NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3840 8.3044 120.3494 54.8415 33.3560 174.9098 2 I 3.6127 8.4188 126.3006 61.3718 38.7249 173.1716 3 Q 4.8538 8.3227 124.6842 54.2116 33.8793 173.6935 4 S 5.1555 8.5744 115.6480 56.8832 66.4478 173.0307 5 Q 4.8042 8.8425 120.4118 54.6179 30.1095 175.8413 6 I 4.3420 8.4677 112.9866 60.2782 39.1337 174.7780 7 N 4.8900 7.8211 120.2395 51.0200 40.8698 174.7675 8 R 3.9654 8.6242 123.5930 59.3127 29.3696 178.3648 9 N 4.3329 8.6252 117.4149 55.9799 38.4235 177.2761 10 I 3.6824 7.4297 121.1675 64.6788 37.2326 178.7326 11 R 4.0286 7.8925 118.0779 58.9319 29.9824 178.9714 12 L 4.0166 8.1520 119.2713 57.6405 41.6130 179.0750 13 D 4.3560 8.4766 119.4297 57.2167 40.6538 178.5283 14 L 3.9325 7.9589 120.5870 57.9847 41.9937 178.7044 15 A 4.1108 8.1479 120.8952 55.4270 18.2815 179.2815 16 D 4.2905 8.1099 116.9395 57.4951 40.9043 178.9564 17 A 3.9865 7.9627 121.0996 55.1943 18.3685 179.6551 18 I 3.6529 8.0217 118.5436 64.6887 37.2261 178.7213 19 L 4.0676 8.2362 119.9601 57.4848 41.3095 179.4438 20 L 3.9168 7.9602 120.4434 58.0857 42.0864 178.7832 21 S 4.0336 8.1069 113.1216 61.3490 62.2315 175.8090 22 K 3.7304 8.3872 122.3740 59.6054 31.8294 178.4983 23 A 3.9097 8.0519 120.6758 55.1683 18.1276 179.6295 24 K 3.8798 8.1312 116.1393 59.3273 32.2401 178.7847 25 K 4.1988 8.0387 115.4911 55.2668 33.1347 175.9006 26 D 4.2711 7.5626 118.3198 55.1219 40.0557 172.8578 27 L 4.7777 7.9029 117.5053 53.5074 44.1828 177.4098 28 S 4.6636 8.5067 116.0379 56.7851 66.4633 175.5010 29 F 4.1975 8.3958 121.3615 60.5375 38.6446 177.8249 30 A 4.0623 8.0920 120.3224 55.2518 18.1022 179.3999 31 E 3.9995 8.1821 114.8469 59.4773 29.8137 178.9830 32 I 3.8277 7.7420 119.9129 64.2121 37.5925 177.9508 33 A 4.2001 8.3646 121.5962 53.5902 18.2568 177.3204 34 D 4.4665 7.4659 117.3286 56.1082 41.5532 176.6597 35 G 4.0118 9.0618 114.8023 45.5498 0.0000 173.9311 36 T 4.0097 7.9481 113.7357 62.3699 67.6499 176.4457 37 G 3.8571 8.2322 107.3744 45.4093 0.0000 172.9584 38 L 4.6285 7.0035 118.6236 52.3892 44.0221 176.9247 39 A 4.1463 8.2624 123.2121 52.0046 20.2139 178.3376 40 E 3.8888 8.9299 123.2236 59.6572 29.7036 179.4766 41 A 3.9197 7.9684 120.0500 54.9606 18.4797 179.3232 42 F 3.9254 8.0233 118.6810 61.4114 39.7048 177.4100 43 V 3.6404 8.1335 117.9947 66.3006 31.3361 178.0478 44 T 3.8031 8.1688 115.3516 66.6044 68.2456 176.2172 45 A 3.8365 7.8676 122.3317 55.1380 18.3004 179.4193 46 A 4.1525 7.5936 120.2233 54.8732 18.2509 179.8223 47 L 3.9981 7.7426 115.8765 57.5894 41.7387 178.8400 48 L 4.4858 7.5940 116.2214 54.4312 41.7809 177.4586 49 G 3.9308 8.1168 107.4492 45.5071 0.0000 174.2913 50 Q 4.4957 8.1240 116.6005 55.5434 29.8777 175.0506 51 Q 4.3934 7.4208 115.9160 54.3862 32.9573 172.5851 52 A 4.9131 8.2521 120.8148 50.3635 21.0077 176.4578 53 L 4.5621 8.7464 122.7629 53.3034 43.3953 175.2027 54 P 4.4868 0.0000 0.0000 62.5042 32.4811 177.3017 55 A 3.9738 8.8446 123.3696 55.7065 18.2889 179.9416 56 D 4.2801 8.1055 116.5260 57.5148 40.8871 178.7623 57 A 4.0149 8.0318 120.5600 54.9391 18.3823 179.3110 58 A 3.9461 8.2820 119.4754 55.4831 18.5205 180.0635 59 R 3.8599 8.1772 116.6532 59.1868 30.1188 179.0923 60 L 3.9318 8.0555 120.0058 58.4662 42.1988 179.5754 61 V 3.7969 8.1907 112.6992 64.1231 31.4073 178.8107 62 G 3.6251 8.3689 105.6318 47.7142 0.0000 175.6316 63 A 4.0077 8.0808 123.2200 54.9309 18.2289 179.8911 64 K 3.9571 7.8847 115.7380 58.8621 32.2059 178.5468 65 L 4.4157 7.7178 116.1803 53.3481 42.6998 175.7622 66 D 4.4017 7.6811 117.2275 55.2704 38.5598 173.9727 67 L 4.3869 8.1480 118.3049 53.8723 43.1393 177.6915 68 D 4.7059 8.2529 121.7698 52.8129 41.9313 177.3405 69 E 3.9923 8.5502 118.5490 59.6112 29.3024 179.3266 70 D 4.3820 8.1018 118.5709 57.2597 40.9310 178.8756 71 S 4.1019 8.7855 116.1512 61.7210 62.6771 176.5851 72 I 3.7154 7.5996 121.0975 64.4182 37.1172 177.9543 73 L 4.2557 8.1240 121.0374 58.1202 41.9531 178.9204 74 L 3.9962 8.2781 119.3529 57.8863 41.5005 179.4309 75 L 4.0257 8.0839 118.6539 57.5379 41.3041 178.8412 76 Q 4.6124 7.6551 117.1474 55.5124 29.4327 175.9972 77 M 4.4973 7.3401 120.2842 54.9366 33.0706 176.3954 78 I 4.0267 8.8066 124.6635 60.7829 38.1187 174.2716 79 P 4.7135 0.0000 0.0000 62.2035 32.8942 176.2504 80 L 4.3278 8.3025 123.2244 54.1047 41.4741 176.4530 81 R 4.1788 8.2863 124.9359 55.7575 30.8611 175.1936 82 G 3.0183 8.2009 108.8765 45.0022 0.0000 173.0141 83 C 4.2691 8.0189 122.8384 59.4003 30.6579 174.7777 84 I 3.9673 7.5441 121.8149 60.5786 37.4399 174.8963 85 D 4.4565 8.8991 125.6773 57.0665 41.6019 176.4673 86 D 4.6423 7.2664 114.8208 53.0482 41.3954 173.9991 87 R 4.2662 8.1787 127.0586 56.5691 29.2552 177.1414 88 I 4.0139 7.1666 116.3135 58.2705 38.9708 173.9322 89 P 4.4183 0.0000 0.0000 62.9436 31.8227 176.4923 90 T 4.1768 8.3519 111.5413 63.5932 69.8829 175.6176 91 D 4.4968 7.9540 121.9898 53.2334 42.7225 174.7413 92 P 4.3265 0.0000 0.0000 66.1325 31.1901 178.9344 93 T 3.9435 7.9754 113.0329 66.9739 68.6646 176.2364 94 M 4.4387 8.1536 120.6947 58.5581 32.0010 177.9166 95 Y 3.9607 8.7946 120.1282 61.1076 38.8463 178.2591 96 Q 4.0242 8.1832 118.5661 59.1941 28.4746 179.3174 97 F 4.0200 7.8922 118.5268 60.4026 38.9774 176.9486 98 Y 4.0074 7.9873 118.7691 60.7850 38.5564 177.7009 99 E 3.7107 8.0780 120.4045 59.4670 29.5618 178.4539 100 M 4.1197 8.1216 118.7880 58.6502 32.0091 178.8152 101 L 3.9445 7.4505 118.6697 57.8595 41.5512 179.5428 102 Q 3.7942 7.4647 116.9935 58.4554 28.5898 178.5732 103 V 3.7225 7.5389 118.2371 64.8267 32.2290 176.7527 104 Y 4.7052 8.0394 113.9597 57.3246 38.5525 177.6677 105 G 3.6973 8.2106 109.0331 48.3095 0.0000 176.1340 106 T 3.9810 7.8437 112.1814 64.4883 68.7615 176.6621 107 T 3.8968 7.8948 118.1765 66.4139 68.5139 176.2883 108 L 3.9898 8.4984 121.2981 57.6734 41.6553 179.4705 109 K 3.7897 8.1533 119.0606 59.4779 32.2052 178.4718 110 A 4.0417 8.2105 121.1455 55.4725 18.2759 179.6837 111 L 4.0257 8.2945 117.6159 57.5914 41.5925 179.8502 112 V 3.8112 8.1101 118.6762 66.4963 31.0054 177.8905 113 H 4.9671 8.2379 117.2991 58.2475 28.2712 177.4903 114 E 3.9431 8.1436 120.3304 59.3785 29.6434 178.8125 115 K 3.9317 8.2712 117.4808 58.4125 32.1054 178.0162 116 F 4.2935 9.1123 115.3093 60.3127 41.1945 175.5255 117 G 4.1129 7.2960 101.8561 44.1648 0.0000 172.0594 118 D 4.6478 8.6152 119.3479 54.8906 42.3789 174.8151 119 G 4.1908 8.0530 111.1288 45.1336 0.0000 172.7170 120 I 4.7831 8.5869 115.8682 59.2166 41.7312 174.9213 121 I 4.5801 8.1733 124.2833 60.3115 37.9143 175.6371 122 S 4.2941 9.0363 123.5363 58.1585 62.6014 173.9071 123 A 3.6818 8.6330 128.4904 52.7131 18.9247 177.4635 124 I 4.2074 7.6995 116.0939 63.1042 38.5468 176.9718 125 N 4.7850 7.7627 123.4862 52.1760 37.8658 171.9306 126 F 5.4656 8.0553 123.1765 56.4534 42.8492 172.5581 127 K 4.5457 8.2737 123.8280 55.0423 36.3205 174.8042 128 L 5.6240 8.1653 119.7300 53.6993 43.8303 174.7686 129 D 4.7453 8.3039 117.6856 52.2753 43.0308 173.8994 130 V 4.7740 8.3166 119.3321 61.1945 33.8960 174.6586 131 K 4.7172 8.9492 127.0645 54.4226 35.5729 174.9212 132 K 4.9607 8.6083 124.9659 55.1420 33.6907 175.6552 133 V 4.5805 8.7724 126.6713 60.5987 34.9909 174.4728 134 A 4.3508 8.7011 129.1105 52.1150 19.3304 176.3340 135 D 4.5716 8.9902 122.2106 52.4744 41.8190 175.4541 136 P 4.2939 0.0000 0.0000 65.6680 31.4262 176.7802 137 E 4.3319 8.6228 115.8109 55.9592 29.4831 176.7783 138 G 3.9142 8.2979 107.6370 46.6145 0.0000 175.8855 139 G 3.8403 8.9218 108.7935 44.2602 0.0000 171.7426 140 E 5.1622 8.4077 116.9414 54.7060 33.5862 175.4854 141 R 4.8265 9.3167 120.2244 54.3971 34.3748 174.2121 142 A 5.0474 8.5642 122.8732 50.3930 21.2481 176.4379 143 V 4.1924 8.9924 123.5351 61.4416 33.3477 174.4209 144 I 4.9209 8.3855 129.3531 59.9952 39.1118 175.3588 145 T 4.4741 8.7383 124.8111 61.9698 70.3027 173.7186 146 L 4.7720 8.5534 127.2161 53.3180 43.3612 175.9053 147 D 4.7396 8.7660 124.7961 52.2689 43.0487 174.3268 148 G 4.6725 8.4705 111.7979 43.6610 0.0000 170.5845 149 K 4.2986 8.8704 124.9539 56.2370 33.2704 175.2738 150 Y 4.7393 8.6534 128.4686 57.4448 40.2429 173.7265 151 L 4.6967 8.7215 127.2949 51.9786 44.2526 174.3163 152 P 4.5551 0.0000 0.0000 62.8002 32.7156 175.9601 153 T 4.5023 8.6608 119.1441 62.2805 69.7887 174.1666 154 K 4.6859 8.4771 125.5074 53.5163 35.2532 174.6024 155 P 4.5268 0.0000 0.0000 62.7632 32.0261 176.7216 156 F 4.5292 7.8155 114.0138 57.3074 37.8659 174.4034 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 4.38 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.42 3.61 1.88 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 1.42 1.05 0.91 0.00 0.00 3 Q 8.32 4.85 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.51 2.27 0.00 4 S 8.57 5.16 0.00 3.81 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 5 Q 8.84 4.80 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 6 I 8.47 4.34 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 1.30 0.67 0.91 0.00 0.00 7 N 7.82 4.89 0.00 2.76 2.67 0.00 0.00 6.95 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 8 R 8.62 3.97 0.00 2.06 2.29 0.00 3.12 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 9 N 8.63 4.33 0.00 2.88 2.91 0.00 0.00 6.85 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 10 I 7.43 3.68 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 1.52 1.16 0.91 0.00 0.00 11 R 7.89 4.03 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.50 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.15 4.02 0.00 1.68 1.71 0.91 0.85 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 13 D 8.48 4.36 0.00 2.93 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 14 L 7.96 3.93 0.00 1.78 1.84 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.15 4.11 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.11 4.29 0.00 2.94 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 17 A 7.96 3.99 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 18 I 8.02 3.65 2.05 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 1.53 0.69 0.95 0.00 0.00 19 L 8.24 4.07 0.00 1.85 1.75 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.96 3.92 0.00 1.77 1.81 0.92 0.89 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 21 S 8.11 4.03 0.00 3.92 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 22 K 8.39 3.73 0.00 1.79 1.91 0.00 1.13 0.00 0.00 1.19 0.00 0.00 2.30 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.24 7.81 23 A 8.05 3.91 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 24 K 8.13 3.88 0.00 1.86 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.66 7.81 25 K 8.04 4.20 0.00 1.69 1.81 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.56 7.81 26 D 7.56 4.27 0.00 2.75 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 27 L 7.90 4.78 0.00 1.68 1.43 0.97 1.02 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 28 S 8.51 4.66 0.00 4.03 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 29 F 8.40 4.20 0.00 3.20 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 30 A 8.09 4.06 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 31 E 8.18 4.00 0.00 2.13 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 0.00 2.55 2.32 0.00 32 I 7.74 3.83 1.91 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 1.43 0.56 0.96 0.00 0.00 33 A 8.36 4.20 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 34 D 7.47 4.47 0.00 2.81 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 35 G 9.06 4.01 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 0.00 0.00 0.00 36 T 7.95 4.01 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 1.39 0.00 0.00 37 G 8.23 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 0.00 0.00 0.00 38 L 7.00 4.63 0.00 1.55 1.66 1.06 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.26 4.15 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 40 E 8.93 3.89 0.00 2.08 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 2.44 2.47 0.00 41 A 7.97 3.92 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 42 F 8.02 3.93 0.00 3.18 3.21 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 43 V 8.13 3.64 2.16 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 1.05 0.00 0.00 1.09 0.00 0.00 44 T 8.17 3.80 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 0.48 0.00 0.00 45 A 7.87 3.84 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 46 A 7.59 4.15 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 47 L 7.74 4.00 0.00 1.87 1.85 1.14 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.59 4.49 0.00 1.67 1.64 0.75 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.12 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 0.00 0.00 0.00 50 Q 8.12 4.50 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.58 6.63 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 51 Q 7.42 4.39 0.00 1.50 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.89 0.00 0.00 0.00 0.00 0.00 1.99 1.34 0.00 52 A 8.25 4.91 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 53 L 8.75 4.56 0.00 1.65 1.65 0.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.49 0.00 2.10 1.99 0.00 3.71 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 55 A 8.84 3.97 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 56 D 8.11 4.28 0.00 2.71 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 57 A 8.03 4.01 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 58 A 8.28 3.95 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 59 R 8.18 3.86 0.00 2.01 2.00 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 60 L 8.06 3.93 0.00 1.92 1.77 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.19 3.80 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 0.76 0.00 0.00 1.03 0.00 0.00 62 G 8.37 3.63 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 0.00 0.00 0.00 63 A 8.08 4.01 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 64 K 7.88 3.96 0.00 1.93 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.61 7.81 65 L 7.72 4.42 0.00 1.72 1.68 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.68 4.40 0.00 2.85 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.15 4.39 0.00 1.59 1.59 0.93 0.99 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 68 D 8.25 4.71 0.00 2.95 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 69 E 8.55 3.99 0.00 2.00 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 0.00 2.40 2.34 0.00 70 D 8.10 4.38 0.00 2.72 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 71 S 8.79 4.10 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 72 I 7.60 3.72 1.88 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 1.56 0.54 0.99 0.00 0.00 73 L 8.12 4.26 0.00 1.85 1.91 0.93 0.54 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 74 L 8.28 4.00 0.00 1.89 1.70 0.92 0.55 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 75 L 8.08 4.03 0.00 1.89 1.74 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.66 4.61 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.87 0.00 0.00 0.00 0.00 0.00 2.56 2.39 0.00 77 M 7.34 4.50 0.00 1.91 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.52 0.00 78 I 8.81 4.03 1.88 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 1.43 0.97 0.92 0.00 0.00 79 P 0.00 4.71 0.00 2.14 2.01 0.00 3.75 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 1.95 1.92 0.00 80 L 8.30 4.33 0.00 1.81 1.65 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.29 4.18 0.00 1.82 1.88 0.00 3.24 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 82 G 8.20 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 0.00 0.00 0.00 83 C 8.02 4.27 0.00 3.06 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 84 I 7.54 3.97 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 1.29 0.52 0.92 0.00 0.00 85 D 8.90 4.46 0.00 2.63 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 86 D 7.27 4.64 0.00 2.59 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.18 4.27 0.00 1.98 2.05 0.00 3.21 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 88 I 7.17 4.01 1.75 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.73 0.63 0.00 0.00 89 P 0.00 4.42 0.00 2.18 2.04 0.00 3.37 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 90 T 8.35 4.18 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 1.20 0.00 0.00 91 D 7.95 4.50 0.00 2.85 2.64 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 92 P 0.00 4.33 0.00 2.24 2.13 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 93 T 7.98 3.94 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 94 M 8.15 4.44 0.00 2.11 2.31 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.59 0.00 95 Y 8.79 3.96 0.00 3.22 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 Q 8.18 4.02 0.00 1.83 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 97 F 7.89 4.02 0.00 3.32 3.12 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 0.00 0.00 0.00 98 Y 7.99 4.01 0.00 2.91 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 99 E 8.08 3.71 0.00 1.96 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 2.30 2.38 0.00 100 M 8.12 4.12 0.00 2.14 2.33 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.59 0.00 101 L 7.45 3.94 0.00 1.51 1.55 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.46 3.79 0.00 1.95 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.89 0.00 0.00 0.00 0.00 0.00 1.68 2.32 0.00 103 V 7.54 3.72 1.91 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 0.23 0.00 0.00 0.90 0.00 0.00 104 Y 8.04 4.71 0.00 3.25 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 0.00 105 G 8.21 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 0.00 106 T 7.84 3.98 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 1.21 0.00 0.00 107 T 7.89 3.90 4.62 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 1.34 0.00 0.00 108 L 8.50 3.99 0.00 1.84 1.74 0.95 1.03 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 0.00 109 K 8.15 3.79 0.00 1.83 1.99 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.47 7.81 110 A 8.21 4.04 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 0.00 111 L 8.29 4.03 0.00 1.78 1.75 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.11 3.81 2.22 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 1.08 0.00 0.00 1.00 0.00 0.00 113 H 8.24 4.97 0.00 3.26 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.14 3.94 0.00 2.06 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 2.29 2.34 0.00 115 K 8.27 3.93 0.00 1.65 1.19 0.00 1.72 0.00 0.00 1.57 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.49 7.81 116 F 9.11 4.29 0.00 2.35 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 G 7.30 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.62 4.65 0.00 2.76 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 0.00 119 G 8.05 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 0.00 0.00 0.00 0.00 120 I 8.59 4.78 1.85 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 1.17 0.99 0.91 0.00 0.00 121 I 8.17 4.58 1.81 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.66 0.96 0.00 0.00 122 S 9.04 4.29 0.00 3.89 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 0.00 123 A 8.63 3.68 0.99 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 0.00 0.00 124 I 7.70 4.21 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 1.16 0.92 0.93 0.00 0.00 125 N 7.76 4.79 0.00 2.80 2.75 0.00 0.00 6.47 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 0.00 126 F 8.06 5.47 0.00 3.13 2.96 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 0.00 127 K 8.27 4.55 0.00 1.63 1.66 0.00 1.22 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.12 1.17 7.81 128 L 8.17 5.62 0.00 1.67 1.27 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.30 4.75 0.00 2.66 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 0.00 130 V 8.32 4.77 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 0.88 0.00 0.00 0.90 0.00 0.00 131 K 8.95 4.72 0.00 1.73 1.65 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.51 7.81 132 K 8.61 4.96 0.00 1.78 1.72 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.44 7.81 133 V 8.77 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 0.72 0.00 0.00 0.94 0.00 0.00 134 A 8.70 4.35 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 0.00 135 D 8.99 4.57 0.00 2.72 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 0.00 136 P 0.00 4.29 0.00 2.08 2.13 0.00 3.72 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 2.14 0.00 137 E 8.62 4.33 0.00 2.05 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 2.30 2.25 0.00 138 G 8.30 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 0.00 139 G 8.92 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 E 8.41 5.16 0.00 1.82 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 2.21 2.32 0.00 141 R 9.32 4.83 0.00 1.67 1.78 0.00 3.22 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 142 A 8.56 5.05 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 0.00 143 V 8.99 4.19 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 0.97 0.00 0.00 0.94 0.00 0.00 144 I 8.39 4.92 2.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.83 0.94 0.00 0.00 145 T 8.74 4.47 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 1.18 0.00 0.00 146 L 8.55 4.77 0.00 1.66 1.99 1.01 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 147 D 8.77 4.74 0.00 2.60 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.47 4.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 K 8.87 4.30 0.00 1.93 1.70 0.00 1.57 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.46 7.81 150 Y 8.65 4.74 0.00 2.58 2.85 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 0.00 151 L 8.72 4.70 0.00 1.38 1.37 0.86 0.78 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 0.00 152 P 0.00 4.56 0.00 2.03 1.89 0.00 3.46 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.88 0.00 153 T 8.66 4.50 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 0.00 154 K 8.48 4.69 0.00 1.76 1.74 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.44 7.81 155 P 0.00 4.53 0.00 2.03 1.93 0.00 3.67 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 2.03 2.07 0.00 156 F 7.82 4.53 0.00 3.06 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