NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4935 8.1633 120.6089 55.5132 34.4130 173.8642 2 Q 4.5218 8.2768 121.8060 52.2672 32.7780 172.7384 3 I 4.6258 8.8328 116.9016 59.0630 41.8966 174.0258 4 F 5.3707 7.9270 122.0399 56.1567 41.9170 174.9184 5 V 5.2395 8.4108 119.6620 60.0815 34.9959 174.2225 6 K 4.7755 8.3867 127.4996 54.8694 35.4473 175.7766 7 T 4.3551 7.9222 122.0787 60.7535 68.1385 173.7693 8 L 3.9787 8.5039 125.5504 57.3936 42.0670 176.4664 9 T 4.2269 7.7416 114.9687 61.8724 68.7193 174.8500 10 G 3.6560 9.2529 116.4023 45.6949 0.0000 168.9402 11 K 3.5640 8.1851 121.4575 56.6787 29.1119 173.2267 12 T 4.9346 7.6734 119.3987 60.9457 68.7168 172.9163 13 I 4.1156 8.0496 127.4214 60.8590 38.7077 174.6644 14 T 4.8896 8.5562 117.7960 60.2058 70.4520 174.2760 15 L 4.5642 8.4128 126.5462 53.4581 44.6315 175.6680 16 E 4.7025 8.6207 118.5250 55.0459 31.5987 175.3561 17 V 4.6335 8.0141 116.3739 59.4492 36.0456 174.5747 18 E 4.8859 9.0099 119.5235 53.9508 32.9402 176.2348 19 P 4.2976 0.0000 0.0000 65.6781 31.5647 178.4766 20 S 4.3240 7.9289 111.8798 59.7041 63.6525 174.1889 21 D 4.4181 7.8928 122.9885 54.4614 41.1455 176.3456 22 T 4.4405 8.2999 114.3368 61.0863 71.1075 175.7579 23 I 3.6941 8.2636 123.3456 64.7509 37.2100 178.4834 24 E 3.9328 7.9593 118.3012 59.7450 28.9713 178.8193 25 N 4.3420 7.7285 116.5360 56.3999 39.1553 177.1660 26 V 3.6366 7.9265 119.8668 65.8162 31.6691 178.2463 27 K 4.0134 8.5414 118.5973 59.1308 31.8358 178.6262 28 A 3.9533 8.0083 121.1354 55.7489 17.8092 179.8863 29 K 4.0524 8.0685 115.3220 58.9627 32.2364 179.7102 30 I 3.6082 7.5476 120.2837 63.9798 36.9759 178.0221 31 Q 4.0575 7.9568 120.5334 59.0575 28.7501 177.4895 32 D 4.5580 8.1353 117.8342 56.1891 41.2469 176.6686 33 K 4.5951 7.2890 115.2715 55.9651 33.0992 176.2876 34 E 4.5081 8.2096 115.5191 55.4449 33.3566 175.7417 35 G 4.3999 8.3913 105.7624 47.0815 0.0000 173.4403 36 I 4.1407 7.0896 120.5026 58.8873 37.5469 174.4073 37 P 4.3593 0.0000 0.0000 61.8012 32.0460 175.5875 38 P 4.1912 0.0000 0.0000 65.9968 31.3250 177.4750 39 D 4.7019 8.0318 113.6837 54.3255 39.7689 176.2035 40 Q 4.6577 8.4216 119.3343 55.9153 30.8396 175.0712 41 Q 4.7297 7.8137 117.5006 54.9177 30.6023 175.8872 42 R 4.5296 8.7332 120.1667 54.4289 33.3573 174.9059 43 L 4.5797 8.4326 124.2187 54.7239 43.6456 176.5833 44 I 5.4346 8.1851 121.6246 60.0101 41.4203 173.8724 45 F 5.2130 8.3275 128.4322 56.7530 43.0201 174.2793 46 A 3.0917 8.7916 127.3932 53.5301 15.8176 176.9442 47 G 3.9989 8.2321 103.3461 47.6240 0.0000 174.7538 48 K 4.4807 7.5952 115.6957 54.2350 35.9870 176.4820 49 Q 4.4969 8.5927 122.6563 55.4201 27.6867 175.8373 50 L 3.9892 7.9892 124.5336 54.9470 42.7089 176.2959 51 E 4.7575 8.6209 115.9288 54.6922 32.7773 176.4308 52 D 4.4252 9.1211 121.3603 57.7679 41.3313 179.4115 53 G 3.5753 8.1932 106.6820 48.6379 0.0000 174.2906 54 R 4.0388 7.5561 120.1378 55.8103 30.5898 176.4499 55 T 4.8399 7.8920 110.3181 60.1272 71.1363 175.5225 56 L 4.2715 8.3344 122.0757 58.0730 41.4381 180.0071 57 S 4.1767 8.0882 114.1008 61.6355 62.5963 175.9040 58 D 4.5862 7.9548 118.6517 55.4109 40.4349 176.3810 59 Y 4.8247 7.6113 114.3585 56.8056 40.9307 174.4792 60 N 4.2361 8.2917 116.2244 54.3313 36.2929 174.7471 61 I 4.2124 7.8723 118.2910 60.4384 38.1767 175.6183 62 Q 4.6645 8.1655 123.3694 53.2388 32.6344 174.8770 63 K 3.9416 8.4757 117.3430 57.8265 32.3616 176.4814 64 E 3.1907 8.2272 117.1714 56.9040 28.1049 175.0341 65 S 4.3617 7.7985 115.5699 57.9261 63.0641 174.0872 66 T 4.4770 8.4599 117.7969 62.0432 70.3975 174.1391 67 L 4.1249 8.2831 122.3742 54.4997 44.5719 173.8526 68 H 4.7206 8.9322 124.9903 56.0329 29.8565 174.5073 69 L 5.0778 8.4792 122.7152 53.3189 45.7134 175.2984 70 V 4.6379 8.3057 124.9051 61.1747 34.6217 174.0703 71 L 5.0264 8.5376 127.5011 53.6829 43.0105 176.8251 72 R 4.3186 8.9342 122.2128 55.8953 30.8410 176.9530 73 L 4.2302 8.5550 119.6706 55.6850 42.0647 176.5652 74 R 4.4452 7.2440 113.5763 55.8379 31.8968 173.4420 75 G 4.3946 9.0079 107.7814 44.5708 0.0000 172.9464 76 G 3.8270 8.3819 107.0675 46.1510 0.0000 173.4521 77 M 4.8603 7.8289 120.1878 53.5405 35.3566 174.3091 78 Q 5.3825 8.7178 122.7040 53.2718 32.5474 173.8852 79 I 4.5204 7.9890 114.2033 59.0311 41.6728 173.7459 80 F 5.3977 8.7311 120.2654 55.6825 42.5925 174.9162 81 V 4.9025 9.3257 121.3551 61.1475 34.5513 173.9383 82 K 4.7784 8.8073 130.0248 55.0181 33.7888 176.7981 83 T 4.1967 7.8307 118.7104 61.6250 70.2112 173.6981 84 L 4.3048 8.4520 118.7344 57.8689 42.5708 178.1480 85 T 3.9740 8.1906 114.4113 67.0961 68.4756 174.3532 86 G 3.6923 7.4168 114.3058 45.6098 0.0000 172.1783 87 K 3.6836 7.8858 122.4910 57.0864 31.8727 174.7502 88 T 4.7184 8.3718 123.6244 62.5237 69.5358 174.4929 89 I 4.8577 8.9329 119.8788 59.1738 41.3774 174.2410 90 T 5.0580 8.5072 112.2507 59.9550 71.2257 173.1649 91 L 4.7309 8.8724 124.3136 53.0470 45.2994 175.7037 92 E 4.2870 8.6674 121.6545 55.4723 29.8503 175.5817 93 V 4.6575 8.1600 117.4787 59.3699 35.2836 175.0787 94 E 4.8303 8.7900 120.2842 53.7827 32.4873 176.0354 95 P 3.9028 0.0000 0.0000 65.2191 31.2917 177.4762 96 S 4.6539 7.7973 111.3619 57.6943 63.6788 173.8426 97 D 4.3503 8.6147 123.6991 55.1739 41.0458 176.6813 98 T 4.9685 8.1918 113.0207 60.5351 70.0880 175.6350 99 I 3.7259 8.3277 123.0326 64.3978 37.0466 178.1150 100 E 3.9142 8.2531 119.7864 59.6225 29.2872 178.6267 101 N 4.5183 8.0078 116.2575 55.9028 38.6340 177.2579 102 V 3.7609 7.5811 118.9546 64.9522 31.6911 178.0358 103 K 4.2841 8.5111 120.0359 58.6172 31.8419 179.0231 104 A 3.8882 8.4639 121.4581 55.0877 18.0758 179.8058 105 K 3.9796 7.8082 117.1480 59.3956 32.0556 179.6344 106 I 3.8137 7.6089 119.8824 63.9895 37.0080 178.0187 107 Q 4.2225 8.7202 122.4589 58.7535 28.6288 178.2753 108 D 4.3576 7.5804 118.6240 57.6501 40.9308 178.5418 109 K 4.1569 7.7729 118.0176 58.2752 31.8945 178.2076 110 E 4.5668 8.6946 116.3043 55.7513 29.8159 178.3126 111 G 3.9627 8.1913 108.0503 45.6487 0.0000 174.3483 112 I 3.7759 7.2099 120.4920 60.4706 37.1983 173.8652 113 P 4.3745 0.0000 0.0000 61.8096 32.0988 175.4719 114 P 4.2396 0.0000 0.0000 65.8126 31.3797 178.1178 115 D 4.4504 8.1934 115.4948 55.8362 39.1136 176.9123 116 Q 4.6234 8.1956 118.1277 55.5206 29.1491 174.8494 117 Q 4.6871 8.0644 117.3907 54.0419 31.3447 174.7859 118 R 4.7187 8.5004 120.5312 54.3388 33.7107 174.3073 119 L 5.2464 8.5586 123.4381 52.9341 44.8394 175.3327 120 I 4.9037 8.6782 124.0404 59.3750 40.5386 174.4469 121 F 4.9709 8.7461 128.6052 56.6068 40.7388 174.5381 122 A 3.3401 9.5140 124.6643 53.6866 15.0606 176.1285 123 G 3.6727 8.5897 112.5102 44.8517 0.0000 167.2456 124 K 3.8977 8.3785 124.0893 55.6868 30.4018 175.4494 125 Q 4.6820 8.3923 125.3338 55.3582 30.0250 174.9237 126 L 3.7785 8.6711 127.2753 54.0694 42.0910 176.7528 127 E 4.5411 9.3803 123.9893 55.6892 31.1529 177.1560 128 D 4.2387 8.8492 119.9914 55.7846 41.3774 177.9074 129 G 3.8231 8.0283 106.3010 45.9109 0.0000 173.6798 130 R 4.4386 7.4103 119.6557 54.8749 32.1382 174.8036 131 T 5.1044 8.8337 108.9226 59.3351 71.5362 175.0112 132 L 4.1159 8.6945 123.3778 57.8356 42.5123 179.1392 133 S 4.1148 8.0057 113.8607 61.1686 62.4998 175.7011 134 D 4.3189 7.7262 118.6588 57.0868 40.5278 176.8960 135 Y 4.5213 7.3969 112.7573 56.8718 38.3260 174.7903 136 N 4.1917 8.1046 117.7319 54.5772 37.8457 174.0274 137 I 3.7919 7.9024 117.8465 59.8311 38.8412 175.7007 138 Q 4.5079 8.1009 121.0647 53.8987 31.8098 174.0126 139 K 3.9338 8.4231 116.1630 58.6691 32.2256 177.3611 140 E 4.3028 8.7932 121.2253 56.5476 29.0918 175.4312 141 S 4.4778 7.8670 115.4489 59.0495 64.1410 173.1412 142 T 5.2426 8.7005 117.8105 60.4482 69.3843 173.1134 143 L 4.8593 9.2397 129.1698 54.1471 44.0622 175.1879 144 H 5.2564 8.9847 119.8465 54.4649 30.7063 173.7654 145 L 5.0764 8.9876 125.6005 53.4244 43.9784 176.3348 146 V 4.0958 8.4895 124.4160 63.0751 31.8998 175.0026 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 8.16 4.49 0.00 2.29 1.97 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.51 0.00 2 Q 8.28 4.52 0.00 2.06 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.69 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 3 I 8.83 4.63 1.81 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.02 0.81 0.00 0.00 4 F 7.93 5.37 0.00 2.91 2.81 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 5 V 8.41 5.24 2.19 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 1.36 0.00 0.00 0.92 0.00 0.00 6 K 8.39 4.78 0.00 1.79 1.53 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.39 7.81 7 T 7.92 4.36 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 8 L 8.50 3.98 0.00 1.64 1.70 0.95 0.88 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 9 T 7.74 4.23 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 1.21 0.00 0.00 10 G 9.25 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 11 K 8.19 3.56 0.00 1.96 1.84 0.00 1.93 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.43 7.81 12 T 7.67 4.93 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 1.11 0.00 0.00 13 I 8.05 4.12 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 1.39 1.07 0.91 0.00 0.00 14 T 8.56 4.89 4.69 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 1.12 0.00 0.00 15 L 8.41 4.56 0.00 1.59 1.63 0.91 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.62 4.70 0.00 1.77 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 2.20 2.37 0.00 17 V 8.01 4.63 2.20 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 0.67 0.00 0.00 0.89 0.00 0.00 18 E 9.01 4.89 0.00 1.84 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.35 0.00 19 P 0.00 4.30 0.00 2.21 2.30 0.00 3.68 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 20 S 7.93 4.32 0.00 4.00 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 21 D 7.89 4.42 0.00 2.97 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 22 T 8.30 4.44 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 1.25 0.00 0.00 23 I 8.26 3.69 2.00 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 2.00 1.09 0.91 0.00 0.00 24 E 7.96 3.93 0.00 2.14 2.38 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 2.57 2.35 0.00 25 N 7.73 4.34 0.00 2.93 3.08 0.00 0.00 6.74 7.59 0.00 0.00 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 V 7.93 3.64 2.19 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 0.95 0.00 0.00 0.98 0.00 0.00 27 K 8.54 4.01 0.00 1.94 1.84 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.44 7.81 28 A 8.01 3.95 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 29 K 8.07 4.05 0.00 1.79 1.87 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.68 7.81 30 I 7.55 3.61 2.03 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 1.47 1.02 0.00 0.00 31 Q 7.96 4.06 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 32 D 8.14 4.56 0.00 2.84 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 33 K 7.29 4.60 0.00 1.74 1.76 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.32 7.81 34 E 8.21 4.51 0.00 2.05 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 0.00 2.20 2.29 0.00 35 G 8.39 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 0.00 0.00 0.00 0.00 36 I 7.09 4.14 2.06 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 0.64 0.90 0.00 0.00 37 P 0.00 4.36 0.00 2.30 2.28 0.00 3.73 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 2.21 2.15 0.00 38 P 0.00 4.19 0.00 2.16 2.13 0.00 3.58 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 39 D 8.03 4.70 0.00 2.77 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 40 Q 8.42 4.66 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.44 2.25 0.00 41 Q 7.81 4.73 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.74 0.00 0.00 0.00 0.00 0.00 2.52 2.38 0.00 42 R 8.73 4.53 0.00 1.93 1.85 0.00 3.16 0.00 0.00 3.16 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 43 L 8.43 4.58 0.00 1.55 1.52 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 44 I 8.19 5.43 1.90 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 1.07 0.44 0.88 0.00 0.00 45 F 8.33 5.21 0.00 2.89 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 46 A 8.79 3.09 1.05 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 0.00 0.00 0.00 47 G 8.23 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 0.00 0.00 0.00 48 K 7.60 4.48 0.00 1.94 1.65 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.57 1.54 7.81 49 Q 8.59 4.50 0.00 1.93 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 50 L 7.99 3.99 0.00 1.31 1.17 0.72 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.62 4.76 0.00 2.16 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 2.38 2.40 0.00 52 D 9.12 4.43 0.00 2.75 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.19 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.56 4.04 0.00 2.12 1.61 0.00 3.07 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 55 T 7.89 4.84 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 1.24 0.00 0.00 56 L 8.33 4.27 0.00 1.83 1.79 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 57 S 8.09 4.18 0.00 4.07 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 D 7.95 4.59 0.00 2.73 2.34 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 59 Y 7.61 4.82 0.00 3.16 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 60 N 8.29 4.24 0.00 2.99 3.00 0.00 0.00 6.90 7.31 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 61 I 7.87 4.21 2.01 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 0.88 0.62 0.75 0.00 0.00 62 Q 8.17 4.66 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.95 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 63 K 8.48 3.94 0.00 1.76 1.67 0.00 1.78 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.45 7.81 64 E 8.23 3.19 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 2.32 2.29 0.00 65 S 7.80 4.36 0.00 4.05 3.46 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 66 T 8.46 4.48 4.29 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 1.41 0.00 0.00 67 L 8.28 4.12 0.00 1.46 1.61 0.76 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 68 H 8.93 4.72 0.00 3.18 3.24 0.00 5.61 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 L 8.48 5.08 0.00 1.69 1.45 0.92 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 70 V 8.31 4.64 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 0.93 0.00 0.00 0.94 0.00 0.00 71 L 8.54 5.03 0.00 1.56 1.56 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 72 R 8.93 4.32 0.00 1.74 2.06 0.00 3.32 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 73 L 8.56 4.23 0.00 1.64 1.71 0.92 0.85 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 74 R 7.24 4.45 0.00 2.08 1.86 0.00 2.98 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.54 0.00 75 G 9.01 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 0.00 0.00 0.00 76 G 8.38 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 0.00 0.00 0.00 77 M 7.83 4.86 0.00 2.23 1.84 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.40 0.00 78 Q 8.72 5.38 0.00 1.85 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.48 0.00 0.00 0.00 0.00 0.00 2.07 1.93 0.00 79 I 7.99 4.52 1.92 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 1.19 0.88 0.81 0.00 0.00 80 F 8.73 5.40 0.00 2.99 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 81 V 9.33 4.90 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 1.10 0.00 0.00 0.94 0.00 0.00 82 K 8.81 4.78 0.00 1.88 1.64 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.53 7.81 83 T 7.83 4.20 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 1.32 0.00 0.00 84 L 8.45 4.30 0.00 1.66 1.76 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.19 3.97 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 86 G 7.42 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 0.00 0.00 0.00 87 K 7.89 3.68 0.00 1.80 1.79 0.00 1.72 0.00 0.00 2.07 0.00 0.00 3.15 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.51 7.81 88 T 8.37 4.72 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 1.20 0.00 0.00 89 I 8.93 4.86 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.01 0.94 0.00 0.00 90 T 8.51 5.06 4.12 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 1.49 0.00 0.00 91 L 8.87 4.73 0.00 1.49 1.51 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.67 4.29 0.00 1.81 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 93 V 8.16 4.66 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 0.62 0.00 0.00 0.89 0.00 0.00 94 E 8.79 4.83 0.00 2.11 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 95 P 0.00 3.90 0.00 2.19 2.30 0.00 3.65 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 96 S 7.80 4.65 0.00 3.97 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 97 D 8.61 4.35 0.00 2.80 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 98 T 8.19 4.97 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 1.21 0.00 0.00 99 I 8.33 3.73 2.06 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.56 0.96 0.00 0.00 100 E 8.25 3.91 0.00 2.08 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 2.38 2.48 0.00 101 N 8.01 4.52 0.00 3.01 2.84 0.00 0.00 6.67 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 7.58 3.76 2.21 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 1.05 0.00 0.00 0.99 0.00 0.00 103 K 8.51 4.28 0.00 1.99 1.86 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.61 1.47 7.81 104 A 8.46 3.89 1.43 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 0.00 105 K 7.81 3.98 0.00 1.88 1.85 0.00 1.64 0.00 0.00 1.62 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.56 7.81 106 I 7.61 3.81 2.12 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 0.92 0.92 0.00 0.00 107 Q 8.72 4.22 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 108 D 7.58 4.36 0.00 2.82 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 0.00 109 K 7.77 4.16 0.00 1.78 1.82 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.23 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.62 7.81 110 E 8.69 4.57 0.00 1.99 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 0.00 2.25 2.30 0.00 111 G 8.19 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 0.00 112 I 7.21 3.78 1.87 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 1.30 0.76 0.91 0.00 0.00 113 P 0.00 4.37 0.00 2.49 1.98 0.00 3.64 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 114 P 0.00 4.24 0.00 2.17 2.14 0.00 3.61 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 115 D 8.19 4.45 0.00 2.78 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 0.00 116 Q 8.20 4.62 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.62 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 117 Q 8.06 4.69 0.00 2.25 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.55 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 118 R 8.50 4.72 0.00 1.69 1.79 0.00 3.07 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 119 L 8.56 5.25 0.00 1.53 1.53 0.91 0.91 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 0.00 120 I 8.68 4.90 1.90 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 1.09 0.82 0.90 0.00 0.00 121 F 8.75 4.97 0.00 2.88 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 0.00 122 A 9.51 3.34 0.72 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 0.00 0.00 123 G 8.59 3.67 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 0.00 124 K 8.38 3.90 0.00 2.01 1.92 0.00 1.83 0.00 0.00 1.98 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.44 7.81 125 Q 8.39 4.68 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.88 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 126 L 8.67 3.78 0.00 1.37 1.25 0.84 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 127 E 9.38 4.54 0.00 2.05 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 2.43 2.51 0.00 128 D 8.85 4.24 0.00 2.69 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 0.00 129 G 8.03 3.82 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 0.00 0.00 0.00 130 R 7.41 4.44 0.00 2.02 1.68 0.00 3.13 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 131 T 8.83 5.10 4.34 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 1.27 0.00 0.00 132 L 8.69 4.12 0.00 1.87 1.66 0.88 0.85 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 0.00 133 S 8.01 4.11 0.00 3.98 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 D 7.73 4.32 0.00 2.49 2.36 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 0.00 135 Y 7.40 4.52 0.00 3.04 3.13 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 0.00 136 N 8.10 4.19 0.00 2.87 3.00 0.00 0.00 7.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 I 7.90 3.79 1.78 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.36 0.48 0.00 0.00 138 Q 8.10 4.51 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.87 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 139 K 8.42 3.93 0.00 1.77 1.80 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.49 7.81 140 E 8.79 4.30 0.00 2.26 2.35 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 2.26 2.49 0.00 141 S 7.87 4.48 0.00 3.91 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 0.00 142 T 8.70 5.24 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 1.28 0.00 0.00 143 L 9.24 4.86 0.00 1.62 1.75 0.89 0.82 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 0.00 144 H 8.98 5.26 0.00 3.10 3.22 0.00 5.59 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.99 5.08 0.00 1.59 1.67 0.97 0.91 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 0.00 146 V 8.49 4.10 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 0.94 0.00 0.00