NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1706 8.1727 122.0534 56.3107 34.0911 174.0295 2 V 4.5153 8.2086 127.4369 60.7961 32.0884 174.5531 3 F 4.2502 9.9725 129.0167 57.5044 40.1666 174.9958 4 E 4.2264 8.8089 121.3880 55.7314 30.8709 177.0639 5 R 3.2795 8.9536 121.8173 60.6639 29.9792 179.5609 6 C 4.3479 8.0103 115.2768 59.5623 37.2979 175.7186 7 E 3.9051 8.0810 120.7939 59.2838 29.2700 178.4899 8 L 3.6858 8.0866 120.1678 57.8130 42.0602 178.6589 9 A 3.9395 7.8929 120.7727 55.3731 18.3596 179.9088 10 R 3.8986 8.0832 116.4901 59.5475 30.0830 179.4900 11 T 3.8639 7.8873 115.6137 66.6336 68.4830 176.7288 12 L 3.8526 8.1114 121.2608 57.5956 41.6124 179.5203 13 K 3.9214 7.9908 119.5798 59.4985 31.9142 178.8959 14 R 3.9614 7.8376 118.0725 58.9535 30.0271 177.5013 15 L 4.3664 7.5191 116.4799 53.9779 41.7727 176.7116 16 G 3.8391 7.8218 106.7702 47.1089 0.0000 175.2311 17 M 3.8839 7.7663 120.9224 56.2870 32.4727 175.9246 18 D 4.4406 8.0020 118.0822 55.8128 41.2206 175.8117 19 G 3.9422 9.2627 115.5577 45.4743 0.0000 171.4692 20 Y 4.1907 8.2780 122.0887 58.6441 38.8948 176.3400 21 R 3.6343 8.9609 126.9440 57.2957 27.7776 177.2674 22 G 3.7936 8.1342 103.3406 45.7055 0.0000 174.0940 23 I 4.0881 7.6075 122.0068 59.0399 37.9194 175.8698 24 S 4.6411 8.3474 120.4415 57.7822 63.9258 174.9794 25 L 4.2245 9.0546 123.3682 58.6208 41.7559 179.3532 26 A 4.2084 8.2003 120.0292 55.2515 18.2412 179.2385 27 N 4.4649 8.2393 115.0007 56.2383 38.5859 177.6970 28 W 4.2344 8.0561 119.9646 60.0095 29.2167 178.3720 29 M 4.1983 8.4465 118.7815 58.4841 31.4295 177.9443 30 C 3.1235 8.1350 118.6676 59.0640 43.4982 175.3730 31 L 3.9355 8.1625 121.6936 58.2787 41.7395 178.7895 32 A 4.0175 8.2997 120.7860 54.8719 18.3444 179.4193 33 K 2.6829 7.9745 118.0120 59.3566 32.0395 179.1981 34 W 4.1991 7.5459 117.4575 59.3503 29.0334 178.3826 35 E 4.2910 8.3884 118.7910 58.8072 28.9309 177.9277 36 S 4.5063 7.9092 109.5982 56.5660 64.8302 174.3980 37 G 3.9247 7.7237 108.4968 46.9110 0.0000 173.0972 38 Y 3.6037 7.5415 113.0423 58.6277 35.3187 168.8354 39 N 5.3036 7.5016 118.9193 52.0114 39.9998 175.6162 40 T 4.2062 9.0008 117.3390 63.7362 69.2308 175.9373 41 R 4.4533 8.0216 116.9944 55.7526 30.2284 176.3031 42 A 4.3063 7.6363 121.6746 52.7878 19.2497 176.9122 43 T 5.0675 8.3936 111.5467 60.0364 72.4370 173.1262 44 N 4.8806 8.7056 122.0890 52.4099 42.2476 172.4527 45 Y 4.5946 8.7827 127.9915 57.4018 40.7531 173.8837 46 N 4.7257 8.4139 124.8039 51.0660 38.5475 175.1972 47 A 3.6633 8.2146 127.3117 54.7301 18.8842 179.3359 48 G 3.7283 8.0012 104.2000 48.0246 0.0000 173.7631 49 D 4.6980 7.4047 114.8274 52.0146 40.3900 175.7407 50 R 4.0044 8.2054 116.5619 57.0644 28.1168 175.8451 51 S 4.9637 7.6466 112.4928 57.1603 66.2827 172.8475 52 T 5.0723 8.8598 116.2871 61.9424 72.5708 172.7605 53 D 5.4736 8.8900 125.2746 53.2232 43.2996 175.0225 54 Y 4.9175 9.1134 120.9842 57.4831 41.3818 177.2587 55 G 4.3958 9.5601 112.5056 44.6395 0.0000 173.2579 56 A 4.2535 8.5132 119.6243 54.2451 18.2270 178.7295 57 F 4.5634 7.9928 110.8144 56.6472 40.0976 175.5658 58 Q 3.6106 7.8539 119.2554 57.1233 26.4986 174.0242 59 I 4.4321 8.1192 118.9086 61.0339 39.2110 176.9941 60 N 5.3229 9.2698 126.1101 53.5891 39.7818 175.6566 61 S 4.7064 9.0311 120.1017 60.0518 63.4661 175.3818 62 R 3.7882 8.7767 122.3320 58.6640 30.4662 177.6432 63 Y 4.2234 7.7631 114.9360 57.8571 40.5272 177.0007 64 W 4.9229 8.0644 118.9971 57.7990 30.7932 174.1432 65 C 5.6781 8.1663 112.1333 53.6131 46.4283 172.2445 66 N 5.3121 9.0341 119.1278 52.0830 40.3181 174.7590 67 D 4.8684 8.7230 123.5378 52.2972 40.5867 177.7528 68 G 4.0997 8.4950 109.8791 45.8283 0.0000 174.7986 69 K 4.4059 7.9206 115.7972 56.6615 32.9561 175.8676 70 T 4.4389 7.6998 116.9762 61.6008 69.2508 172.9374 71 P 4.2847 0.0000 0.0000 63.6247 31.9156 176.1626 72 G 3.9009 8.5275 108.7104 46.4394 0.0000 172.9606 73 A 4.5634 7.8415 119.3209 50.7079 20.2736 177.9610 74 V 4.2590 8.4376 113.9289 59.3176 35.1659 175.8549 75 N 4.9655 8.0479 117.9707 51.8133 37.6351 174.4152 76 A 3.9618 8.7008 124.6976 54.9196 19.1302 178.5735 77 C 4.4820 8.4518 111.2714 57.4895 41.1014 173.0367 78 H 4.1854 7.9479 116.3466 56.6492 26.2896 174.1582 79 L 4.8346 8.3572 117.6656 52.8715 46.4732 176.6316 80 S 4.6567 8.3731 115.4133 58.0014 63.2751 176.0396 81 C 4.1407 8.7445 124.4831 59.6517 38.8971 176.3598 82 S 3.9110 7.6734 115.0834 61.2808 61.6493 175.9726 83 A 4.1283 7.7817 122.4937 54.4677 17.8072 177.9749 84 L 4.4241 7.7246 116.2487 55.2220 41.7750 177.7071 85 L 5.0036 7.7755 117.3813 54.4905 42.4161 176.6416 86 Q 4.3589 7.8284 117.9942 55.5464 29.4784 175.8539 87 D 4.4411 8.4817 118.9955 56.8208 41.2042 176.6999 88 N 4.6033 8.0477 118.0645 52.9729 38.8520 174.8308 89 I 4.1276 8.4968 119.0686 61.3076 37.9472 176.9909 90 A 3.9392 8.4125 124.6046 55.9502 18.1903 179.8051 91 D 4.2780 8.0796 116.3739 57.4687 40.9140 178.6953 92 A 4.1205 8.0127 120.8455 55.1111 18.4292 179.7456 93 V 3.2697 8.1567 116.8766 66.0179 31.4756 178.1816 94 A 3.8356 7.9116 120.5859 55.1719 18.1547 178.8170 95 C 4.2198 8.3026 116.9176 59.5189 37.9469 175.5666 96 A 3.9240 8.1165 122.7661 55.0942 17.6279 179.7289 97 K 3.7814 7.5389 115.9620 59.3850 32.2714 179.2480 98 R 4.0476 7.5854 118.9159 59.3202 30.0528 178.5590 99 V 2.2328 7.3501 117.9563 65.7213 30.9467 177.8419 100 V 3.9265 7.5873 109.1544 62.2991 31.3029 177.4858 101 R 4.2365 7.7439 118.3824 56.8327 30.6727 175.8782 102 D 4.7429 7.3328 118.4102 53.1703 41.8825 175.2644 103 P 4.2518 0.0000 0.0000 66.2754 31.2904 177.8945 104 Q 4.0093 8.1407 117.4585 56.5715 30.1184 177.1569 105 G 3.6862 7.8113 106.7206 47.0131 0.0000 176.4191 106 I 3.5817 7.7645 121.1305 63.3248 37.9322 177.7265 107 R 4.2533 7.3146 117.3379 57.8510 29.9550 177.5315 108 A 3.9050 7.6413 120.6459 53.9009 18.6897 177.4559 109 W 4.7779 8.0205 117.1273 55.1742 30.1801 177.2922 110 V 3.7110 8.7827 123.6762 66.1227 30.8855 177.6311 111 A 4.0358 8.2741 120.0303 54.7964 18.1119 179.2221 112 W 3.9642 8.4057 126.9485 60.7211 30.5694 178.4731 113 R 3.6096 8.1151 116.4480 59.1457 29.6302 178.4077 114 N 4.3380 7.8893 115.3529 55.7105 38.7712 176.9208 115 R 4.0390 7.7921 116.2793 55.9830 31.4313 176.1709 116 C 4.5766 7.1226 114.4185 57.8192 42.8983 174.2476 117 Q 3.3112 6.5375 119.6381 57.3806 28.6739 175.6908 118 N 4.1957 8.7382 119.8889 54.0580 36.2085 173.7000 119 R 4.4933 7.3474 115.8484 54.0181 32.9141 175.7056 120 D 4.5547 8.4117 118.8052 54.1273 40.1915 175.8364 121 V 4.5210 8.2088 118.9512 61.4217 32.4279 178.4675 122 R 4.0282 8.2420 121.6161 59.4165 29.5714 178.5557 123 Q 3.9626 8.0967 116.0473 59.7590 28.2338 178.3569 124 Y 4.3152 7.7505 117.3931 59.8606 38.2787 176.8296 125 V 4.3730 7.8717 111.0024 60.7734 33.3577 175.5726 126 Q 4.1748 7.9784 120.1148 57.3169 28.7643 176.7456 127 G 3.9566 8.9960 110.8374 45.8324 0.0000 174.3940 128 C 4.4233 7.9490 115.6233 56.8210 40.6268 174.1348 129 G 3.8518 8.1907 107.2396 46.6085 0.0000 174.0869 130 V 4.0067 7.8474 118.0690 61.0847 32.0768 175.8029 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 K 8.17 4.17 0.00 1.83 1.71 0.00 1.28 0.00 0.00 1.02 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 1.13 7.81 2 V 8.21 4.52 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.97 4.25 0.00 2.89 2.86 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 4 E 8.81 4.23 0.00 1.87 1.85 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 2.30 2.23 0.00 5 R 8.95 3.28 0.00 1.89 1.90 0.00 3.42 0.00 0.00 3.45 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 6 C 8.01 4.35 0.00 2.99 3.11 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 7 E 8.08 3.91 0.00 2.05 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 0.00 2.57 2.41 0.00 8 L 8.09 3.69 0.00 1.46 1.41 -0.04 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.89 3.94 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 10 R 8.08 3.90 0.00 1.88 1.99 0.00 3.13 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.89 3.86 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 1.20 0.00 0.00 12 L 8.11 3.85 0.00 1.73 1.58 0.96 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.99 3.92 0.00 1.85 1.93 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.84 3.96 0.00 2.00 2.05 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.52 4.37 0.00 1.66 1.53 0.84 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.82 3.84 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 0.00 0.00 0.00 17 M 7.77 3.88 0.00 1.30 1.93 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.19 0.00 18 D 8.00 4.44 0.00 2.67 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 19 G 9.26 3.94 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 0.00 0.00 0.00 20 Y 8.28 4.19 0.00 3.30 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 21 R 8.96 3.63 0.00 1.90 1.84 0.00 3.21 0.00 0.00 2.95 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.40 0.00 22 G 8.13 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 0.00 0.00 0.00 23 I 7.61 4.09 1.92 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.81 -0.20 0.00 0.00 24 S 8.35 4.64 0.00 4.07 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 25 L 9.05 4.22 0.00 2.06 1.82 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.20 4.21 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.24 4.46 0.00 2.84 2.73 0.00 0.00 6.90 7.19 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 28 W 8.06 4.23 0.00 3.59 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 29 M 8.45 4.20 0.00 2.20 2.38 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.93 0.00 30 C 8.14 3.12 0.00 2.60 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 31 L 8.16 3.94 0.00 1.86 1.86 0.59 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.30 4.02 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 33 K 7.97 2.68 0.00 1.53 1.69 0.00 0.71 0.00 0.00 1.12 0.00 0.00 2.62 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.04 0.21 7.81 34 W 7.55 4.20 0.00 3.34 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.39 4.29 0.00 1.95 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 0.00 2.53 2.34 0.00 36 S 7.91 4.51 0.00 4.04 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 37 G 7.72 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 0.00 0.00 0.00 38 Y 7.54 3.60 0.00 3.25 2.97 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 39 N 7.50 5.30 0.00 2.75 2.80 0.00 0.00 7.01 7.10 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 40 T 9.00 4.21 4.45 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 1.49 0.00 0.00 41 R 8.02 4.45 0.00 2.00 2.11 0.00 3.09 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 42 A 7.64 4.31 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 43 T 8.39 5.07 4.08 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 1.36 0.00 0.00 44 N 8.71 4.88 0.00 3.02 2.66 0.00 0.00 6.82 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 45 Y 8.78 4.59 0.00 3.00 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 46 N 8.41 4.73 0.00 2.66 2.59 0.00 0.00 6.58 7.32 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 47 A 8.21 3.66 1.31 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 0.00 0.00 48 G 8.00 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 49 D 7.40 4.70 0.00 2.70 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 50 R 8.21 4.00 0.00 2.05 2.21 0.00 3.14 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.54 0.00 51 S 7.65 4.96 0.00 3.94 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 52 T 8.86 5.07 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 0.56 0.00 0.00 53 D 8.89 5.47 0.00 2.71 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 54 Y 9.11 4.92 0.00 2.95 2.89 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 55 G 9.56 4.40 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 0.00 56 A 8.51 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 F 7.99 4.56 0.00 3.18 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.85 3.61 0.00 2.53 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.70 0.00 59 I 8.12 4.43 2.16 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.16 1.17 0.00 0.00 60 N 9.27 5.32 0.00 3.10 3.06 0.00 0.00 6.98 7.65 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 61 S 9.03 4.71 0.00 4.09 4.42 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 62 R 8.78 3.79 0.00 1.66 1.49 0.00 2.64 0.00 0.00 2.84 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.14 0.00 63 Y 7.76 4.22 0.00 1.53 1.64 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 64 W 8.06 4.92 0.00 3.55 3.30 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 65 C 8.17 5.68 0.00 3.07 3.23 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 66 N 9.03 5.31 0.00 2.85 2.71 0.00 0.00 7.09 8.81 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 67 D 8.72 4.87 0.00 2.97 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 68 G 8.49 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 69 K 7.92 4.41 0.00 1.93 1.92 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.46 7.81 70 T 7.70 4.44 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 1.17 0.00 0.00 71 P 0.00 4.28 0.00 2.01 1.97 0.00 3.82 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 72 G 8.53 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 0.00 0.00 0.00 73 A 7.84 4.56 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.44 4.26 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 0.60 0.00 0.00 0.83 0.00 0.00 75 N 8.05 4.97 0.00 2.78 2.65 0.00 0.00 6.75 7.86 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 76 A 8.70 3.96 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 77 C 8.45 4.48 0.00 3.29 3.23 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 78 H 7.95 4.19 0.00 3.33 3.35 0.00 5.62 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 79 L 8.36 4.83 0.00 1.68 1.50 0.96 0.67 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 80 S 8.37 4.66 0.00 3.84 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 81 C 8.74 4.14 0.00 2.24 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 82 S 7.67 3.91 0.00 3.81 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 83 A 7.78 4.13 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 84 L 7.72 4.42 0.00 1.96 1.83 1.07 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.78 5.00 0.00 1.79 1.73 1.09 1.09 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 86 Q 7.83 4.36 0.00 2.24 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 7.12 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 87 D 8.48 4.44 0.00 2.66 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 88 N 8.05 4.60 0.00 2.71 2.77 0.00 0.00 7.01 7.94 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 89 I 8.50 4.13 1.82 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.50 0.85 0.00 0.00 90 A 8.41 3.94 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 91 D 8.08 4.28 0.00 2.75 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 92 A 8.01 4.12 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 93 V 8.16 3.27 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 0.68 0.00 0.00 0.92 0.00 0.00 94 A 7.91 3.84 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 95 C 8.30 4.22 0.00 3.06 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.12 3.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.54 3.78 0.00 1.60 1.38 0.00 1.25 0.00 0.00 0.78 0.00 0.00 2.21 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.30 0.89 7.81 98 R 7.59 4.05 0.00 1.89 2.11 0.00 3.26 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.91 0.00 99 V 7.35 2.23 1.77 0.00 0.00 0.00 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 -0.82 0.00 0.00 100 V 7.59 3.93 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 1.13 0.00 0.00 1.44 0.00 0.00 101 R 7.74 4.24 0.00 2.17 2.04 0.00 3.33 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 102 D 7.33 4.74 0.00 3.06 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 4.25 0.00 2.15 2.19 0.00 3.78 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 1.98 2.00 0.00 104 Q 8.14 4.01 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.82 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.81 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 0.00 106 I 7.76 3.58 1.03 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.20 -0.63 0.00 0.00 107 R 7.31 4.25 0.00 2.03 2.03 0.00 3.22 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.55 0.00 108 A 7.64 3.91 0.88 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 0.00 0.00 109 W 8.02 4.78 0.00 3.49 3.22 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 0.00 110 V 8.78 3.71 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 1.09 0.00 0.00 1.00 0.00 0.00 111 A 8.27 4.04 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 0.00 112 W 8.41 3.96 0.00 3.49 3.50 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 0.00 113 R 8.12 3.61 0.00 2.05 1.97 0.00 3.62 0.00 0.00 3.60 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.13 0.00 114 N 7.89 4.34 0.00 2.66 2.69 0.00 0.00 6.95 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 0.00 115 R 7.79 4.04 0.00 0.89 0.66 0.00 2.79 0.00 0.00 2.82 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.88 0.00 116 C 7.12 4.58 0.00 1.82 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 0.00 117 Q 6.54 3.31 0.00 0.93 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.63 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 118 N 8.74 4.20 0.00 2.81 2.83 0.00 0.00 6.88 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 0.00 119 R 7.35 4.49 0.00 1.87 1.82 0.00 3.22 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 120 D 8.41 4.55 0.00 2.65 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 0.00 121 V 8.21 4.52 2.40 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 0.93 0.00 0.00 1.06 0.00 0.00 122 R 8.24 4.03 0.00 1.98 2.02 0.00 3.30 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 123 Q 8.10 3.96 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.11 0.00 0.00 0.00 0.00 0.00 1.98 1.46 0.00 124 Y 7.75 4.32 0.00 3.22 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 0.00 125 V 7.87 4.37 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 0.97 0.00 0.00 1.06 0.00 0.00 126 Q 7.98 4.17 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.77 0.00 0.00 0.00 0.00 0.00 2.55 2.31 0.00 127 G 9.00 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 0.00 0.00 0.00 128 C 7.95 4.42 0.00 3.08 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 0.00 129 G 8.19 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 0.00 130 V 7.85 4.01 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 0.76 0.00 0.00 0.96 0.00 0.00