NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4120 8.2893 120.3486 55.3607 33.0227 174.7162 2 N 4.6557 8.5783 124.1085 51.4775 38.9071 173.0131 3 I 4.6054 8.7895 121.1050 59.5951 41.9724 176.2904 4 I 4.3753 8.3233 123.7373 59.6309 38.5400 175.1453 5 K 4.4529 8.6149 124.8122 54.3918 34.0694 176.1903 6 A 4.5951 8.3856 126.3006 50.7180 21.3815 174.9891 7 N 5.0698 8.1697 116.7233 51.9093 41.5427 175.6341 8 V 3.8997 8.1958 114.4586 62.7834 32.2781 176.8547 9 A 4.2585 8.1347 123.5252 52.1345 18.6729 177.9378 10 A 4.6102 8.2924 122.2120 51.2267 21.6751 174.1210 11 P 4.6714 0.0000 0.0000 64.9478 32.1394 178.8823 12 D 4.6186 8.0616 115.4157 54.3020 40.5436 175.8242 13 A 4.5777 7.6787 124.6129 51.9579 20.0757 178.2690 14 R 4.8232 9.4621 120.9533 55.1321 32.4826 175.8348 15 V 4.9193 8.8811 124.5258 60.0093 34.7134 173.9746 16 A 4.8358 8.3810 128.6205 50.0987 21.4705 175.2282 17 I 4.7947 8.6566 123.8514 59.6133 39.3677 174.7066 18 T 4.7926 8.6132 117.7766 59.9643 70.9073 173.3643 19 I 5.2522 8.2241 126.5342 58.2056 40.5144 174.5584 20 A 5.0920 8.4706 128.0853 51.4505 19.0522 177.9332 21 R 4.4499 9.3636 119.3935 58.2846 30.3109 176.9030 22 F 4.5903 8.2895 121.5800 59.9272 39.7349 174.3206 23 N 4.6459 9.8899 123.9021 54.5609 35.5867 176.1443 24 Q 4.2060 8.3035 120.3586 59.3812 28.0805 177.8585 25 F 3.8352 8.5068 121.5981 61.1953 39.4242 176.4815 26 I 4.1879 8.1802 118.5635 63.8666 37.7375 177.8170 27 N 4.3744 8.2885 116.6049 56.2794 38.2732 176.9615 28 D 4.5792 8.8169 121.0276 57.6251 41.0086 178.7990 29 S 4.0728 7.9637 112.9876 61.0691 62.4417 175.4392 30 L 4.0697 7.7898 123.2191 58.6028 41.6612 178.3940 31 L 3.8686 8.3252 120.4179 57.7180 42.0220 178.6983 32 D 4.5043 8.4263 118.6676 57.2894 40.8865 179.6746 33 G 3.6098 8.1931 105.8189 47.8058 0.0000 175.2105 34 A 3.9409 7.8524 123.4076 54.6682 18.4324 179.3791 35 V 3.4482 7.9800 116.7819 66.3012 31.5660 177.4177 36 D 4.3063 8.1278 117.1677 57.6789 40.9528 177.6736 37 A 3.9140 8.3194 121.1169 55.8024 18.3210 179.0432 38 L 3.8129 8.5465 116.1678 59.5002 41.8330 179.8271 39 T 4.1832 8.4042 110.9788 63.9720 68.5808 176.2259 40 R 3.8542 8.1701 124.0666 58.3259 30.7041 178.0938 41 I 4.0707 8.0319 117.1462 63.5214 37.8117 177.1391 42 G 3.7363 8.0048 106.9380 45.1948 0.0000 174.1598 43 Q 3.6165 8.2703 119.9191 56.4844 27.9012 172.8317 44 V 3.7958 7.4615 116.5555 62.0388 32.2976 175.0217 45 K 4.3598 8.5850 128.9313 56.2929 32.5471 176.5961 46 D 4.7531 8.8075 124.4364 53.9708 39.0797 176.1817 47 D 4.8189 8.0098 116.8821 53.8160 40.0829 176.0921 48 N 4.8314 8.6128 117.5374 53.6665 40.1516 174.3072 49 I 4.8535 7.6781 120.8803 60.3151 38.4755 175.2142 50 T 4.7070 8.9225 117.4165 59.7022 71.9638 172.9930 51 V 4.6029 8.4151 123.7029 61.0951 34.0318 174.5642 52 V 4.2905 8.9843 129.1741 60.8012 33.5366 174.5913 53 W 4.7730 8.9655 129.1600 56.6062 29.4814 176.5146 54 V 4.2848 8.6042 119.0894 59.1183 33.4481 174.5417 55 P 4.3281 0.0000 0.0000 64.9974 31.1526 177.0332 56 G 4.5137 7.9620 108.0975 42.9560 0.0000 174.1105 57 A 4.0972 8.4879 120.6461 54.7753 18.0980 179.2770 58 Y 4.2070 8.1644 117.0983 60.6648 39.2456 177.4158 59 E 4.1171 8.2844 119.1876 58.2389 29.5943 178.6869 60 L 3.8832 7.6141 119.4731 58.0247 41.5967 177.1804 61 P 4.1897 0.0000 0.0000 64.7900 31.2123 177.9589 62 L 3.9299 7.7462 117.9887 58.4835 42.2253 179.2711 63 A 3.9897 7.8091 120.0345 55.5904 18.3285 179.8143 64 T 3.8674 8.1615 108.3322 64.4138 68.7637 176.3225 65 E 3.8427 8.9528 123.2235 59.2012 29.6404 178.2502 66 A 4.0126 7.9619 120.6031 55.6381 18.1845 179.6264 67 L 4.1031 7.5949 114.8116 57.8676 41.9612 179.4993 68 A 4.2213 8.3157 120.8224 55.1601 18.2324 179.7937 69 K 3.9225 8.2047 116.1979 59.6620 32.1548 178.9454 70 S 4.1930 8.1072 112.8553 59.4816 61.8195 175.8600 71 G 3.9361 8.4853 110.3320 46.2825 0.0000 176.0723 72 K 3.9227 7.6896 120.3324 56.3094 31.8662 182.1473 73 Y 5.1222 6.9467 114.0184 56.8177 40.7252 175.4694 74 D 4.7184 9.1779 122.1117 55.9936 41.8078 176.5024 75 A 4.5390 7.3389 117.3641 51.2244 22.4423 175.0948 76 V 4.7060 8.2161 120.2524 61.0342 34.5718 174.4640 77 V 4.3697 8.7798 128.2702 61.4598 33.5013 174.1701 78 A 4.9175 8.5713 130.1991 49.7308 20.7611 175.1659 79 L 4.9540 8.5681 123.2012 53.5228 44.3834 176.4188 80 G 4.2028 7.7830 108.6358 45.9505 0.0000 172.0662 81 T 5.0532 8.5354 116.1408 61.5190 71.9924 174.3664 82 V 4.2144 9.1446 125.0637 61.3425 34.0568 173.8615 83 I 4.7201 8.1781 128.5452 59.6654 38.6669 175.9468 84 R 3.6821 8.4168 127.6244 56.4859 30.3170 176.3372 85 G 4.4330 8.3285 116.0117 44.2827 0.0000 172.9236 86 G 3.6416 8.7874 107.6579 47.4855 0.0000 173.3419 87 T 4.5355 7.5920 108.2712 59.6743 71.6068 173.4375 88 A 4.4752 8.3706 121.2875 52.7819 18.7429 178.7841 89 H 4.3151 8.3677 120.4229 60.3441 29.6897 176.9234 90 F 4.0187 8.4787 122.0472 61.5165 39.0091 176.5717 91 E 3.6016 7.9053 117.9468 59.6244 29.4031 178.4574 92 Y 4.3184 7.4025 115.8423 60.7288 38.0957 177.6464 93 V 3.6617 7.6846 119.3247 65.8964 31.6034 177.8347 94 A 4.0869 7.7511 120.2888 55.1935 18.0647 179.6449 95 G 3.6171 8.1816 104.6382 47.7501 0.0000 176.0350 96 G 3.8705 8.5854 108.2691 45.8813 0.0000 174.7107 97 A 4.2969 7.6826 122.4230 54.2829 19.7738 179.1629 98 S 4.1436 8.2841 111.8582 61.7879 62.3802 176.2394 99 N 4.4254 8.5664 119.5659 56.0027 38.3469 177.3460 100 G 3.7720 7.6842 106.2051 48.1362 0.0000 175.4825 101 L 4.0049 7.9935 121.6620 57.2458 41.8447 179.6083 102 A 4.0046 8.0541 120.6088 55.0472 18.2731 179.6127 103 S 3.9510 8.3379 111.7959 61.5098 62.4794 176.1422 104 V 3.5413 7.7732 120.7700 66.2606 31.0936 177.7128 105 A 4.3689 7.7827 120.8945 54.8304 18.0251 179.4200 106 Q 3.8846 7.7747 116.3312 59.1660 29.1184 177.8620 107 D 4.5287 8.0058 119.4323 56.9802 41.2817 178.4650 108 S 4.3602 8.2868 112.7666 58.6492 63.4955 175.6180 109 G 3.8969 8.1656 109.6218 45.7054 0.0000 173.7744 110 V 3.9583 7.6027 121.0796 61.6271 33.0268 173.6221 111 P 4.5605 0.0000 0.0000 62.7064 32.4896 175.1660 112 V 4.8949 8.3904 123.4496 61.0228 34.1058 174.2222 113 A 4.4527 8.8862 130.3526 50.9451 20.4390 176.2834 114 F 4.8169 9.0104 126.6620 56.2933 38.2327 175.9320 115 G 3.9512 8.0878 118.5249 45.1131 0.0000 171.1776 116 V 4.5372 6.1587 118.0368 60.5135 33.7366 175.9438 117 L 4.2532 8.6622 129.4489 55.0934 42.7295 176.6627 118 T 5.4459 8.7595 112.9464 58.6742 68.8031 172.6008 119 T 4.6006 8.1483 120.8630 61.0165 72.0930 175.1012 120 E 4.1214 9.7586 120.6321 57.3799 30.4410 177.2608 121 S 4.7104 7.5857 111.9348 55.5936 67.6251 174.8049 122 I 3.6820 8.2259 123.0774 64.2621 36.6940 177.9747 123 E 3.9067 8.2498 119.8532 59.7903 29.1199 179.0055 124 Q 4.1589 7.9360 115.9614 58.7529 29.0224 178.2514 125 A 4.1622 7.7986 121.9200 55.4073 18.3519 179.6203 126 I 3.7313 7.8227 118.2249 64.8049 37.1424 178.5352 127 E 4.5744 8.0072 120.3708 58.1676 29.2948 178.4870 128 R 4.5224 7.9739 115.8083 55.7139 30.5306 176.7471 129 A 4.8187 7.2884 121.7635 52.6935 19.5248 177.0296 130 G 4.4562 7.9789 107.9776 48.1203 0.0000 175.4595 131 T 4.6152 7.5386 115.0644 60.0930 68.8105 175.7403 132 K 3.7901 9.2196 117.0778 59.3401 31.7637 177.7602 133 A 4.5676 7.8067 119.2229 52.0355 19.9715 178.9475 134 G 3.7424 8.1248 110.3331 47.2993 0.0000 173.8169 135 N 5.2378 8.2485 117.9988 50.9545 41.0323 175.6519 136 K 4.0268 8.9206 129.0066 59.0785 32.0364 179.1139 137 G 4.0734 8.2680 107.8545 47.3509 0.0000 175.6060 138 A 4.0365 7.8811 123.3570 54.3345 18.4489 179.2273 139 E 3.8870 8.3984 118.0044 59.3213 29.7320 178.8919 140 A 4.0730 8.5833 122.4705 54.3178 18.4128 179.3713 141 A 3.8910 8.2651 119.6944 55.4226 18.3921 179.9305 142 L 3.9506 7.9983 117.6515 58.1373 41.2858 179.9072 143 T 3.8646 8.0657 109.3449 64.4064 68.5904 176.3175 144 A 3.9906 7.8800 124.1474 55.0676 18.3434 179.0270 145 L 3.8596 7.8869 116.7665 58.2030 41.7773 179.2813 146 E 4.1665 8.3743 120.1673 59.1635 29.4229 179.0958 147 M 4.0543 7.9505 117.7879 58.2858 31.8998 178.4311 148 I 3.6978 7.6889 120.0156 64.8558 37.2863 178.1437 149 N 4.3199 7.9590 116.6038 56.2187 38.1465 177.5209 150 V 3.5766 7.8820 119.0177 66.1155 31.7650 177.9198 151 L 4.0809 8.3190 118.7865 57.8104 41.3860 179.1204 152 K 3.8241 8.1289 118.4466 59.6280 32.0357 177.2819 153 A 4.4527 8.0913 119.8988 51.7354 19.1409 177.2694 154 I 3.8905 7.8478 120.9124 63.1893 37.7231 173.9928 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 8.29 4.41 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 2 N 8.58 4.66 0.00 2.95 2.79 0.00 0.00 6.06 6.93 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 3 I 8.79 4.61 1.87 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 0.67 0.91 0.00 0.00 4 I 8.32 4.38 1.87 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 0.61 0.91 0.00 0.00 5 K 8.61 4.45 0.00 1.71 1.70 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.39 7.81 6 A 8.39 4.60 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 7 N 8.17 5.07 0.00 2.73 2.64 0.00 0.00 6.87 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 8 V 8.20 3.90 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 0.80 0.00 0.00 0.93 0.00 0.00 9 A 8.13 4.26 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 10 A 8.29 4.61 1.20 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 0.00 0.00 11 P 0.00 4.67 0.00 2.23 2.38 0.00 3.86 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.94 0.00 12 D 8.06 4.62 0.00 2.69 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 13 A 7.68 4.58 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 14 R 9.46 4.82 0.00 1.42 1.79 0.00 3.22 0.00 0.00 3.09 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 15 V 8.88 4.92 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 0.96 0.00 0.00 0.95 0.00 0.00 16 A 8.38 4.84 0.26 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 17 I 8.66 4.79 1.68 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 1.16 0.86 0.69 0.00 0.00 18 T 8.61 4.79 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 1.09 0.00 0.00 19 I 8.22 5.25 0.78 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 -0.08 0.35 0.00 0.00 20 A 8.47 5.09 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 9.36 4.45 0.00 2.07 2.51 0.00 2.87 0.00 0.00 3.11 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.63 0.00 22 F 8.29 4.59 0.00 3.15 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 23 N 9.89 4.65 0.00 2.97 2.99 0.00 0.00 6.88 7.88 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 24 Q 8.30 4.21 0.00 2.53 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.70 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 25 F 8.51 3.84 0.00 3.14 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 26 I 8.18 4.19 2.13 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.86 0.95 0.00 0.00 27 N 8.29 4.37 0.00 2.88 2.92 0.00 0.00 7.07 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 28 D 8.82 4.58 0.00 2.66 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 29 S 7.96 4.07 0.00 3.81 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 30 L 7.79 4.07 0.00 1.93 1.63 0.96 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.33 3.87 0.00 1.79 1.78 0.77 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.43 4.50 0.00 2.87 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 33 G 8.19 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.85 3.94 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 35 V 7.98 3.45 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 0.97 0.00 0.00 0.96 0.00 0.00 36 D 8.13 4.31 0.00 2.83 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 37 A 8.32 3.91 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 38 L 8.55 3.81 0.00 1.86 1.71 0.88 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.40 4.18 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 1.27 0.00 0.00 40 R 8.17 3.85 0.00 1.81 2.26 0.00 3.24 0.00 0.00 3.58 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 41 I 8.03 4.07 2.09 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 1.23 0.96 0.91 0.00 0.00 42 G 8.00 3.74 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 0.00 0.00 0.00 43 Q 8.27 3.62 0.00 2.33 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.94 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 44 V 7.46 3.80 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 0.91 0.00 0.00 1.03 0.00 0.00 45 K 8.58 4.36 0.00 1.80 1.68 0.00 1.92 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.37 7.81 46 D 8.81 4.75 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 47 D 8.01 4.82 0.00 2.78 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 48 N 8.61 4.83 0.00 2.76 2.99 0.00 0.00 6.93 7.30 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 49 I 7.68 4.85 1.88 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 1.40 0.52 0.88 0.00 0.00 50 T 8.92 4.71 4.31 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 1.48 0.00 0.00 51 V 8.42 4.60 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 0.46 0.00 0.00 0.83 0.00 0.00 52 V 8.98 4.29 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 0.94 0.00 0.00 0.87 0.00 0.00 53 W 8.97 4.77 0.00 3.21 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 54 V 8.60 4.28 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 0.74 0.00 0.00 1.07 0.00 0.00 55 P 0.00 4.33 0.00 2.19 2.28 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.05 0.00 56 G 7.96 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.49 4.10 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.21 0.00 2.92 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 59 E 8.28 4.12 0.00 2.00 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 2.65 2.58 0.00 60 L 7.61 3.88 0.00 1.73 1.70 0.89 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.19 0.00 2.03 1.86 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 62 L 7.75 3.93 0.00 1.63 1.67 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 63 A 7.81 3.99 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 64 T 8.16 3.87 4.19 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 1.20 0.00 0.00 65 E 8.95 3.84 0.00 1.98 2.18 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 2.31 2.33 0.00 66 A 7.96 4.01 1.42 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 0.00 0.00 67 L 7.59 4.10 0.00 1.76 1.69 0.63 0.82 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 68 A 8.32 4.22 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.20 3.92 0.00 1.73 1.91 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.64 1.60 7.81 70 S 8.11 4.19 0.00 3.91 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 71 G 8.49 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 72 K 7.69 3.92 0.00 1.83 1.75 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.28 7.81 73 Y 6.95 5.12 0.00 3.11 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 74 D 9.18 4.72 0.00 2.55 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 75 A 7.34 4.54 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 76 V 8.22 4.71 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 0.93 0.00 0.00 0.85 0.00 0.00 77 V 8.78 4.37 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 0.88 0.00 0.00 0.88 0.00 0.00 78 A 8.57 4.92 1.18 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 0.00 0.00 79 L 8.57 4.95 0.00 1.39 1.40 0.80 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 80 G 7.78 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 0.00 0.00 0.00 81 T 8.54 5.05 4.30 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 1.19 0.00 0.00 82 V 9.14 4.21 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 0.90 0.00 0.00 0.87 0.00 0.00 83 I 8.18 4.72 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 1.24 0.69 0.88 0.00 0.00 84 R 8.42 3.68 0.00 0.67 1.38 0.00 3.05 0.00 0.00 2.97 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.15 0.00 85 G 8.33 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.79 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 87 T 7.59 4.54 4.31 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 1.24 0.00 0.00 88 A 8.37 4.48 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 89 H 8.37 4.32 0.00 3.30 3.41 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 F 8.48 4.02 0.00 3.10 3.02 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 91 E 7.91 3.60 0.00 1.94 1.12 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 2.01 2.18 0.00 92 Y 7.40 4.32 0.00 2.99 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 93 V 7.68 3.66 1.94 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 1.04 0.00 0.00 0.77 0.00 0.00 94 A 7.75 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 8.18 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.59 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.68 4.30 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 98 S 8.28 4.14 0.00 3.71 3.86 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 99 N 8.57 4.43 0.00 2.86 2.83 0.00 0.00 6.94 7.84 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 0.00 100 G 7.68 3.77 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 0.00 101 L 7.99 4.00 0.00 2.05 1.82 1.06 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 102 A 8.05 4.00 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 0.00 103 S 8.34 3.95 0.00 3.96 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 0.00 104 V 7.77 3.54 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 1.03 0.00 0.00 0.96 0.00 0.00 105 A 7.78 4.37 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.77 3.88 0.00 2.09 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 107 D 8.01 4.53 0.00 2.70 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 0.00 108 S 8.29 4.36 0.00 4.03 4.06 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 0.00 109 G 8.17 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 0.00 110 V 7.60 3.96 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 0.96 0.00 0.00 1.00 0.00 0.00 111 P 0.00 4.56 0.00 2.12 1.96 0.00 3.77 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 2.12 2.09 0.00 112 V 8.39 4.89 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 0.81 0.00 0.00 1.01 0.00 0.00 113 A 8.89 4.45 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 0.00 114 F 9.01 4.82 0.00 3.02 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 0.00 115 G 8.09 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 0.00 116 V 6.16 4.54 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 0.69 0.00 0.00 0.02 0.00 0.00 117 L 8.66 4.25 0.00 1.63 1.58 0.92 0.33 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 0.00 118 T 8.76 5.45 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 1.24 0.00 0.00 119 T 8.15 4.60 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 1.26 0.00 0.00 120 E 9.76 4.12 0.00 1.95 1.92 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 2.31 2.30 0.00 121 S 7.59 4.71 0.00 3.95 3.86 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 0.00 122 I 8.23 3.68 1.84 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 1.47 0.43 0.87 0.00 0.00 123 E 8.25 3.91 0.00 2.06 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 0.00 2.38 2.49 0.00 124 Q 7.94 4.16 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 125 A 7.80 4.16 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 0.00 126 I 7.82 3.73 2.01 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.72 0.99 0.00 0.00 127 E 8.01 4.57 0.00 2.21 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 2.34 2.38 0.00 128 R 7.97 4.52 0.00 1.87 1.94 0.00 3.11 0.00 0.00 3.19 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 129 A 7.29 4.82 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 0.00 130 G 7.98 4.46 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 0.00 131 T 7.54 4.62 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 1.26 0.00 0.00 132 K 9.22 3.79 0.00 1.77 1.96 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.49 7.81 133 A 7.81 4.57 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 0.00 134 G 8.12 3.74 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 0.00 0.00 0.00 135 N 8.25 5.24 0.00 2.70 2.65 0.00 0.00 6.94 7.11 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 0.00 136 K 8.92 4.03 0.00 1.82 1.82 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.47 7.81 137 G 8.27 4.07 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 0.00 0.00 0.00 138 A 7.88 4.04 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 0.00 139 E 8.40 3.89 0.00 2.04 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 2.32 0.00 140 A 8.58 4.07 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 0.00 141 A 8.27 3.89 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.00 3.95 0.00 1.99 1.72 0.91 0.42 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 0.00 143 T 8.07 3.86 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 1.30 0.00 0.00 144 A 7.88 3.99 1.40 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 0.00 145 L 7.89 3.86 0.00 1.85 1.89 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.37 4.17 0.00 2.02 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 2.32 2.24 0.00 147 M 7.95 4.05 0.00 2.10 2.34 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 2.63 2.91 0.00 148 I 7.69 3.70 2.05 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 0.92 0.92 0.00 0.00 149 N 7.96 4.32 0.00 2.91 2.86 0.00 0.00 6.74 8.97 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 0.00 150 V 7.88 3.58 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 0.83 0.00 0.00 0.98 0.00 0.00 151 L 8.32 4.08 0.00 1.95 1.69 0.93 0.82 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 0.00 152 K 8.13 3.82 0.00 1.84 2.08 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.50 7.81 153 A 8.09 4.45 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 I 7.85 3.89 1.87 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 1.16 0.72 0.91 0.00 0.00