NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5431 8.3044 118.1911 55.4179 33.6226 175.1050 2 T 4.2841 7.5235 116.4347 60.6385 67.9528 171.0736 3 H 4.4857 8.9681 118.5970 55.0660 30.3386 174.0800 4 D 4.6869 8.1959 119.0902 53.7160 42.1917 175.5134 5 N 4.4604 8.3856 117.4739 56.5824 39.4024 175.8824 6 K 4.1459 7.7004 118.9458 56.4401 33.3635 177.0215 7 L 4.4551 7.7185 126.0912 52.1050 40.8012 176.4318 8 Q 4.7459 6.9972 117.8632 55.4992 30.9969 172.7981 9 V 4.6076 7.5717 112.8235 59.6215 36.2518 176.5115 10 E 4.7021 8.3468 118.0098 54.7636 29.6767 175.2113 11 A 4.0367 7.9055 122.5593 53.1567 19.7125 178.0254 12 I 4.1121 8.1737 116.0613 60.1534 39.1842 177.1533 13 K 2.8482 8.4627 122.7343 58.4720 32.1480 177.0797 14 R 4.9478 7.6843 113.7181 53.8170 32.4183 174.4516 15 G 4.0245 8.3227 108.4381 44.6851 0.0000 171.7995 16 T 4.8291 8.2947 117.4512 63.4376 70.5725 175.3943 17 V 4.3625 8.2885 122.8945 62.2741 33.9349 172.4902 18 I 4.5814 9.0670 129.9501 60.6927 38.2696 174.8318 19 D 5.0418 9.4938 127.2868 53.2670 44.9306 176.0497 20 H 4.2593 9.0700 114.8782 55.8334 26.3470 175.2375 21 I 3.9373 7.3304 121.2879 60.8069 37.5830 174.1437 22 P 4.7035 0.0000 0.0000 62.5876 31.5100 175.9762 23 A 4.0948 8.8624 122.3416 53.0791 19.5904 177.2445 24 Q 3.2386 8.0155 116.2564 56.6964 27.4506 175.7227 25 I 4.5266 7.4687 115.9702 61.1667 38.0987 177.4360 26 G 3.6819 8.1172 107.6248 47.4970 0.0000 175.5331 27 F 4.4928 8.2196 122.3444 60.5858 39.5025 177.3578 28 K 3.7916 8.1397 117.8101 59.6455 31.6749 178.4856 29 L 4.2939 7.6175 117.0343 58.2611 41.6635 179.0324 30 L 3.9611 7.6566 119.7386 58.3558 41.8879 178.9166 31 S 4.1068 7.6336 112.1206 60.5512 62.9962 177.1392 32 L 4.4491 8.5405 122.4625 53.8160 40.2881 177.0298 33 F 4.4643 8.2623 116.5034 56.8086 45.1521 174.4834 34 K 3.8307 8.1874 120.1239 57.4553 29.6834 175.4031 35 L 4.5602 7.6068 114.7754 55.8895 40.8402 177.3757 36 T 4.3631 7.6152 108.6806 62.5843 69.8788 175.9289 37 E 4.0173 8.2483 122.0431 59.6504 29.6750 177.2570 38 T 3.9898 7.7450 106.5033 62.1353 69.0129 173.1598 39 D 4.5375 8.5161 120.3109 56.3340 41.6138 177.8343 40 Q 3.8047 7.9717 115.6937 55.7073 29.2138 177.0836 41 R 4.0329 8.6583 122.3617 57.1283 31.1128 175.0115 42 I 4.8602 8.3535 125.4201 59.7889 40.6658 174.7811 43 T 4.6654 9.2304 122.3007 61.8048 71.4539 173.0775 44 I 4.7403 8.5198 126.5823 59.5807 40.2787 175.6675 45 G 3.9524 9.3943 116.2360 44.9514 0.0000 172.2907 46 L 5.5546 8.2531 126.0704 52.9873 43.6036 176.0384 47 N 4.1258 8.9940 116.3427 54.0704 36.2717 174.6373 48 L 4.2151 8.2858 117.2735 54.1049 42.5586 175.0034 49 P 5.4863 0.0000 0.0000 62.8308 33.5048 173.3868 50 S 4.4358 8.6191 112.1316 57.7440 68.6325 176.7582 51 G 4.3624 8.6501 113.1328 45.5637 0.0000 174.0336 52 E 4.4414 7.9634 115.0932 56.2458 30.9596 176.2359 53 M 4.5448 7.9916 116.2169 54.1571 35.2155 177.4993 54 G 3.8520 8.2127 111.3342 46.5545 0.0000 176.1492 55 R 5.1817 8.9774 117.4832 54.5503 32.2248 175.4754 56 K 4.8520 9.8000 121.9758 55.3981 36.1893 174.5667 57 D 5.4641 9.0606 122.1870 52.8077 43.4405 175.2291 58 L 5.0502 9.1845 124.3432 53.3229 46.0619 174.9323 59 I 4.8459 9.1636 126.7482 59.5155 40.0925 174.5085 60 K 4.6630 9.1420 130.2797 55.0714 32.9476 174.7476 61 I 4.5579 8.1055 129.1016 59.3001 39.3266 174.7880 62 E 4.3568 8.5514 129.6572 56.5120 30.3701 176.9143 63 N 4.1342 9.7392 123.9870 53.6826 37.3230 174.0419 64 T 4.4079 6.9392 113.9618 61.5295 70.7981 173.4328 65 F 5.9681 8.0809 121.6808 54.2616 41.9513 175.2662 66 L 4.0827 8.7565 125.5524 54.8012 42.3129 177.9198 67 S 4.3320 8.7945 119.5079 58.8252 64.6332 175.2506 68 E 4.2531 8.7093 122.2946 58.0005 29.8335 177.5171 69 D 5.5316 7.7466 120.1384 55.6380 42.0313 177.6133 70 Q 3.8985 8.0971 118.0843 59.0699 28.2870 178.6595 71 V 3.8225 7.8688 117.8442 64.9453 31.5554 177.5276 72 D 4.4468 8.9218 119.7330 56.6156 40.6534 177.6255 73 Q 4.1301 7.9442 116.4301 56.9772 29.3541 176.9200 74 L 4.1419 7.6466 121.6128 57.0372 41.9708 178.0922 75 A 4.0068 7.3492 119.4912 54.9870 18.2327 179.2136 76 L 4.1448 7.0774 116.8168 57.7859 42.1593 178.6758 77 Y 4.8094 7.5981 114.2420 59.8772 39.1589 176.9806 78 A 4.8006 8.2074 126.3866 49.2983 19.2748 174.4424 79 P 4.3326 0.0000 0.0000 65.2643 31.9094 178.2671 80 Q 4.2613 7.9950 114.2016 56.2207 29.2987 175.2731 81 A 4.6195 7.5839 121.4627 51.9075 19.6603 176.8162 82 T 4.7143 9.3781 116.5276 60.0453 70.7216 173.2806 83 V 4.7689 7.9782 125.5738 60.1135 34.2505 174.2390 84 N 4.8195 9.2460 124.7046 51.3990 40.0303 175.0066 85 R 4.4537 8.5282 124.0566 56.2688 31.7187 176.1968 86 I 5.1582 9.0730 122.7750 59.7488 41.4817 173.8417 87 D 4.8733 9.7168 126.7522 53.1346 44.6645 174.3755 88 N 4.1281 9.4707 119.7999 56.2173 36.8181 172.7135 89 Y 4.2023 7.8598 111.8033 56.8716 37.1025 170.8581 90 E 4.6781 8.1707 117.7357 54.6034 33.5103 174.7758 91 V 4.5820 8.2582 125.3893 62.6770 30.6564 176.3074 92 V 3.7951 7.8097 115.6605 63.7922 32.7578 178.7445 93 G 4.2071 8.0459 106.2311 44.1749 0.0000 172.7063 94 K 4.6934 8.5348 120.9854 54.7008 35.2316 175.6578 95 S 4.8964 8.5188 119.3276 56.6935 67.3909 173.5457 96 R 4.5800 8.1979 120.2818 53.9228 32.8398 172.7325 97 P 4.3264 0.0000 0.0000 62.7580 31.4185 175.6176 98 S 4.5874 8.2615 117.9734 55.9951 63.8899 173.4549 99 L 3.9545 8.3264 125.6886 54.1409 41.2285 175.5793 100 P 4.5230 0.0000 0.0000 62.6371 31.9128 176.1676 101 E 4.3418 8.7557 116.7333 58.8727 30.0171 177.2295 102 R 4.7599 7.8010 113.3170 54.5250 33.0187 173.6477 103 I 4.6895 8.7638 120.6711 59.5097 40.8803 173.8783 104 D 5.3042 8.1050 126.4128 52.5216 45.4381 176.1030 105 N 4.5764 8.9894 116.0751 53.8475 36.9777 175.7048 106 V 4.2505 7.4343 109.9084 61.9369 34.3597 176.2483 107 L 4.6379 7.8148 117.6772 53.5887 42.8695 175.8243 108 V 4.3624 8.5215 120.1182 60.7732 33.2540 174.7576 109 C 4.4617 8.9530 127.7029 58.9557 31.5006 172.2802 110 P 3.7595 0.0000 0.0000 64.9911 31.2494 175.9158 111 N 4.4625 7.4721 118.8265 53.2977 38.8449 175.3806 112 S 3.8827 8.7478 121.6381 61.4958 63.1837 174.7953 113 N 4.6151 8.1711 116.0553 53.5063 38.6066 173.7383 114 C 4.3912 7.8711 118.0224 58.6923 32.4420 174.1913 115 I 3.6418 8.6296 126.8279 64.2241 37.2983 177.8400 116 S 3.7262 7.8481 113.6008 62.5122 62.3941 175.7840 117 H 4.1138 7.9177 118.1398 58.2984 28.4622 177.0249 118 A 4.1375 7.8075 122.7443 54.5557 18.7423 177.8695 119 E 4.2532 7.5947 115.4274 55.2524 30.4982 175.8298 120 P 4.5614 0.0000 0.0000 61.5184 30.0090 175.1129 121 V 4.5065 7.2791 118.8110 60.4474 36.1755 174.6245 122 S 4.7489 8.4448 117.2928 57.2683 63.9396 174.8788 123 S 4.2792 8.7313 119.5943 58.8421 64.2584 173.1183 124 S 4.8106 7.3877 108.9632 58.0179 65.3171 175.2732 125 F 6.0481 9.1472 125.7226 54.8920 42.9505 174.0846 126 A 4.8792 8.5897 122.7574 51.0137 20.7640 176.6467 127 V 4.7512 9.6304 124.8021 61.3234 31.4427 174.2894 128 R 4.6946 8.4814 123.1486 53.6416 32.2216 174.9476 129 K 4.0242 8.6279 124.7559 57.0010 32.4403 175.0245 130 R 3.9471 8.8130 130.0226 57.4260 29.8637 176.0866 131 A 4.7386 8.1719 118.9135 53.3685 24.6777 177.5528 132 N 5.0138 7.7229 107.2614 53.0907 42.8389 173.6866 133 D 4.5513 7.4795 116.0021 52.2750 41.2475 174.8046 134 I 4.2662 7.9978 114.6250 60.7383 39.4925 174.2255 135 A 4.8902 8.8345 127.3923 50.5045 21.4423 175.6539 136 L 5.8524 9.8817 121.8377 52.0275 44.9850 175.3574 137 K 4.9842 8.7022 125.3581 54.6469 34.3610 174.8993 138 C 3.6664 9.3572 129.2838 59.2138 31.8747 174.2460 139 K 3.5330 8.9540 128.6492 59.4349 31.7988 176.8471 140 Y 4.3179 7.9986 116.4491 59.9665 38.8617 176.5177 141 C 4.2708 8.0490 113.7727 59.1200 30.2086 174.4274 142 E 3.9165 7.9537 118.1979 57.1372 27.4438 174.1883 143 K 4.2633 7.4500 117.1271 55.5364 33.9709 175.2608 144 E 4.8240 8.0874 123.7028 54.4156 30.9616 174.9679 145 F 5.1062 9.0186 125.1929 55.4045 43.3124 174.6741 146 S 4.3752 8.7117 116.1687 57.9678 63.2493 174.7335 147 H 4.0325 10.0204 123.9811 58.7354 28.3217 177.0247 148 N 4.3283 7.7551 117.6545 56.5273 39.3839 176.2063 149 V 3.7736 8.2143 111.9915 64.1348 31.8266 178.2340 150 V 3.5886 7.5991 116.6374 64.3691 31.4675 175.8119 151 L 4.3910 7.3638 117.0117 54.9805 41.3262 176.4636 152 A 4.5225 7.6991 121.8319 50.4083 19.6887 176.7857 153 N 4.5767 8.4695 117.5197 54.2627 39.3679 175.0312 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 4.54 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.59 0.00 2 T 7.52 4.28 4.14 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 0.99 0.00 0.00 3 H 8.97 4.49 0.00 3.31 3.35 0.00 5.58 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.20 4.69 0.00 2.70 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 5 N 8.39 4.46 0.00 2.69 2.80 0.00 0.00 6.80 6.68 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 6 K 7.70 4.15 0.00 1.74 1.69 0.00 1.70 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.48 7.81 7 L 7.72 4.46 0.00 1.63 1.56 0.91 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 8 Q 7.00 4.75 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 6.54 0.00 0.00 0.00 0.00 0.00 2.13 2.25 0.00 9 V 7.57 4.61 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 0.89 0.00 0.00 0.91 0.00 0.00 10 E 8.35 4.70 0.00 2.02 1.93 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 2.19 2.37 0.00 11 A 7.91 4.04 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 12 I 8.17 4.11 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.60 0.96 0.00 0.00 13 K 8.46 2.85 0.00 1.30 1.52 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.02 0.21 7.81 14 R 7.68 4.95 0.00 2.25 1.86 0.00 3.10 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.41 0.00 15 G 8.32 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 16 T 8.29 4.83 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 1.30 0.00 0.00 17 V 8.29 4.36 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 0.92 0.00 0.00 0.95 0.00 0.00 18 I 9.07 4.58 1.85 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.52 0.95 0.00 0.00 19 D 9.49 5.04 0.00 2.72 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 20 H 9.07 4.26 0.00 3.41 3.70 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.33 3.94 2.11 0.00 0.00 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 1.32 0.75 0.95 0.00 0.00 22 P 0.00 4.70 0.00 2.10 2.09 0.00 3.84 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 2.04 2.24 0.00 23 A 8.86 4.09 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 24 Q 8.02 3.24 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.66 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 25 I 7.47 4.53 1.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.93 0.00 0.00 26 G 8.12 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 0.00 0.00 0.00 27 F 8.22 4.49 0.00 3.05 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 28 K 8.14 3.79 0.00 1.94 1.72 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.51 7.81 29 L 7.62 4.29 0.00 1.92 1.78 0.96 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.66 3.96 0.00 1.90 1.69 0.94 1.22 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 31 S 7.63 4.11 0.00 3.67 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 32 L 8.54 4.45 0.00 1.66 1.62 0.67 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.26 4.46 0.00 3.24 2.99 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 34 K 8.19 3.83 0.00 1.91 1.88 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.35 7.81 35 L 7.61 4.56 0.00 1.79 1.76 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.62 4.36 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 1.25 0.00 0.00 37 E 8.25 4.02 0.00 1.97 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 0.00 2.31 2.36 0.00 38 T 7.74 3.99 4.22 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 1.21 0.00 0.00 39 D 8.52 4.54 0.00 2.65 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 40 Q 7.97 3.80 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.34 2.28 0.00 41 R 8.66 4.03 0.00 1.88 1.80 0.00 3.12 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 42 I 8.35 4.86 1.88 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 1.41 0.84 0.99 0.00 0.00 43 T 9.23 4.67 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 1.34 0.00 0.00 44 I 8.52 4.74 1.91 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 1.36 0.52 0.98 0.00 0.00 45 G 9.39 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 0.00 0.00 0.00 46 L 8.25 5.55 0.00 1.50 1.56 0.76 1.29 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 47 N 8.99 4.13 0.00 2.78 2.83 0.00 0.00 7.00 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 48 L 8.29 4.22 0.00 1.88 1.60 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 5.49 0.00 2.16 2.08 0.00 3.79 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 1.92 1.93 0.00 50 S 8.62 4.44 0.00 3.88 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 51 G 8.65 4.36 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 0.00 52 E 7.96 4.44 0.00 2.07 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 2.19 2.45 0.00 53 M 7.99 4.54 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 54 G 8.21 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 55 R 8.98 5.18 0.00 1.70 1.91 0.00 3.15 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 56 K 9.80 4.85 0.00 1.58 1.82 0.00 1.21 0.00 0.00 1.76 0.00 0.00 2.81 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.30 1.39 7.81 57 D 9.06 5.46 0.00 2.62 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 58 L 9.18 5.05 0.00 1.85 1.45 1.15 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 59 I 9.16 4.85 1.85 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 1.14 0.53 0.90 0.00 0.00 60 K 9.14 4.66 0.00 1.81 1.70 0.00 2.03 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.36 1.41 7.81 61 I 8.11 4.56 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.97 0.87 0.00 0.00 62 E 8.55 4.36 0.00 1.96 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 2.23 2.20 0.00 63 N 9.74 4.13 0.00 2.59 2.78 0.00 0.00 6.95 7.42 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 64 T 6.94 4.41 4.15 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 1.17 0.00 0.00 65 F 8.08 5.97 0.00 2.98 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 66 L 8.76 4.08 0.00 1.66 1.63 0.74 0.90 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 67 S 8.79 4.33 0.00 4.03 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 68 E 8.71 4.25 0.00 2.10 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 2.27 2.43 0.00 69 D 7.75 5.53 0.00 2.81 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 70 Q 8.10 3.90 0.00 2.52 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.72 0.00 0.00 0.00 0.00 0.00 2.77 2.58 0.00 71 V 7.87 3.82 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 1.03 0.00 0.00 1.01 0.00 0.00 72 D 8.92 4.45 0.00 2.82 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 73 Q 7.94 4.13 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.94 0.00 0.00 0.00 0.00 0.00 2.26 1.96 0.00 74 L 7.65 4.14 0.00 1.96 1.98 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 75 A 7.35 4.01 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 76 L 7.08 4.14 0.00 1.48 1.61 0.82 0.81 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 77 Y 7.60 4.81 0.00 3.03 2.99 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 78 A 8.21 4.80 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 79 P 0.00 4.33 0.00 2.20 2.20 0.00 3.85 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 80 Q 7.99 4.26 0.00 2.22 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.45 2.33 0.00 81 A 7.58 4.62 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 82 T 9.38 4.71 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 1.18 0.00 0.00 83 V 7.98 4.77 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 0.80 0.00 0.00 0.92 0.00 0.00 84 N 9.25 4.82 0.00 2.63 2.82 0.00 0.00 6.60 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 85 R 8.53 4.45 0.00 1.80 1.65 0.00 2.90 0.00 0.00 2.83 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 86 I 9.07 5.16 2.09 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 1.23 0.98 1.01 0.00 0.00 87 D 9.72 4.87 0.00 2.66 2.46 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 88 N 9.47 4.13 0.00 2.81 2.82 0.00 0.00 7.21 7.54 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 89 Y 7.86 4.20 0.00 3.07 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 90 E 8.17 4.68 0.00 2.15 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 2.25 2.42 0.00 91 V 8.26 4.58 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 1.24 0.00 0.00 0.95 0.00 0.00 92 V 7.81 3.80 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 0.85 0.00 0.00 0.94 0.00 0.00 93 G 8.05 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 0.00 0.00 0.00 0.00 94 K 8.53 4.69 0.00 1.57 1.69 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.32 1.37 7.81 95 S 8.52 4.90 0.00 3.74 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 96 R 8.20 4.58 0.00 1.66 1.72 0.00 3.42 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.65 0.00 97 P 0.00 4.33 0.00 2.21 2.20 0.00 3.79 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 98 S 8.26 4.59 0.00 3.84 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 99 L 8.33 3.95 0.00 1.66 1.62 0.89 1.02 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 0.00 100 P 0.00 4.52 0.00 2.17 2.10 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 101 E 8.76 4.34 0.00 1.99 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 2.39 2.36 0.00 102 R 7.80 4.76 0.00 1.94 1.84 0.00 2.95 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.61 0.00 103 I 8.76 4.69 1.87 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.48 0.94 0.00 0.00 104 D 8.10 5.30 0.00 2.64 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 0.00 105 N 8.99 4.58 0.00 2.93 2.99 0.00 0.00 6.73 7.25 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 0.00 106 V 7.43 4.25 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 0.67 0.00 0.00 0.91 0.00 0.00 107 L 7.81 4.64 0.00 1.72 1.34 0.71 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.52 4.36 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 0.76 0.00 0.00 0.94 0.00 0.00 109 C 8.95 4.46 0.00 3.22 2.92 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 0.00 110 P 0.00 3.76 0.00 1.83 1.84 0.00 3.11 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.86 0.00 111 N 7.47 4.46 0.00 2.99 2.99 0.00 0.00 6.77 7.05 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 0.00 112 S 8.75 3.88 0.00 3.95 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 0.00 113 N 8.17 4.62 0.00 2.69 2.87 0.00 0.00 6.92 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 0.00 114 C 7.87 4.39 0.00 3.23 3.04 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 0.00 115 I 8.63 3.64 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.16 0.69 0.00 0.00 116 S 7.85 3.73 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 0.00 117 H 7.92 4.11 0.00 3.09 3.34 0.00 5.67 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.81 4.14 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 0.00 119 E 7.59 4.25 0.00 1.94 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 0.00 2.27 2.32 0.00 120 P 0.00 4.56 0.00 2.15 2.06 0.00 3.66 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.95 0.00 121 V 7.28 4.51 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 0.79 0.00 0.00 0.63 0.00 0.00 122 S 8.44 4.75 0.00 3.79 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 0.00 123 S 8.73 4.28 0.00 4.08 4.16 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 0.00 124 S 7.39 4.81 0.00 3.84 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 0.00 125 F 9.15 6.05 0.00 3.07 2.99 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 0.00 126 A 8.59 4.88 1.25 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 0.00 0.00 0.00 127 V 9.63 4.75 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 0.82 0.00 0.00 1.02 0.00 0.00 128 R 8.48 4.69 0.00 1.95 2.00 0.00 3.27 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.75 0.00 129 K 8.63 4.02 0.00 1.80 1.76 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.44 7.81 130 R 8.81 3.95 0.00 1.82 1.79 0.00 3.35 0.00 0.00 3.24 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 131 A 8.17 4.74 1.25 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 0.00 0.00 0.00 132 N 7.72 5.01 0.00 2.67 2.81 0.00 0.00 6.76 8.06 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 0.00 133 D 7.48 4.55 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 0.00 134 I 8.00 4.27 1.89 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 1.24 1.03 0.91 0.00 0.00 135 A 8.83 4.89 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 0.00 136 L 9.88 5.85 0.00 1.62 1.68 0.72 0.74 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 0.00 137 K 8.70 4.98 0.00 1.84 1.68 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.38 7.81 138 C 9.36 3.67 0.00 3.29 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 0.00 139 K 8.95 3.53 0.00 1.50 1.48 0.00 1.56 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.31 1.00 7.81 140 Y 8.00 4.32 0.00 2.99 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 0.00 141 C 8.05 4.27 0.00 3.21 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 0.00 142 E 7.95 3.92 0.00 2.17 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 0.00 2.20 2.41 0.00 143 K 7.45 4.26 0.00 1.36 1.43 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.63 1.54 7.81 144 E 8.09 4.82 0.00 1.80 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 2.14 2.19 0.00 145 F 9.02 5.11 0.00 2.88 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 0.00 146 S 8.71 4.38 0.00 3.88 3.72 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 0.00 147 H 10.02 4.03 0.00 3.42 3.77 0.00 5.52 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 N 7.76 4.33 0.00 2.49 2.81 0.00 0.00 7.03 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 0.00 149 V 8.21 3.77 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 0.74 0.00 0.00 1.06 0.00 0.00 150 V 7.60 3.59 1.88 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 0.09 0.00 0.00 0.79 0.00 0.00 151 L 7.36 4.39 0.00 1.99 1.68 1.12 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 152 A 7.70 4.52 1.19 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 0.00 0.00 153 N 8.47 4.58 0.00 2.65 2.66 0.00 0.00 7.01 7.56 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