NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1778 8.1727 122.0497 56.2751 34.1587 174.0507 2 V 4.5836 8.1302 126.4985 60.6730 32.5166 174.5206 3 F 4.4494 10.1022 129.1464 57.5702 40.1704 174.9030 4 E 4.2352 9.1683 121.1605 55.5227 31.0639 176.7611 5 R 3.3003 8.9782 120.5202 60.9654 30.0007 179.3559 6 C 4.3118 7.9967 115.1624 59.7306 36.9534 175.6053 7 E 3.8856 8.1749 120.6152 59.3335 29.1750 178.5811 8 L 3.6661 8.0602 120.5275 57.9899 42.0897 178.9767 9 S 4.0967 7.8620 114.1307 61.6409 62.7388 176.8095 10 R 3.9552 7.9840 121.5499 59.0487 29.8839 179.1216 11 T 3.8487 7.7780 115.6445 66.6215 68.4652 176.7190 12 L 3.8483 8.1251 121.2825 57.5131 41.6237 179.4887 13 K 3.9046 8.1125 119.5568 59.6812 31.9540 179.0923 14 R 3.9806 7.9924 117.2543 58.9427 30.0082 178.1017 15 L 4.3617 7.3954 115.6955 54.3767 41.6625 177.2329 16 G 3.8773 7.8756 106.9201 46.6790 0.0000 175.0171 17 M 3.9304 7.8230 121.1913 56.4258 32.3199 175.5546 18 D 4.4310 8.0055 117.5021 56.0264 40.8984 175.7027 19 G 3.9455 9.4080 115.5580 45.3736 0.0000 171.1623 20 Y 4.2614 8.1950 121.9822 58.7884 38.9558 176.4879 21 R 3.6784 8.9821 127.0037 57.3241 27.7559 177.2425 22 G 3.7964 8.1530 103.1371 45.7686 0.0000 174.0288 23 I 4.0635 7.5470 122.0170 59.0893 37.7200 175.9251 24 S 4.6438 8.3020 120.3534 57.7028 63.8675 175.0113 25 L 4.2400 8.8621 122.6276 58.4542 41.7408 179.0529 26 A 4.1381 7.6783 118.7690 55.2097 18.1810 179.4594 27 N 4.4210 8.1025 114.9845 56.3767 38.5688 177.6983 28 W 4.2102 8.0453 119.8666 59.9708 29.0697 178.3734 29 M 4.1757 8.5371 118.9644 58.6061 31.4669 177.9586 30 C 3.2154 8.2042 118.7234 59.0257 43.6629 175.4120 31 L 3.9775 8.2087 121.9438 58.2902 41.7973 178.8691 32 A 4.1888 8.5240 121.0507 54.8627 18.2737 179.4927 33 K 2.7895 8.2432 118.3257 59.3662 32.0809 179.1971 34 W 4.2632 7.7468 117.2605 59.2093 29.0414 178.2687 35 E 4.3705 8.4315 118.9345 58.7312 29.1562 177.8431 36 S 4.5046 7.7696 107.8264 57.0505 65.4241 173.9858 37 G 3.3928 8.1572 108.9960 46.9972 0.0000 173.3046 38 Y 3.6353 7.6290 113.4556 58.7205 34.9112 168.7742 39 N 5.2794 7.7963 119.0860 52.0132 40.0594 175.3218 40 T 4.2079 9.0351 117.9382 63.7022 69.9206 175.8906 41 R 4.6326 8.0249 116.9390 55.7414 30.4517 176.5782 42 A 4.3547 7.8048 122.6907 52.7268 19.3836 177.2444 43 T 5.0108 8.3424 110.9379 60.0225 72.5442 173.0333 44 N 4.8787 8.7862 121.8034 52.2754 41.8767 172.5184 45 Y 4.6636 8.7416 127.8780 57.3163 40.8948 173.8763 46 N 4.6833 8.3097 124.1958 51.0299 39.1804 175.1256 47 A 3.7018 8.3252 127.6114 54.7615 18.9991 179.2991 48 G 3.7044 8.1159 104.3154 48.2372 0.0000 174.0307 49 D 4.7340 7.6367 115.5366 52.0477 39.8995 175.9427 50 R 3.8886 8.1030 116.2645 57.0012 28.1061 175.8812 51 S 4.9154 7.5435 113.0865 57.2282 66.2833 172.7068 52 T 5.1390 8.8368 115.3810 62.0240 72.9521 172.9349 53 D 5.4578 9.0684 125.0361 53.2163 43.3017 175.1205 54 Y 5.0653 9.1332 120.5239 57.5236 41.8543 177.2236 55 G 4.4577 9.0084 111.6930 46.2485 0.0000 173.4991 56 I 3.6866 8.2677 117.4164 63.3406 37.9519 177.4141 57 F 4.7660 7.9098 115.6974 56.4116 40.0766 175.0594 58 Q 3.6384 7.8926 119.2580 57.1107 26.5322 174.1492 59 I 4.3675 8.1058 118.9714 61.1298 39.2181 176.9838 60 N 5.3787 9.1900 126.0675 53.4845 39.7865 175.7104 61 S 4.5756 9.1814 120.4431 60.7082 63.4286 175.4184 62 R 3.7752 8.7602 122.3457 58.7996 30.2768 177.7300 63 Y 4.4929 7.7909 114.0400 57.3090 40.6103 176.8228 64 W 4.9453 8.1147 119.0226 57.7052 31.1647 173.9247 65 C 5.6153 8.1616 111.4738 53.7495 46.0316 172.9019 66 N 5.0219 9.1535 119.3072 51.9964 40.2767 174.7253 67 D 4.8689 8.6735 123.6666 52.1942 40.3407 177.8793 68 G 4.0279 8.5270 107.1753 46.3172 0.0000 174.6083 69 K 4.4809 8.0891 116.5289 56.5659 33.0997 175.6922 70 T 4.4758 7.7065 117.3095 61.2384 69.5293 172.2491 71 P 4.2029 0.0000 0.0000 64.2424 31.7085 176.0496 72 G 3.9171 8.9333 109.0820 46.1744 0.0000 173.0545 73 A 4.2445 7.4549 120.0128 51.7685 19.2627 177.5062 74 V 4.3263 8.3739 112.4705 59.2505 35.5665 176.1157 75 N 4.9273 8.0043 117.0687 51.8977 37.6061 174.4326 76 A 3.9373 8.8916 125.1272 54.9528 19.1000 178.5155 77 C 4.5718 8.6132 111.1370 57.3614 41.1514 173.0433 78 H 4.0850 7.9850 116.6043 56.5636 26.3992 173.9509 79 L 4.8196 8.4061 117.8141 52.9502 46.5440 176.6065 80 S 4.7131 8.3344 115.0322 57.9031 63.2968 176.0125 81 C 4.0650 8.6844 124.0290 59.7732 40.8063 176.3772 82 S 3.8807 7.8851 114.8118 61.3486 61.6383 176.0273 83 A 4.0706 7.8328 122.3642 54.3987 18.2155 178.4977 84 L 4.4828 7.9296 116.4663 54.9405 41.6163 177.5832 85 L 5.0483 7.6233 117.7610 54.5187 42.4013 176.6995 86 Q 4.3664 7.8366 117.7250 55.3406 29.5808 175.9612 87 D 4.4265 8.5587 120.1465 57.2055 41.1381 176.9305 88 N 4.5607 8.0317 118.1311 53.3073 39.3503 174.7249 89 I 4.2131 8.4603 118.5374 60.9042 37.9825 176.9565 90 A 3.9373 8.3678 124.7284 56.0918 18.1822 180.0020 91 D 4.2673 8.0895 116.3056 57.4230 40.8810 178.7411 92 A 4.1117 7.9634 120.9129 55.0284 18.3608 179.7808 93 V 3.4058 8.1638 116.9340 66.0357 31.6850 178.0341 94 A 3.8253 8.1074 120.7716 55.3732 18.0912 178.8559 95 C 4.2474 8.3934 116.6739 59.6746 38.8063 175.5941 96 A 3.9548 8.3280 122.8308 55.0427 17.5961 179.7975 97 K 3.8285 7.7255 116.4345 59.4594 32.1960 179.1686 98 R 4.0894 7.7753 118.5394 59.3044 30.0747 178.5137 99 V 2.4133 7.5434 118.0543 65.8721 30.9648 178.1399 100 V 3.8835 7.7251 109.9959 62.8905 31.2257 178.0246 101 R 4.2150 7.6066 117.4505 57.1490 30.4994 176.4745 102 D 4.7245 7.5258 119.4082 52.6128 41.9287 175.3881 103 P 4.1960 0.0000 0.0000 66.3642 31.0147 177.7934 104 Q 4.0062 8.1826 117.8536 56.3355 29.9607 177.2892 105 G 3.8901 7.9276 106.9767 46.8246 0.0000 176.2535 106 I 3.4590 7.7943 120.4446 63.5561 37.8951 177.7865 107 R 4.2531 7.1584 117.6205 57.6299 29.9393 177.4620 108 A 4.0489 7.6763 121.2358 54.1892 18.7547 177.6972 109 W 4.6892 8.0864 117.0737 55.4954 29.7913 177.5325 110 V 3.7381 8.7322 123.7249 65.9897 30.9494 177.6452 111 A 4.0128 8.2818 120.1946 54.7309 18.1302 179.2622 112 W 3.9706 8.2986 126.7331 60.7012 30.6019 178.3889 113 R 3.7168 8.2488 116.2174 59.2720 29.6358 178.4236 114 N 4.3543 8.2238 115.2047 55.8299 38.7551 176.9264 115 R 4.1192 7.7397 115.4199 55.8597 31.3850 175.8136 116 C 4.5272 7.6810 115.7960 57.8677 42.7091 174.4803 117 Q 3.2906 6.4145 119.0670 57.2181 28.7229 175.2239 118 N 4.1802 8.6246 120.3344 54.2133 36.3062 173.8941 119 R 4.4757 7.3719 115.4092 54.1508 32.7639 176.0002 120 D 4.5692 8.4053 119.1527 53.9933 40.1707 176.1033 121 V 4.5821 8.1576 118.8300 61.2925 32.6949 178.3168 122 R 4.0297 8.0129 120.7083 59.5857 29.6685 178.5802 123 Q 4.0238 8.0547 115.4348 59.3924 28.3577 178.0435 124 Y 4.3198 7.9508 117.9233 59.9205 38.2450 176.7906 125 V 4.4006 7.7650 110.9487 60.6941 32.8687 175.4249 126 Q 4.1894 7.9831 120.2474 57.2706 28.8165 176.9507 127 G 3.9613 8.9155 110.3892 45.9811 0.0000 174.5185 128 C 4.4027 8.0767 115.9302 56.8528 40.5585 174.3408 129 G 3.9063 8.1408 107.2160 46.3019 0.0000 174.2051 130 V 3.9841 7.7853 118.0397 61.1073 31.8895 175.8333 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 4.18 0.00 1.99 1.62 0.00 1.24 0.00 0.00 0.94 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 1.13 7.81 2 V 8.13 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 10.10 4.45 0.00 2.84 2.83 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 4 E 9.17 4.24 0.00 1.95 1.86 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 2.31 2.25 0.00 5 R 8.98 3.30 0.00 1.95 1.91 0.00 3.43 0.00 0.00 3.45 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 6 C 8.00 4.31 0.00 3.00 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 8.17 3.89 0.00 2.05 2.25 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 2.57 2.42 0.00 8 L 8.06 3.67 0.00 1.43 1.39 -0.26 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 9 S 7.86 4.10 0.00 4.13 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 10 R 7.98 3.96 0.00 1.91 2.01 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.78 3.85 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 1.22 0.00 0.00 12 L 8.13 3.85 0.00 1.73 1.58 0.92 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.11 3.90 0.00 1.97 1.92 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.14 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 7.99 3.98 0.00 2.02 1.97 0.00 3.21 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 15 L 7.40 4.36 0.00 1.65 1.56 0.87 0.80 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 16 G 7.88 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 0.00 0.00 0.00 17 M 7.82 3.93 0.00 1.31 1.96 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.20 0.00 18 D 8.01 4.43 0.00 2.67 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 19 G 9.41 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 20 Y 8.19 4.26 0.00 3.34 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 21 R 8.98 3.68 0.00 1.89 1.84 0.00 3.23 0.00 0.00 2.96 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.36 0.00 22 G 8.15 3.80 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 0.00 0.00 0.00 23 I 7.55 4.06 1.83 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.57 -0.26 0.00 0.00 24 S 8.30 4.64 0.00 4.06 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.86 4.24 0.00 2.04 1.81 0.98 1.04 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 26 A 7.68 4.14 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.10 4.42 0.00 2.73 2.75 0.00 0.00 6.96 8.80 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 28 W 8.05 4.21 0.00 3.52 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 29 M 8.54 4.18 0.00 2.17 2.38 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.92 0.00 30 C 8.20 3.22 0.00 2.55 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 8.21 3.98 0.00 1.85 1.85 0.64 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.52 4.19 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.24 2.79 0.00 1.61 1.70 0.00 0.66 0.00 0.00 0.92 0.00 0.00 2.56 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.16 0.30 7.81 34 W 7.75 4.26 0.00 3.43 3.25 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 35 E 8.43 4.37 0.00 2.03 2.11 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 2.59 2.59 0.00 36 S 7.77 4.50 0.00 4.04 3.89 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 37 G 8.16 3.39 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 0.00 38 Y 7.63 3.64 0.00 3.33 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 39 N 7.80 5.28 0.00 2.78 2.85 0.00 0.00 7.01 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 40 T 9.04 4.21 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 1.48 0.00 0.00 41 R 8.02 4.63 0.00 1.91 2.08 0.00 3.08 0.00 0.00 3.24 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.59 0.00 42 A 7.80 4.35 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 8.34 5.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 44 N 8.79 4.88 0.00 2.91 2.85 0.00 0.00 6.83 6.84 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 45 Y 8.74 4.66 0.00 2.98 2.83 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 46 N 8.31 4.68 0.00 2.61 2.58 0.00 0.00 6.72 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 47 A 8.33 3.70 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 8.12 3.70 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 0.00 0.00 0.00 49 D 7.64 4.73 0.00 2.71 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 50 R 8.10 3.89 0.00 2.03 2.19 0.00 3.13 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.53 0.00 51 S 7.54 4.92 0.00 3.84 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 8.84 5.14 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 0.63 0.00 0.00 53 D 9.07 5.46 0.00 2.71 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 54 Y 9.13 5.07 0.00 2.93 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 9.01 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 56 I 8.27 3.69 1.67 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.72 0.05 0.00 0.00 57 F 7.91 4.77 0.00 3.21 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 58 Q 7.89 3.64 0.00 2.55 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.72 0.00 59 I 8.11 4.37 2.15 0.00 0.00 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 1.37 1.20 1.14 0.00 0.00 60 N 9.19 5.38 0.00 3.08 3.03 0.00 0.00 6.98 7.34 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 61 S 9.18 4.58 0.00 4.06 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 0.00 62 R 8.76 3.78 0.00 1.62 1.39 0.00 2.68 0.00 0.00 2.83 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.96 0.00 63 Y 7.79 4.49 0.00 1.67 1.95 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 64 W 8.11 4.95 0.00 3.58 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 65 C 8.16 5.62 0.00 3.02 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 66 N 9.15 5.02 0.00 2.81 2.69 0.00 0.00 7.09 8.12 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 67 D 8.67 4.87 0.00 2.97 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 68 G 8.53 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.09 4.48 0.00 1.88 1.89 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.46 7.81 70 T 7.71 4.48 4.23 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 1.16 0.00 0.00 71 P 0.00 4.20 0.00 2.01 2.00 0.00 3.82 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.93 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 73 A 7.45 4.24 1.24 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 0.00 0.00 74 V 8.37 4.33 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 0.62 0.00 0.00 0.84 0.00 0.00 75 N 8.00 4.93 0.00 2.74 2.56 0.00 0.00 6.77 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 76 A 8.89 3.94 1.24 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 0.00 0.00 77 C 8.61 4.57 0.00 3.31 3.25 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 78 H 7.98 4.09 0.00 3.28 3.36 0.00 5.80 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 8.41 4.82 0.00 1.66 1.50 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.33 4.71 0.00 3.83 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 8.68 4.07 0.00 2.22 1.21 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 82 S 7.89 3.88 0.00 3.88 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 7.83 4.07 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.93 4.48 0.00 1.91 1.82 1.06 0.54 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 85 L 7.62 5.05 0.00 1.78 1.72 1.13 0.99 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 86 Q 7.84 4.37 0.00 2.26 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.56 7.08 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 87 D 8.56 4.43 0.00 2.62 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 88 N 8.03 4.56 0.00 2.69 2.74 0.00 0.00 6.94 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 8.46 4.21 1.74 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.66 0.94 0.00 0.00 90 A 8.37 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 8.09 4.27 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 7.96 4.11 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 93 V 8.16 3.41 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 0.78 0.00 0.00 0.87 0.00 0.00 94 A 8.11 3.83 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 95 C 8.39 4.25 0.00 3.17 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 96 A 8.33 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.73 3.83 0.00 1.63 1.43 0.00 1.27 0.00 0.00 0.65 0.00 0.00 2.33 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.30 0.93 7.81 98 R 7.78 4.09 0.00 1.99 2.16 0.00 3.31 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.00 0.00 99 V 7.54 2.41 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 -0.19 0.00 0.00 -0.54 0.00 0.00 100 V 7.73 3.88 2.13 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 1.17 0.00 0.00 1.43 0.00 0.00 101 R 7.61 4.21 0.00 2.00 2.05 0.00 3.26 0.00 0.00 3.32 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.11 0.00 102 D 7.53 4.72 0.00 3.09 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 0.00 103 P 0.00 4.20 0.00 2.15 2.21 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 104 Q 8.18 4.01 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.79 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.93 3.89 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 0.00 0.00 0.00 106 I 7.79 3.46 0.99 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.66 0.00 0.00 107 R 7.16 4.25 0.00 1.99 2.02 0.00 3.20 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.56 0.00 108 A 7.68 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.09 4.69 0.00 3.51 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 0.00 110 V 8.73 3.74 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 1.19 0.00 0.00 0.99 0.00 0.00 111 A 8.28 4.01 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.30 3.97 0.00 3.49 3.51 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 0.00 113 R 8.25 3.72 0.00 2.10 2.00 0.00 3.63 0.00 0.00 3.53 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.14 0.00 114 N 8.22 4.35 0.00 2.66 2.70 0.00 0.00 6.94 8.27 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 0.00 115 R 7.74 4.12 0.00 0.75 0.76 0.00 2.81 0.00 0.00 2.85 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.81 0.00 116 C 7.68 4.53 0.00 1.53 2.65 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 0.00 0.00 0.00 0.00 117 Q 6.41 3.29 0.00 0.93 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.83 0.00 0.00 0.00 0.00 0.00 2.15 2.26 0.00 118 N 8.62 4.18 0.00 2.79 2.81 0.00 0.00 6.90 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 7.37 4.48 0.00 1.86 1.81 0.00 3.24 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 120 D 8.41 4.57 0.00 2.64 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 8.16 4.58 2.39 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 0.95 0.00 0.00 1.06 0.00 0.00 122 R 8.01 4.03 0.00 2.04 2.03 0.00 3.16 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 123 Q 8.05 4.02 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.11 0.00 0.00 0.00 0.00 0.00 2.08 1.65 0.00 124 Y 7.95 4.32 0.00 3.24 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 7.76 4.40 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 0.99 0.00 0.00 1.05 0.00 0.00 126 Q 7.98 4.19 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.78 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 127 G 8.92 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 8.08 4.40 0.00 3.10 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 8.14 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 0.00 0.00 0.00 130 V 7.79 3.98 2.11 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 0.80 0.00 0.00 0.96 0.00 0.00