NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.5791 8.1849 122.7613 55.1658 43.2670 175.6752 2 Q 4.6230 9.3567 124.7508 53.8123 33.4453 172.6148 3 R 5.2795 8.7788 119.5451 54.8783 33.3931 175.0134 4 T 4.7361 8.9162 116.4913 60.2465 71.8381 171.8903 5 L 5.1674 8.5710 128.0343 53.4833 44.1978 175.1128 6 V 4.9716 9.0861 126.6088 61.1182 34.5105 173.9448 7 L 5.0338 8.6276 126.9282 52.9927 44.6709 175.4333 8 I 4.5020 8.7833 125.3889 60.2903 38.5058 175.9979 9 K 4.6178 9.0269 127.4304 54.9570 33.5272 176.6810 10 P 4.6895 0.0000 0.0000 65.0863 30.5696 178.7457 11 D 4.5726 8.4904 117.6631 56.3499 39.3680 178.3357 12 A 4.0348 8.2535 122.4112 54.9033 18.4222 179.6910 13 F 3.9056 8.2963 115.8835 60.7175 38.9538 177.2125 14 E 4.0695 8.3249 117.5929 59.0018 29.4782 178.1499 15 R 4.3776 7.9957 114.6985 54.8018 31.1327 176.2349 16 S 3.6991 7.7650 113.6762 60.3407 60.9615 172.7200 17 L 4.6324 8.1793 116.5409 54.5235 42.8135 179.3331 18 V 3.3543 7.6672 119.7731 66.1585 31.4063 177.8719 19 A 3.9716 7.8322 119.9172 54.9054 18.3399 178.8911 20 E 3.8551 8.1245 117.4201 59.5559 29.5790 179.1128 21 I 3.7063 7.8238 119.5820 64.8040 37.1617 178.3897 22 M 4.2625 8.2896 119.6895 58.3742 31.7006 179.1328 23 G 3.5998 8.6535 106.4075 47.7838 0.0000 176.0517 24 R 3.9608 7.6850 119.1218 59.1279 30.3733 178.9230 25 I 3.8729 7.5374 119.8015 64.1749 37.0737 178.0451 26 E 4.0351 8.5235 120.5613 59.2451 29.2956 178.8652 27 K 4.1395 8.1171 116.9724 58.1725 32.2281 178.1848 28 K 4.1160 7.5324 117.9363 56.0805 32.2987 176.0220 29 N 4.3396 7.8453 115.3743 54.8747 37.8006 173.6419 30 F 4.6080 7.8394 113.9160 56.4173 40.1022 174.9070 31 K 4.8015 8.6817 123.7745 54.6882 34.4516 175.7596 32 I 4.1138 8.5181 125.6621 61.5648 37.0551 176.0866 33 V 4.3615 8.6463 119.7387 61.6085 34.0121 176.1363 34 S 4.6289 7.4653 114.8010 57.3569 67.4399 172.7616 35 M 5.3894 8.3545 120.2715 54.6924 35.1630 173.6167 36 K 4.6799 9.5522 126.6284 54.6150 36.2026 174.2046 37 F 5.1224 8.7012 128.3524 56.4261 41.2868 174.5771 38 W 4.3857 8.3627 126.4707 54.5657 30.4504 176.8620 39 S 3.6637 8.4257 120.6043 60.6763 62.7557 174.4736 40 K 4.4220 7.5415 121.2262 54.6252 34.2157 174.9644 41 A 4.1892 8.3717 129.8957 51.1597 19.2248 175.6735 42 P 4.3249 0.0000 0.0000 62.2853 33.0719 177.7528 43 R 3.8503 8.6662 122.1828 59.7518 29.9520 178.5132 44 N 4.2835 7.9941 116.1425 55.9575 37.2927 177.1082 45 L 3.5894 7.5338 120.7705 57.2239 41.6478 179.3227 46 I 3.7375 7.3463 119.3457 64.5759 36.8796 178.4204 47 E 4.2686 8.2039 118.2739 59.3789 29.6165 178.9706 48 Q 4.0860 8.2217 119.8535 59.3086 28.9059 177.4296 49 H 4.0440 8.3284 118.7144 58.7632 29.9964 176.0250 50 Y 5.0603 7.9843 117.4036 57.7422 39.0528 177.9305 51 K 4.0279 8.0530 123.1523 60.2698 32.1953 178.1878 52 E 3.9636 8.3833 118.2909 58.9752 29.7153 177.1435 53 H 4.7928 8.5692 114.9658 55.2695 29.1515 176.6962 54 S 2.0000 7.4557 115.9577 60.0513 62.5566 175.0546 55 E 4.3327 7.6601 117.6677 55.9128 29.8478 175.6272 56 Q 4.2565 7.5709 119.5553 54.4587 29.8190 177.2324 57 S 4.1147 8.3510 115.3262 61.1965 63.2839 174.7184 58 Y 4.4869 7.0829 117.0367 57.0391 38.7772 176.7062 59 F 4.1495 8.0058 124.0180 61.9499 39.3255 176.6618 60 N 4.1723 8.2029 115.3340 56.3850 38.3356 177.0600 61 D 4.3411 8.0442 119.8296 57.2815 40.9752 178.1435 62 N 4.3305 8.5831 117.9966 56.9723 38.8383 176.7746 63 C 4.0633 8.0327 118.2682 62.6963 27.8965 175.7621 64 D 4.3110 8.0711 119.9036 57.3502 40.7672 178.2225 65 F 4.4122 8.4641 121.2788 61.7787 39.1958 177.0461 66 M 3.7608 8.0601 116.3884 57.0109 31.6995 178.0495 67 V 4.2214 6.9948 111.0257 60.8673 32.3089 176.4235 68 S 4.3344 7.6578 113.1377 58.8905 63.4445 173.4212 69 G 3.9521 6.9227 106.4229 45.3389 0.0000 171.3215 70 P 4.6890 0.0000 0.0000 61.7896 32.5732 175.8937 71 I 4.9258 8.0702 113.9766 59.3635 41.6222 173.9195 72 I 5.2171 8.5644 123.8553 59.6983 39.9167 174.5611 73 S 5.0820 9.1122 121.8936 56.7880 65.2495 173.2095 74 I 4.9962 8.9961 124.6823 59.3900 41.2483 174.3199 75 V 4.6434 8.4419 126.6232 61.6477 33.0751 174.0276 76 Y 5.2232 8.7135 125.7776 56.3605 40.7331 174.3749 77 E 5.1651 9.2163 123.5945 54.3027 33.2070 174.9349 78 G 4.4913 8.5003 112.3874 46.1524 0.0000 172.2756 79 T 4.2822 8.7397 115.3211 63.1910 67.8824 173.4964 80 D 4.6014 9.0590 128.3608 54.8326 38.9528 175.7017 81 A 3.9270 8.2886 121.8396 55.4017 18.3007 179.6495 82 I 3.5912 7.9202 118.1641 64.6760 37.2696 178.8751 83 S 4.1584 7.9646 114.5184 61.3140 62.9710 176.4266 84 K 4.0165 8.0350 122.0026 59.4432 31.7822 179.4741 85 I 3.6511 7.7541 120.0925 64.0422 37.0106 178.6029 86 R 3.8635 7.8869 119.2012 59.2575 29.6603 179.0111 87 R 3.8854 7.8881 117.3785 59.3513 30.3773 178.0110 88 L 4.0757 8.0012 120.1916 57.9332 41.9915 178.6596 89 Q 3.8947 8.1435 120.0028 58.2059 29.0139 177.6215 90 G 4.2621 7.2633 101.8432 44.8623 0.0000 172.4865 91 N 4.4265 8.2422 117.3241 53.5628 39.2581 175.0266 92 T 3.9073 8.6310 120.9789 66.5017 68.9425 173.9226 93 N 4.8251 8.7868 121.7313 52.0597 39.2083 173.7703 94 P 4.3812 0.0000 0.0000 64.5824 31.6651 177.0262 95 L 4.1964 8.4551 118.5696 55.8903 41.9004 177.1593 96 A 4.6115 7.9540 120.7280 52.3096 21.0855 177.1990 97 S 4.1454 7.9336 110.8962 58.3018 63.8317 173.3356 98 A 4.3171 8.4018 127.0762 50.5143 19.3640 174.9678 99 P 4.5904 0.0000 0.0000 64.4547 31.9256 175.8137 100 G 4.0813 9.6566 110.4168 45.9352 0.0000 174.8878 101 T 4.4126 7.7684 109.9401 60.5203 71.3669 175.8846 102 I 3.6647 8.5026 123.0068 64.9197 37.1525 179.2013 103 R 4.0667 8.2689 118.9440 59.1013 29.6538 179.3522 104 G 3.6612 8.1488 104.9733 47.2947 0.0000 174.8985 105 D 4.6179 8.1570 119.8688 55.4994 41.2688 177.3627 106 L 4.5969 7.9725 116.4330 54.1611 44.2060 176.4089 107 A 4.6953 7.7979 120.7978 50.8370 20.3452 176.0101 108 N 5.0480 8.3477 117.9240 52.6752 40.0696 173.4101 109 D 4.6285 7.7063 113.1355 52.3000 44.0883 175.0582 110 I 3.9931 7.7751 124.4768 62.7088 38.5134 177.0567 111 G 3.6007 8.0278 107.7947 47.3803 0.0000 174.8763 112 E 3.6132 8.0900 124.9688 54.6031 27.7520 175.8062 113 N 4.9493 7.9477 119.3410 52.0066 38.6358 176.7705 114 L 4.2406 9.3649 124.5504 56.1653 41.3325 174.4378 115 I 5.0884 7.9305 116.2844 59.8228 41.3935 173.7151 116 H 5.1404 9.4169 128.7132 54.6077 32.3199 173.0761 117 A 5.1851 7.9780 124.6574 49.9707 22.1263 176.0430 118 S 4.4413 8.5476 118.1249 59.3433 63.3315 174.5692 119 D 4.6996 8.6746 121.5389 53.4828 40.2317 176.2397 120 S 4.5633 7.5455 114.5439 56.5753 67.2263 175.9484 121 E 3.9566 8.5264 121.5849 59.7493 29.1922 179.3838 122 D 4.3801 8.0717 118.5113 57.5025 41.0078 178.9497 123 S 4.1992 8.1507 114.3873 61.0724 62.9515 176.2993 124 A 4.0138 8.3254 124.7897 55.0740 18.1657 179.7124 125 V 3.5669 7.8183 116.6753 66.2243 31.6739 177.8466 126 D 4.3791 8.0975 118.5544 57.6916 40.7290 178.8467 127 E 4.1709 8.7879 119.3230 59.4016 29.3891 179.4494 128 I 4.1119 8.3677 120.6840 64.4586 37.1212 178.6239 129 S 4.2273 8.3272 115.1761 61.2724 62.5392 176.8170 130 I 3.6023 7.3694 122.3865 63.9220 36.9716 177.8341 131 W 4.4118 7.9879 117.4883 57.3249 30.5657 176.7450 132 F 5.0131 8.4582 116.6524 55.1673 38.9373 173.0011 133 P 4.8473 0.0000 0.0000 62.5746 30.9887 177.0660 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 L 8.18 4.58 0.00 1.68 1.68 0.96 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 2 Q 9.36 4.62 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.61 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 3 R 8.78 5.28 0.00 1.67 1.81 0.00 3.14 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 4 T 8.92 4.74 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 1.17 0.00 0.00 5 L 8.57 5.17 0.00 1.88 1.63 0.87 1.19 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 6 V 9.09 4.97 2.32 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 1.10 0.00 0.00 1.07 0.00 0.00 7 L 8.63 5.03 0.00 1.52 1.26 0.25 -0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.78 4.50 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.36 0.85 0.00 0.00 9 K 9.03 4.62 0.00 2.10 1.79 0.00 1.95 0.00 0.00 1.97 0.00 0.00 3.04 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.49 1.50 7.81 10 P 0.00 4.69 0.00 1.77 2.00 0.00 3.09 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.95 0.00 11 D 8.49 4.57 0.00 3.00 3.24 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 12 A 8.25 4.03 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 13 F 8.30 3.91 0.00 3.37 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 14 E 8.32 4.07 0.00 2.06 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 2.40 2.47 0.00 15 R 8.00 4.38 0.00 1.93 1.95 0.00 3.39 0.00 0.00 3.26 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 16 S 7.76 3.70 0.00 4.04 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 17 L 8.18 4.63 0.00 1.59 1.60 0.92 0.83 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 18 V 7.67 3.35 1.80 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 0.84 0.00 0.00 -0.14 0.00 0.00 19 A 7.83 3.97 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 20 E 8.12 3.86 0.00 2.07 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 2.37 2.46 0.00 21 I 7.82 3.71 1.98 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 1.52 0.57 0.92 0.00 0.00 22 M 8.29 4.26 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.70 0.00 23 G 8.65 3.60 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 0.00 0.00 0.00 24 R 7.69 3.96 0.00 1.97 2.00 0.00 3.16 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 25 I 7.54 3.87 1.76 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.88 -0.11 0.00 0.00 26 E 8.52 4.04 0.00 2.20 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 2.34 2.41 0.00 27 K 8.12 4.14 0.00 1.77 1.84 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.58 7.81 28 K 7.53 4.12 0.00 1.77 2.13 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.15 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.74 1.16 7.81 29 N 7.85 4.34 0.00 2.77 2.70 0.00 0.00 7.15 6.36 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 30 F 7.84 4.61 0.00 2.95 2.93 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 31 K 8.68 4.80 0.00 1.78 1.76 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.58 7.81 32 I 8.52 4.11 1.85 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.56 0.82 0.00 0.00 33 V 8.65 4.36 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 0.68 0.00 0.00 0.90 0.00 0.00 34 S 7.47 4.63 0.00 2.72 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 35 M 8.35 5.39 0.00 2.02 1.86 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.62 0.00 36 K 9.55 4.68 0.00 1.76 1.48 0.00 1.21 0.00 0.00 0.61 0.00 0.00 2.23 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.40 0.97 7.81 37 F 8.70 5.12 0.00 3.05 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 38 W 8.36 4.39 0.00 2.94 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 39 S 8.43 3.66 0.00 3.99 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 0.00 40 K 7.54 4.42 0.00 1.63 1.67 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.28 1.53 7.81 41 A 8.37 4.19 1.06 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 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.32 0.00 2.14 1.94 0.00 3.25 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.23 0.00 43 R 8.67 3.85 0.00 1.87 1.90 0.00 3.16 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.00 44 N 7.99 4.28 0.00 2.89 3.01 0.00 0.00 6.26 6.67 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 45 L 7.53 3.59 0.00 1.18 0.43 0.14 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.35 3.74 1.99 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.17 1.00 0.00 0.00 47 E 8.20 4.27 0.00 2.00 2.27 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 2.36 2.51 0.00 48 Q 8.22 4.09 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.77 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 49 H 8.33 4.04 0.00 3.17 3.37 0.00 5.97 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Y 7.98 5.06 0.00 3.50 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 51 K 8.05 4.03 0.00 1.99 2.31 0.00 1.31 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.54 1.50 7.81 52 E 8.38 3.96 0.00 2.02 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 2.34 2.39 0.00 53 H 8.57 4.79 0.00 3.60 3.45 0.00 5.63 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 S 7.46 2.00 0.00 3.31 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 55 E 7.66 4.33 0.00 1.85 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 2.08 2.15 0.00 56 Q 7.57 4.26 0.00 1.28 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 57 S 8.35 4.11 0.00 3.99 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 58 Y 7.08 4.49 0.00 3.19 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 59 F 8.01 4.15 0.00 3.14 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 60 N 8.20 4.17 0.00 2.80 2.85 0.00 0.00 7.04 8.08 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 61 D 8.04 4.34 0.00 2.86 2.73 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 62 N 8.58 4.33 0.00 2.91 2.84 0.00 0.00 7.24 7.20 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 63 C 8.03 4.06 0.00 2.84 2.77 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 64 D 8.07 4.31 0.00 2.83 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 65 F 8.46 4.41 0.00 2.97 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 66 M 8.06 3.76 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.94 0.00 67 V 6.99 4.22 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 0.79 0.00 0.00 0.97 0.00 0.00 68 S 7.66 4.33 0.00 4.01 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 0.00 69 G 6.92 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 70 P 0.00 4.69 0.00 0.49 1.26 0.00 3.54 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 1.68 1.70 0.00 71 I 8.07 4.93 1.74 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.10 0.71 0.00 0.00 72 I 8.56 5.22 2.06 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.31 1.12 0.00 0.00 73 S 9.11 5.08 0.00 3.75 3.33 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 74 I 9.00 5.00 1.65 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.65 0.16 0.00 0.00 75 V 8.44 4.64 1.73 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 0.96 0.00 0.00 0.47 0.00 0.00 76 Y 8.71 5.22 0.00 2.93 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 77 E 9.22 5.17 0.00 2.03 1.82 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 2.26 2.42 0.00 78 G 8.50 4.49 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 0.00 79 T 8.74 4.28 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 1.22 0.00 0.00 80 D 9.06 4.60 0.00 2.97 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 81 A 8.29 3.93 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 82 I 7.92 3.59 1.96 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 1.58 0.61 0.93 0.00 0.00 83 S 7.96 4.16 0.00 4.05 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 84 K 8.03 4.02 0.00 2.08 2.14 0.00 2.18 0.00 0.00 1.87 0.00 0.00 2.99 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.56 1.69 7.81 85 I 7.75 3.65 1.70 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 -0.20 0.73 0.00 0.00 86 R 7.89 3.86 0.00 1.99 1.97 0.00 3.26 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.77 0.00 87 R 7.89 3.89 0.00 1.90 2.14 0.00 3.32 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 88 L 8.00 4.08 0.00 2.04 1.68 0.94 0.53 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 89 Q 8.14 3.89 0.00 2.19 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.18 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 90 G 7.26 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 0.00 0.00 0.00 0.00 91 N 8.24 4.43 0.00 2.69 2.80 0.00 0.00 7.01 7.70 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 92 T 8.63 3.91 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 1.19 0.00 0.00 93 N 8.79 4.83 0.00 2.67 2.74 0.00 0.00 6.98 7.77 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 94 P 0.00 4.38 0.00 2.17 2.13 0.00 3.51 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.01 0.00 95 L 8.46 4.20 0.00 1.74 1.74 0.91 0.71 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 96 A 7.95 4.61 1.23 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 0.00 0.00 97 S 7.93 4.15 0.00 4.00 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 0.00 98 A 8.40 4.32 1.27 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 0.00 0.00 99 P 0.00 4.59 0.00 2.04 2.01 0.00 3.64 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 2.03 2.10 0.00 100 G 9.66 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 0.00 0.00 0.00 0.00 101 T 7.77 4.41 4.39 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 1.28 0.00 0.00 102 I 8.50 3.66 1.99 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.51 0.91 0.00 0.00 103 R 8.27 4.07 0.00 1.92 1.96 0.00 3.42 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 1.78 1.73 0.00 104 G 8.15 3.66 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 0.00 0.00 0.00 105 D 8.16 4.62 0.00 2.73 2.73 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 0.00 106 L 7.97 4.60 0.00 1.69 1.66 0.92 0.83 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 0.00 107 A 7.80 4.70 1.22 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 0.00 0.00 108 N 8.35 5.05 0.00 2.59 2.69 0.00 0.00 6.76 8.47 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 0.00 109 D 7.71 4.63 0.00 2.54 2.52 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 0.00 110 I 7.78 3.99 1.78 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 1.11 1.54 0.78 0.00 0.00 111 G 8.03 3.60 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 0.00 0.00 0.00 112 E 8.09 3.61 0.00 1.69 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 0.00 1.47 1.81 0.00 113 N 7.95 4.95 0.00 2.88 3.08 0.00 0.00 6.20 6.67 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 0.00 114 L 9.36 4.24 0.00 1.97 1.93 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 115 I 7.93 5.09 1.90 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 1.13 0.89 0.97 0.00 0.00 116 H 9.42 5.14 0.00 3.41 3.13 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 7.98 5.19 1.11 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 0.00 0.00 118 S 8.55 4.44 0.00 3.82 3.88 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 0.00 119 D 8.67 4.70 0.00 2.80 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 0.00 120 S 7.55 4.56 0.00 3.98 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 0.00 121 E 8.53 3.96 0.00 2.05 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 2.42 2.42 0.00 122 D 8.07 4.38 0.00 2.70 2.73 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 0.00 123 S 8.15 4.20 0.00 4.12 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 0.00 124 A 8.33 4.01 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 0.00 125 V 7.82 3.57 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 1.05 0.00 0.00 0.96 0.00 0.00 126 D 8.10 4.38 0.00 2.96 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 0.00 127 E 8.79 4.17 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 2.33 2.50 0.00 128 I 8.37 4.11 2.02 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.98 1.02 0.00 0.00 129 S 8.33 4.23 0.00 4.10 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 0.00 130 I 7.37 3.60 1.77 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.60 -0.13 0.00 0.00 131 W 7.99 4.41 0.00 3.35 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 0.00 132 F 8.46 5.01 0.00 3.22 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 0.00 133 P 0.00 4.85 0.00 2.20 2.05 0.00 3.48 0.00 0.00 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.94 0.00