 8.0339 121.0709 55.5198 38.7409 173.5760 23 P 4.6036 0.0000 0.0000 64.7435 32.0337 177.1947 24 L 4.7397 6.7351 119.1592 51.6293 40.4027 174.3706 25 P 4.7270 0.0000 0.0000 62.1100 32.0947 177.6704 26 D 4.6603 8.8075 119.6354 56.8084 41.0137 177.2727 27 V 4.5413 7.1436 110.5986 58.7868 35.5174 175.2312 28 A 4.0251 8.4107 125.0188 52.3349 18.9799 177.1988 29 H 3.5563 8.4792 122.8564 58.6517 29.8441 175.6918 30 V 3.9919 7.9194 119.6716 61.0328 31.9206 175.1463 31 K 4.1540 8.5221 126.4817 57.5006 33.7144 176.0683 32 N 4.7049 7.8585 116.7892 51.2592 39.1103 174.1033 33 L 4.2788 8.2944 124.5250 53.4049 42.7585 177.8013 34 S 4.2831 8.5498 118.6373 57.9925 64.2093 175.1006 35 A 3.9889 8.5144 123.1066 55.6261 18.0015 180.0571 36 S 4.1357 7.9701 111.9792 61.5574 63.2608 176.2835 37 Q 3.9801 7.8688 121.5817 58.8110 28.5028 179.0593 38 K 3.9363 8.1915 119.0871 59.4497 32.0310 179.2824 39 A 4.0307 7.6844 120.0439 54.8319 18.2994 179.3666 40 L 3.9231 8.4220 119.3887 58.3902 41.9416 179.4845 41 K 4.0747 8.0511 117.3366 59.1628 32.1834 179.0536 42 E 4.1207 8.0818 119.1295 59.4122 29.4140 179.2627 43 K 4.0080 8.6974 119.8274 59.3734 31.9709 178.1737 44 E 4.2170 8.0107 118.5757 58.5099 29.6128 178.1602 45 K 4.2792 8.0256 116.7720 57.1680 32.4866 176.7375 46 A 4.4015 7.5455 122.4576 50.1235 20.3611 176.6619 47 S 3.9165 8.4915 112.7381 59.0757 62.6954 175.4563 48 W 4.6788 8.6284 126.3956 59.2824 29.3296 178.6763 49 S 4.2641 8.1767 113.8396 61.5394 62.3472 175.3175 50 S 4.3958 7.8045 113.6582 59.4057 62.7164 174.0395 51 L 4.6744 7.6773 121.8423 53.5432 42.6634 177.5298 52 S 4.4010 9.5440 118.6176 57.9102 65.0770 175.4032 53 I 3.6552 8.3821 124.2799 65.1564 36.9101 178.3166 54 D 4.3954 8.0902 118.7390 57.2968 40.5418 178.7309 55 E 3.9390 8.1853 119.0974 59.2814 29.5876 179.0396 56 K 3.8062 8.5297 119.0264 59.8825 32.1197 179.2582 57 V 3.6381 8.1580 118.3729 65.9734 31.4153 177.6154 58 E 3.9507 8.3135 119.1143 59.2626 29.3269 178.8088 59 L 3.9650 8.2951 119.4304 57.7752 41.7448 178.8492 60 Y 4.0328 8.0251 119.4002 60.9234 38.6492 178.3776 61 R 4.3913 8.1425 118.3900 57.9592 30.3879 178.7420 62 L 4.0449 7.8292 119.6681 57.5572 41.5526 179.1187 63 K 3.6667 7.5751 119.4241 57.1587 32.0301 176.5051 64 F 5.1519 7.3807 116.7434 55.2936 41.9209 175.1292 65 K 3.6433 8.9669 125.7630 57.6374 32.5375 176.4365 66 E 5.0201 8.5075 119.6767 54.3773 32.1454 177.0181 67 S 5.1965 9.1062 118.9978 57.3197 65.4357 175.5592 68 F 3.9228 9.0594 120.9313 60.7899 38.4290 177.6393 69 A 4.0591 8.1347 118.4777 55.2834 18.3427 179.1771 70 E 4.0935 8.0804 117.0552 59.8494 29.4469 179.5639 71 M 4.1531 8.3575 115.7917 57.8212 31.2150 177.1986 72 N 4.7483 7.7263 115.4665 52.0468 39.2765 175.4164 73 R 4.1481 7.1522 117.7324 55.9809 30.2772 176.2059 74 S 4.7331 8.3183 114.2439 57.1037 65.1374 172.5326 75 T 4.7638 8.0623 109.8804 60.2591 71.6479 172.9923 76 N 4.8646 8.4515 115.5586 53.3926 38.8813 176.9586 77 E 3.9093 8.2532 122.4869 59.2518 29.5260 178.7328 78 W 4.3032 8.4369 116.1586 59.6342 27.7330 178.2179 79 K 3.0215 6.4261 119.0089 59.2744 31.3678 179.3552 80 T 3.7428 7.5001 115.2696 66.4883 68.3444 176.7132 81 V 3.5817 7.9268 120.2031 66.0680 31.6419 178.2210 82 V 3.7546 8.3220 118.4861 66.0037 31.3774 178.2428 83 G 3.5650 8.3658 105.4888 47.6361 0.0000 175.4743 84 A 4.0782 8.4741 123.6034 54.8961 18.4045 179.2935 85 A 4.1630 8.3781 119.4853 56.0389 18.3427 179.8429 86 M 4.0967 8.2496 116.9323 58.3188 31.9411 178.6053 87 F 4.0298 8.4384 120.9830 61.5129 39.4416 177.3365 88 F 3.9334 8.4078 117.2956 60.5093 38.5222 177.8878 89 I 3.9039 8.2469 119.1772 64.1332 37.2440 178.4425 90 G 3.6389 8.2492 107.2508 47.5854 0.0000 175.7219 91 F 3.9549 8.1588 123.4017 61.1234 39.2960 177.3442 92 T 3.6472 8.2196 115.4736 66.3614 68.1005 176.3371 93 A 4.0340 7.8370 122.1881 54.6852 18.1996 179.7947 94 L 3.8340 7.4009 117.7284 57.8301 41.6073 179.2308 95 L 3.8892 7.4620 118.4101 58.1312 41.4968 179.6608 96 L 4.1017 7.9470 118.5155 57.6589 41.5098 179.5823 97 I 3.7135 8.4723 120.5519 64.0919 37.0760 178.1165 98 W 4.2091 8.9135 129.6420 60.5100 30.5717 177.6245 99 E 3.7983 8.7468 119.5543 59.2434 28.9372 178.6355 100 K 4.1311 8.0749 118.4801 59.6671 32.2535 177.9592 101 H 4.1018 7.9763 117.6966 58.8956 30.0277 176.1144 102 Y 4.0686 7.6778 115.6581 57.7460 38.3070 175.7437 103 V 4.0074 7.1081 116.4947 64.3435 33.4937 175.4409 104 Y 4.4053 7.4644 116.5051 57.9527 38.5099 176.6359 105 G 4.0266 8.3531 113.4113 43.8908 0.0000 171.4711 106 P 4.4047 0.0000 0.0000 62.1906 32.1445 175.8679 107 I 4.0211 7.7313 113.1974 59.0262 38.9988 173.7706 108 P 4.3544 0.0000 0.0000 62.8412 31.8765 177.4772 109 H 4.2877 8.6377 116.0716 58.0408 28.4217 177.1610 110 T 2.5865 7.0484 109.2855 62.9750 68.6518 174.8422 111 F 4.4559 7.7628 119.8795 57.7760 39.7518 176.6504 112 E 4.1945 7.8741 121.3347 56.0753 31.1290 177.1578 113 E 3.9841 8.8985 122.7561 59.8141 29.7015 179.1160 114 E 3.9489 8.2348 118.5965 58.9658 29.7731 178.3571 115 W 3.9108 8.2532 128.0706 60.3902 30.7757 177.9614 116 V 3.7240 8.3652 118.4582 65.8046 30.9489 177.8732 117 A 4.0959 8.2746 120.6239 55.0913 18.2064 179.6261 118 K 3.6883 7.7955 116.8745 59.6563 32.1005 179.1236 119 Q 3.8207 8.1265 119.9683 59.5887 28.9014 178.5560 120 T 4.0150 8.6301 117.4867 66.6449 68.4683 176.3726 121 K 3.5934 7.8930 121.1737 59.4516 32.1767 178.5569 122 R 3.7964 8.0659 119.2314 59.9230 29.8381 178.2193 123 M 4.0432 8.4382 118.6394 58.5179 32.0712 178.8089 124 L 4.0986 8.0526 119.0896 57.7791 41.4621 179.2123 125 D 4.4920 8.1742 118.6987 56.6428 40.8924 177.5797 126 M 4.2642 8.1396 115.2359 54.1564 32.3725 175.8084 127 K 4.1808 7.8596 117.1131 56.6436 30.1974 176.5389 128 V 3.4916 8.1758 118.4961 64.6395 32.5869 174.7419 129 A 4.1791 8.6493 127.4292 52.9464 15.3309 174.9557 130 P 4.6891 0.0000 0.0000 63.0589 32.8926 178.3001 131 I 4.2090 7.7912 119.2959 63.3770 37.9150 176.2554 132 Q 4.5209 8.0042 114.2418 57.3377 33.5379 176.4594 133 G 3.8301 8.3516 105.5184 48.1370 0.0000 173.1472 134 F 4.9304 8.4285 121.1208 59.5205 43.1130 176.5505 135 S 4.3338 8.8543 116.5387 61.0820 63.1303 176.6418 136 A 4.1542 8.3174 122.2908 54.7400 18.2309 178.0113 137 K 4.4290 8.2581 113.7726 56.2316 32.6845 175.6549 138 W 4.5842 8.0958 130.3516 55.1423 31.9665 174.6951 139 D 4.3316 7.8140 126.2780 53.7360 40.4807 176.3725 140 Y 4.3028 8.4904 124.7649 60.0726 38.6293 176.8252 141 D 4.5866 8.2649 118.8946 56.7422 41.9578 178.1252 142 K 3.9366 8.2015 117.5067 57.0335 32.2523 176.7651 143 N 4.4555 7.4406 116.5835 53.8484 37.8026 172.5886 144 E 3.6209 6.0341 110.4923 53.3401 34.1007 174.5078 145 W 4.5930 7.8935 119.6072 56.8893 29.4830 176.5941 146 K 3.7827 8.7397 124.2776 56.9334 32.2975 177.2676 147 K 4.1421 8.5246 122.2582 56.7763 32.1152 176.8831 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 4 S 8.33 4.14 0.00 3.78 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 5 V 7.65 3.65 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 0.72 0.00 0.00 0.91 0.00 0.00 6 V 8.88 4.20 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 0.89 0.00 0.00 0.96 0.00 0.00 7 K 8.12 4.75 0.00 2.07 1.66 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.35 7.81 8 S 8.69 4.07 0.00 3.92 3.98 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 9 E 8.06 4.33 0.00 1.96 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 0.00 2.21 2.25 0.00 10 D 7.44 4.68 0.00 2.90 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 11 Y 7.38 4.17 0.00 3.07 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 12 A 7.07 4.31 1.04 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 0.00 0.00 13 L 7.12 4.82 0.00 1.60 1.53 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.29 0.00 2.06 2.04 0.00 3.62 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 15 S 8.30 4.82 0.00 3.97 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 16 Y 8.39 4.57 0.00 3.01 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 17 V 7.08 4.28 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 0.69 0.00 0.00 0.83 0.00 0.00 18 D 8.47 4.54 0.00 2.67 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 R 7.82 4.50 0.00 1.81 1.99 0.00 3.47 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 20 R 8.75 3.37 0.00 1.76 2.09 0.00 3.29 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 21 D 8.00 4.75 0.00 2.85 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 22 Y 8.03 4.81 0.00 2.92 2.76 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 0.00 0.00 0.00 23 P 0.00 4.60 0.00 2.27 2.40 0.00 3.73 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.02 0.00 24 L 6.74 4.74 0.00 1.70 1.69 0.96 1.23 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 25 P 0.00 4.73 0.00 2.31 1.72 0.00 3.91 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.09 0.00 26 D 8.81 4.66 0.00 2.74 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 27 V 7.14 4.54 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 0.72 0.00 0.00 1.03 0.00 0.00 28 A 8.41 4.03 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 29 H 8.48 3.56 0.00 1.99 3.17 0.00 5.93 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 30 V 7.92 3.99 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 0.77 0.00 0.00 0.75 0.00 0.00 31 K 8.52 4.15 0.00 1.86 1.86 0.00 1.58 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.41 7.81 32 N 7.86 4.70 0.00 2.67 2.78 0.00 0.00 6.91 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.29 4.28 0.00 1.61 1.58 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.55 4.28 0.00 4.03 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 35 A 8.51 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 S 7.97 4.14 0.00 4.06 4.13 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 0.00 0.00 0.00 0.00 37 Q 7.87 3.98 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.50 2.40 0.00 38 K 8.19 3.94 0.00 1.97 1.86 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.24 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.68 7.81 39 A 7.68 4.03 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 40 L 8.42 3.92 0.00 1.72 1.85 0.93 0.55 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 41 K 8.05 4.07 0.00 1.93 1.87 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.71 1.61 7.81 42 E 8.08 4.12 0.00 2.12 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 0.00 2.52 2.47 0.00 43 K 8.70 4.01 0.00 1.95 1.95 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.49 7.81 44 E 8.01 4.22 0.00 2.16 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 45 K 8.03 4.28 0.00 1.83 1.88 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.54 1.80 7.81 46 A 7.55 4.40 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 47 S 8.49 3.92 0.00 3.82 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.63 4.68 0.00 3.48 3.07 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 49 S 8.18 4.26 0.00 3.90 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 50 S 7.80 4.40 0.00 4.14 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.68 4.67 0.00 1.97 1.62 1.02 0.70 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 52 S 9.54 4.40 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 8.38 3.66 1.87 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 1.64 0.93 0.90 0.00 0.00 54 D 8.09 4.40 0.00 2.72 2.72 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 55 E 8.19 3.94 0.00 2.21 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 2.34 2.36 0.00 56 K 8.53 3.81 0.00 1.97 1.86 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.40 1.57 7.81 57 V 8.16 3.64 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 1.10 0.00 0.00 0.93 0.00 0.00 58 E 8.31 3.95 0.00 2.23 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 2.31 2.36 0.00 59 L 8.30 3.97 0.00 1.88 1.64 0.86 0.85 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 60 Y 8.03 4.03 0.00 3.18 3.20 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 61 R 8.14 4.39 0.00 1.87 2.03 0.00 3.47 0.00 0.00 3.41 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.76 0.00 62 L 7.83 4.04 0.00 1.79 1.61 0.88 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.58 3.67 0.00 1.39 1.11 0.00 1.11 0.00 0.00 1.33 0.00 0.00 2.82 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.30 0.21 7.81 64 F 7.38 5.15 0.00 2.48 2.78 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 65 K 8.97 3.64 0.00 0.98 2.00 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.23 7.81 66 E 8.51 5.02 0.00 2.22 1.89 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 2.40 2.25 0.00 67 S 9.11 5.20 0.00 4.06 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 9.06 3.92 0.00 3.03 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 69 A 8.13 4.06 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.08 4.09 0.00 2.17 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 2.36 2.35 0.00 71 M 8.36 4.15 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.66 0.00 72 N 7.73 4.75 0.00 2.89 2.90 0.00 0.00 7.03 7.69 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 73 R 7.15 4.15 0.00 1.91 1.95 0.00 3.07 0.00 0.00 3.30 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.59 0.00 74 S 8.32 4.73 0.00 4.03 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 75 T 8.06 4.76 4.28 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 1.25 0.00 0.00 76 N 8.45 4.86 0.00 2.72 2.69 0.00 0.00 6.42 7.66 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 77 E 8.25 3.91 0.00 2.11 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 2.34 2.34 0.00 78 W 8.44 4.30 0.00 3.69 3.35 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 79 K 6.43 3.02 0.00 1.39 1.36 0.00 1.35 0.00 0.00 1.22 0.00 0.00 2.96 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.30 0.45 7.81 80 T 7.50 3.74 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 81 V 7.93 3.58 2.29 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 1.14 0.00 0.00 1.00 0.00 0.00 82 V 8.32 3.75 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 1.07 0.00 0.00 1.15 0.00 0.00 83 G 8.37 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.47 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 85 A 8.38 4.16 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 86 M 8.25 4.10 0.00 2.14 2.35 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 2.87 2.60 0.00 87 F 8.44 4.03 0.00 3.02 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 88 F 8.41 3.93 0.00 3.32 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 89 I 8.25 3.90 1.97 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.64 0.94 0.00 0.00 90 G 8.25 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 91 F 8.16 3.95 0.00 2.38 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 92 T 8.22 3.65 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 1.20 0.00 0.00 93 A 7.84 4.03 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 94 L 7.40 3.83 0.00 1.46 1.53 0.93 0.43 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 95 L 7.46 3.89 0.00 1.76 1.65 0.86 0.29 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 96 L 7.95 4.10 0.00 1.88 1.75 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 97 I 8.47 3.71 2.05 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.81 0.95 0.00 0.00 98 W 8.91 4.21 0.00 3.47 3.47 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 99 E 8.75 3.80 0.00 2.29 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 0.00 1.81 2.09 0.00 100 K 8.07 4.13 0.00 1.91 1.86 0.00 1.84 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.49 7.81 101 H 7.98 4.10 0.00 3.05 3.32 0.00 5.99 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 0.00 102 Y 7.68 4.07 0.00 1.43 2.24 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 0.00 103 V 7.11 4.01 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 0.50 0.00 0.00 0.68 0.00 0.00 104 Y 7.46 4.41 0.00 2.98 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.35 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 0.00 0.00 0.00 0.00 106 P 0.00 4.40 0.00 2.16 2.02 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 107 I 7.73 4.02 1.44 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.50 0.59 0.00 0.00 108 P 0.00 4.35 0.00 2.26 1.94 0.00 3.69 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.09 0.00 109 H 8.64 4.29 0.00 3.27 3.48 0.00 5.65 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 0.00 110 T 7.05 2.59 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 0.14 0.00 0.00 111 F 7.76 4.46 0.00 3.10 3.09 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 0.00 112 E 7.87 4.19 0.00 2.19 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 2.39 2.39 0.00 113 E 8.90 3.98 0.00 2.08 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 0.00 2.44 2.44 0.00 114 E 8.23 3.95 0.00 2.12 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 0.00 2.39 2.38 0.00 115 W 8.25 3.91 0.00 3.60 3.27 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 0.00 116 V 8.37 3.72 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 1.04 0.00 0.00 1.12 0.00 0.00 117 A 8.27 4.10 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 0.00 118 K 7.80 3.69 0.00 1.56 1.57 0.00 1.45 0.00 0.00 1.29 0.00 0.00 2.79 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.50 7.81 119 Q 8.13 3.82 0.00 2.10 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 120 T 8.63 4.02 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 121 K 7.89 3.59 0.00 1.63 1.78 0.00 1.53 0.00 0.00 1.48 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.25 7.81 122 R 8.07 3.80 0.00 1.79 1.97 0.00 3.07 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 123 M 8.44 4.04 0.00 2.05 2.42 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.45 0.00 124 L 8.05 4.10 0.00 1.44 1.27 -0.89 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.17 4.49 0.00 2.75 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 0.00 126 M 8.14 4.26 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.84 0.00 127 K 7.86 4.18 0.00 1.99 1.97 0.00 1.54 0.00 0.00 1.26 0.00 0.00 2.42 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.49 1.26 7.81 128 V 8.18 3.49 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 0.78 0.00 0.00 0.93 0.00 0.00 129 A 8.65 4.18 1.49 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 0.00 0.00 130 P 0.00 4.69 0.00 2.25 2.26 0.00 3.82 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 1.99 2.12 0.00 131 I 7.79 4.21 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.49 0.95 0.00 0.00 132 Q 8.00 4.52 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.08 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 133 G 8.35 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.43 4.93 0.00 3.09 3.27 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 0.00 135 S 8.85 4.33 0.00 4.23 4.28 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 0.00 136 A 8.32 4.15 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.26 4.43 0.00 2.23 1.97 0.00 1.80 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.45 7.81 138 W 8.10 4.58 0.00 2.68 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.81 4.33 0.00 2.35 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 0.00 0.00 0.00 140 Y 8.49 4.30 0.00 3.08 3.05 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 0.00 0.00 0.00 0.00 141 D 8.26 4.59 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 0.00 142 K 8.20 3.94 0.00 1.90 1.65 0.00 1.91 0.00 0.00 1.61 0.00 0.00 2.77 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.29 7.81 143 N 7.44 4.46 0.00 2.76 2.80 0.00 0.00 6.92 8.62 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 0.00 144 E 6.03 3.62 0.00 1.78 1.66 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 1.75 1.96 0.00 145 W 7.89 4.59 0.00 3.17 3.13 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 0.00 0.00 0.00 0.00 146 K 8.74 3.78 0.00 1.78 1.78 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.46 7.81 147 K 8.52 4.14 0.00 1.72 1.70 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.42 7.81