NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3796 8.3044 120.3231 55.5853 32.6779 175.7315 2 H 4.4085 8.4443 128.5878 54.4936 28.3751 173.2290 3 L 4.5467 8.0731 121.4136 53.6245 44.2954 177.5909 4 T 4.0289 9.2652 121.3977 62.4198 70.2975 173.4993 5 P 4.3873 0.0000 0.0000 66.0270 31.4122 178.6359 6 E 4.0932 8.1425 114.6089 58.3489 29.3700 178.4570 7 E 4.0245 7.7641 119.7940 58.9053 30.0312 178.0267 8 K 3.7485 8.5315 119.5624 59.8687 32.1695 179.1073 9 S 4.0348 8.1936 112.6385 61.2583 61.8114 175.8341 10 A 3.9994 7.6476 123.6522 55.4486 18.0673 179.4827 11 V 3.5488 8.0094 116.7948 66.1724 31.6791 177.9134 12 T 3.8940 8.2990 115.2229 66.9764 68.2847 175.9768 13 A 4.0481 7.7803 120.9159 55.5302 18.8239 179.2174 14 L 3.9390 7.7749 117.4530 57.7876 42.0364 178.8582 15 W 4.3700 8.6282 128.7934 60.4046 30.5038 177.9957 16 G 3.8384 8.0874 103.8820 46.7008 0.0000 174.0068 17 K 4.5045 7.5161 118.6087 56.0041 32.4203 175.8794 18 V 4.0027 7.4674 119.9177 61.7332 32.2666 176.4321 19 N 4.5058 8.2588 125.4560 52.2224 38.2434 175.0689 20 V 3.4563 8.0909 127.1011 66.0713 31.7586 177.1118 21 D 4.3459 8.0419 117.7837 57.3318 40.7461 178.4911 22 E 4.0346 8.3995 119.0137 59.2973 29.6314 179.4863 23 V 3.5283 8.0141 118.7899 65.6642 31.6309 178.1274 24 G 3.7654 8.1084 105.6579 47.9665 0.0000 175.7695 25 G 3.6730 7.6177 107.6803 47.4821 0.0000 175.5023 26 E 4.0758 8.3247 120.3557 58.8011 29.4631 178.6401 27 A 4.0523 7.9767 121.8403 54.4010 18.4415 178.9563 28 L 3.9861 8.1924 117.3980 58.1858 42.1721 179.6331 29 G 3.6928 8.0926 105.2681 48.3113 0.0000 175.8756 30 R 3.9915 8.2087 121.0493 58.1596 29.9184 179.1354 31 L 4.1398 7.9194 120.5782 58.2236 42.2895 178.9648 32 L 4.0846 7.8197 118.7062 57.4601 41.2517 179.7345 33 V 3.5936 7.3675 117.2829 65.9827 31.7236 178.1182 34 V 3.5848 8.0055 116.7685 64.5001 32.8951 175.6068 35 Y 5.0184 7.8275 114.9331 53.1970 37.9920 173.7347 36 P 4.9037 0.0000 0.0000 65.1067 31.4269 177.5861 37 E 3.8301 8.5346 116.9324 59.7982 28.8321 178.8944 38 T 4.3633 8.5349 108.5758 63.5299 69.0000 176.5146 39 Q 4.2715 9.3947 123.0883 58.6587 28.4535 178.0347 40 R 3.7033 7.2266 116.8350 59.6364 29.1343 178.1787 41 F 4.3614 7.1067 114.8989 58.2410 39.1526 176.0936 42 F 4.6120 8.2194 117.0167 56.8692 39.9163 176.6474 43 E 3.7379 8.4128 123.7274 59.6237 29.2321 178.7836 44 S 4.6837 8.0772 110.2775 59.0275 63.4654 174.7397 45 F 4.5545 8.9672 120.8601 58.4106 39.9758 175.9303 46 G 3.9789 7.4964 103.9435 43.6395 0.0000 175.0494 47 D 4.3783 8.7899 126.2284 55.0234 40.6222 175.4620 48 L 4.8339 8.2229 125.9856 54.6046 42.7600 178.3544 49 S 4.3070 8.2391 117.8850 61.2001 63.0802 175.4474 50 T 4.7306 7.4214 108.9966 58.3110 72.9238 172.5387 51 P 4.2062 0.0000 0.0000 66.3778 31.2932 178.5748 52 D 4.3718 8.1488 116.4596 57.1616 40.6114 178.7538 53 A 3.9764 7.4994 120.8028 55.1890 18.2486 179.4317 54 V 3.5348 7.5141 115.2211 66.7752 31.6650 177.4782 55 M 4.1466 8.0908 117.0980 57.7309 31.9937 177.8951 56 G 3.7475 7.4728 106.3957 46.2464 0.0000 173.4769 57 N 4.3214 8.2800 120.5704 53.0014 39.3090 173.6013 58 P 4.2545 0.0000 0.0000 66.0655 31.2778 178.6514 59 K 3.7029 8.3004 118.3064 58.7058 31.7600 179.5033 60 V 3.7941 7.8923 118.1673 65.9598 31.6926 177.7156 61 K 3.8349 8.0655 117.8959 59.7552 32.1331 179.0128 62 A 4.0206 8.0874 120.6490 55.5932 18.2732 179.1758 63 H 4.4066 8.2534 116.9525 59.1097 29.8802 177.6742 64 G 3.7843 8.1949 107.8726 47.5783 0.0000 175.6535 65 K 3.9906 7.9996 121.4165 59.2217 32.1489 178.9641 66 K 4.0144 7.9445 119.7124 59.2647 32.1935 179.1142 67 V 3.6598 8.3486 118.9960 66.0548 31.6216 177.9298 68 L 4.3983 8.3942 119.9817 57.6616 41.3737 179.1046 69 G 3.7216 8.3832 106.0798 47.8211 0.0000 175.6253 70 A 4.2505 7.7768 122.2911 54.3370 18.6948 179.3481 71 F 4.1217 8.2987 119.2100 61.6857 39.4884 177.1313 72 S 4.0488 8.3452 114.8857 62.2341 62.4657 176.9017 73 D 4.5197 7.9809 119.8932 57.1201 40.4690 179.0750 74 G 3.4193 8.3379 106.8837 47.3470 0.0000 175.7872 75 L 3.9046 7.3557 119.5208 56.5756 41.6431 178.2588 76 A 4.4489 7.2789 118.5052 52.4540 19.4185 177.0904 77 H 4.7401 7.5751 113.7485 55.3048 29.7542 175.8914 78 L 3.3421 7.8729 121.9055 58.1086 41.5765 178.4998 79 D 4.4778 7.9341 117.1725 56.3945 41.1663 176.0427 80 N 4.9518 8.8629 118.2735 51.0088 39.1208 174.3724 81 L 4.0168 7.9015 122.7672 57.2609 42.4503 178.5266 82 K 3.9335 8.1909 118.2245 59.8491 31.7814 179.3719 83 G 3.6574 7.7964 104.1047 47.8296 0.0000 175.6297 84 T 3.8511 7.2296 116.0164 65.2904 68.6034 175.9417 85 F 4.8011 7.7870 117.0118 56.9098 39.3796 177.0463 86 A 4.0808 7.5355 122.2406 56.2248 18.0278 179.8815 87 T 3.8623 8.0085 113.5757 66.2774 68.6304 176.4709 88 L 3.9749 8.0339 120.4561 58.3807 41.7702 179.7013 89 S 4.2952 8.4333 113.2428 61.4654 62.5035 175.7590 90 E 3.9093 8.4935 121.4191 59.5123 29.2652 179.5494 91 L 3.9357 8.3093 120.5548 58.5083 42.2538 178.7204 92 H 4.2525 8.5708 115.8606 58.0176 27.3697 177.0304 93 C 3.7037 7.8142 120.3678 61.6730 31.5443 175.2680 94 D 4.5279 8.2256 118.6394 55.9466 40.4999 177.3583 95 K 4.3227 7.7038 116.1923 57.2622 34.7778 177.2198 96 L 4.0443 7.7252 117.3596 55.5225 42.1252 176.3850 97 H 4.0491 7.2216 110.8200 56.7808 25.9555 175.2137 98 V 3.8545 7.6236 118.9074 60.8691 32.4472 174.6652 99 D 4.2926 8.6693 127.1424 53.8741 41.3113 175.0062 100 P 2.9700 0.0000 0.0000 64.0841 31.4863 177.9893 101 E 3.8439 8.7197 119.7074 59.1140 29.3532 178.3676 102 N 4.3130 8.1901 117.0989 55.7746 38.4230 176.9181 103 F 4.4137 7.0089 119.3451 61.0872 39.0012 177.6333 104 R 3.9638 7.5322 117.0795 59.5282 29.8569 178.7685 105 L 3.7763 7.7962 117.8283 57.9536 41.5924 179.2172 106 L 4.1162 8.0333 120.0489 58.1556 41.9633 179.2043 107 G 3.7320 8.2944 105.7405 48.0224 0.0000 175.4673 108 N 4.4824 8.5328 119.2194 55.7073 38.5686 177.6126 109 V 3.6341 8.1388 120.0234 65.9951 31.5859 177.6105 110 L 3.8601 8.3123 120.2164 58.3488 41.9487 178.7878 111 V 3.5799 7.9043 117.9434 66.5184 31.3712 177.7185 112 C 4.0274 8.3629 116.3198 62.7800 28.0038 176.1716 113 V 3.5216 7.7597 119.7729 65.9883 30.9776 178.0148 114 L 3.9213 7.8007 118.2826 57.8373 41.0175 179.4830 115 A 3.3640 7.0365 120.2242 54.7840 17.8774 179.1821 116 H 4.1273 7.6943 116.4298 59.6250 30.0740 176.8456 117 H 4.0363 8.0655 116.9578 57.7469 28.8690 176.7623 118 F 4.7446 8.3216 117.6977 55.8836 39.7945 177.9542 119 G 3.8643 8.4403 107.6306 45.6108 0.0000 175.7785 120 K 3.8571 9.1929 122.8888 59.4696 31.6977 177.3164 121 E 4.0650 8.3165 117.4816 58.1737 30.1364 176.9915 122 F 4.6063 8.4120 123.8030 57.4001 37.9878 175.6448 123 T 4.1743 7.2649 114.7727 60.4325 71.3925 173.4069 124 P 4.1376 0.0000 0.0000 65.7194 31.5211 176.7834 125 P 4.1829 0.0000 0.0000 65.8770 31.2421 178.8394 126 V 3.5797 7.1411 116.9161 65.7232 31.3066 177.8688 127 Q 3.5706 7.7817 119.1842 58.9476 28.9725 177.8334 128 A 3.9747 8.0663 121.6712 55.3784 17.8612 179.2941 129 A 3.9166 7.8394 118.6005 55.7822 18.3759 179.5554 130 Y 3.8673 8.1319 115.0862 61.1567 38.0632 178.2560 131 Q 4.2483 9.0493 119.4794 59.0588 28.6784 179.3499 132 K 4.0475 8.0044 119.4914 59.1675 32.0039 179.6586 133 V 3.4642 7.3838 117.7967 65.9699 31.5339 178.0900 134 V 3.7170 8.3852 118.2682 66.1000 31.2139 177.9016 135 A 4.0593 8.0337 119.9140 55.0922 18.2997 179.5100 136 G 3.6729 8.1582 104.5155 48.2904 0.0000 175.9104 137 V 3.2740 8.4521 121.7107 65.2699 31.5325 177.9616 138 A 3.7808 7.8824 120.5597 55.0925 18.2997 179.4149 139 N 4.2586 8.3819 115.0026 56.3525 38.4070 177.3652 140 A 4.0106 7.6023 121.0161 55.4014 18.5249 179.4816 141 L 3.8667 7.3211 115.5572 57.1170 41.8557 178.6552 142 A 4.3195 7.7027 118.6064 52.4445 18.8366 178.2817 143 H 4.1011 7.7910 117.4171 59.0713 29.8880 176.1198 144 K 4.4716 7.7528 115.5925 56.3053 31.9978 176.0223 145 Y 4.0963 8.1409 118.3181 58.1286 38.2950 175.7324 146 H 4.5110 8.2701 119.0548 55.8696 28.7494 173.0395 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 2.26 0.00 0.00 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.44 0.00 2 H 8.44 4.41 0.00 3.15 3.24 0.00 5.73 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.07 4.55 0.00 1.60 1.51 0.82 0.88 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 4 T 9.27 4.03 4.35 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 1.25 0.00 0.00 5 P 0.00 4.39 0.00 2.12 2.11 0.00 3.56 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 2.10 2.16 0.00 6 E 8.14 4.09 0.00 2.14 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 0.00 2.33 2.33 0.00 7 E 7.76 4.02 0.00 2.20 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 2.32 2.34 0.00 8 K 8.53 3.75 0.00 1.89 1.85 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.42 7.81 9 S 8.19 4.03 0.00 3.88 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 10 A 7.65 4.00 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 11 V 8.01 3.55 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 0.67 0.00 0.00 0.60 0.00 0.00 12 T 8.30 3.89 4.33 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 1.25 0.00 0.00 13 A 7.78 4.05 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 14 L 7.77 3.94 0.00 1.77 1.97 -0.34 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.63 4.37 0.00 3.65 3.32 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 16 G 8.09 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 17 K 7.52 4.50 0.00 1.85 1.97 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.36 7.81 18 V 7.47 4.00 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 0.18 0.00 0.00 0.78 0.00 0.00 19 N 8.26 4.51 0.00 2.72 2.60 0.00 0.00 6.82 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 20 V 8.09 3.46 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 1.06 0.00 0.00 0.88 0.00 0.00 21 D 8.04 4.35 0.00 2.94 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 22 E 8.40 4.03 0.00 1.96 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 2.42 0.00 23 V 8.01 3.53 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 0.90 0.00 0.00 0.63 0.00 0.00 24 G 8.11 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 25 G 7.62 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 26 E 8.32 4.08 0.00 2.12 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 2.29 2.30 0.00 27 A 7.98 4.05 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 28 L 8.19 3.99 0.00 1.83 1.69 1.01 1.11 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 29 G 8.09 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 30 R 8.21 3.99 0.00 2.08 1.98 0.00 3.07 0.00 0.00 3.03 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 31 L 7.92 4.14 0.00 1.90 1.95 1.12 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.82 4.08 0.00 1.83 1.73 0.68 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.37 3.59 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 0.74 0.00 0.00 0.91 0.00 0.00 34 V 8.01 3.58 1.71 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 0.10 0.00 0.00 0.85 0.00 0.00 35 Y 7.83 5.02 0.00 3.20 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 36 P 0.00 4.90 0.00 2.17 2.15 0.00 3.94 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 37 E 8.53 3.83 0.00 2.09 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 0.00 2.44 2.50 0.00 38 T 8.53 4.36 4.58 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 1.42 0.00 0.00 39 Q 9.39 4.27 0.00 2.01 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.70 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 40 R 7.23 3.70 0.00 1.55 1.82 0.00 2.81 0.00 0.00 2.51 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.50 0.00 41 F 7.11 4.36 0.00 2.16 2.47 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 42 F 8.22 4.61 0.00 2.77 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 0.00 0.00 0.00 43 E 8.41 3.74 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 44 S 8.08 4.68 0.00 4.09 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 45 F 8.97 4.55 0.00 3.09 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 46 G 7.50 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 0.00 0.00 0.00 47 D 8.79 4.38 0.00 2.65 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 48 L 8.22 4.83 0.00 1.67 1.74 0.99 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.24 4.31 0.00 3.82 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 50 T 7.42 4.73 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 51 P 0.00 4.21 0.00 2.15 2.15 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 52 D 8.15 4.37 0.00 2.67 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 53 A 7.50 3.98 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 54 V 7.51 3.53 2.23 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 0.90 0.00 0.00 0.94 0.00 0.00 55 M 8.09 4.15 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.83 0.00 56 G 7.47 3.75 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 0.00 0.00 0.00 57 N 8.28 4.32 0.00 2.89 2.89 0.00 0.00 6.77 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 58 P 0.00 4.25 0.00 2.24 2.26 0.00 3.73 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 2.01 2.02 0.00 59 K 8.30 3.70 0.00 1.56 0.74 0.00 1.26 0.00 0.00 1.19 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.15 1.23 7.81 60 V 7.89 3.79 2.33 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 1.06 0.00 0.00 1.10 0.00 0.00 61 K 8.07 3.83 0.00 2.00 1.85 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.47 7.81 62 A 8.09 4.02 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 63 H 8.25 4.41 0.00 3.51 3.65 0.00 5.79 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 64 G 8.19 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 0.00 0.00 0.00 65 K 8.00 3.99 0.00 1.88 2.07 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.47 1.47 7.81 66 K 7.94 4.01 0.00 2.10 1.88 0.00 1.74 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.50 7.81 67 V 8.35 3.66 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 1.05 0.00 0.00 0.97 0.00 0.00 68 L 8.39 4.40 0.00 2.10 1.81 0.94 1.25 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 69 G 8.38 3.72 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 0.00 70 A 7.78 4.25 1.51 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 71 F 8.30 4.12 0.00 3.37 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.35 4.05 0.00 4.37 4.16 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 0.00 0.00 0.00 0.00 73 D 7.98 4.52 0.00 2.78 2.58 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 74 G 8.34 3.42 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 0.00 75 L 7.36 3.90 0.00 1.50 1.50 -0.22 0.95 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 76 A 7.28 4.45 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.58 4.74 0.00 3.05 3.14 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.87 3.34 0.00 1.55 1.68 0.84 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.93 4.48 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 80 N 8.86 4.95 0.00 2.60 2.60 0.00 0.00 7.07 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.90 4.02 0.00 1.72 1.78 0.88 0.75 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 82 K 8.19 3.93 0.00 1.75 1.78 0.00 1.46 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.01 1.28 7.81 83 G 7.80 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 84 T 7.23 3.85 3.76 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 0.53 0.00 0.00 85 F 7.79 4.80 0.00 3.01 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 86 A 7.54 4.08 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 87 T 8.01 3.86 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 88 L 8.03 3.97 0.00 1.99 1.85 1.02 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.43 4.30 0.00 4.07 4.10 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 90 E 8.49 3.91 0.00 2.04 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 2.34 2.57 0.00 91 L 8.31 3.94 0.00 1.76 1.98 0.91 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.57 4.25 0.00 3.57 3.69 0.00 5.85 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.81 3.70 0.00 1.23 2.30 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 94 D 8.23 4.53 0.00 2.77 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 95 K 7.70 4.32 0.00 1.76 1.73 0.00 1.58 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.43 7.81 96 L 7.73 4.04 0.00 1.69 1.54 0.70 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.22 4.05 0.00 3.37 3.45 0.00 5.64 0.00 0.00 0.00 0.00 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.62 3.85 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 0.01 0.00 0.00 0.65 0.00 0.00 99 D 8.67 4.29 0.00 2.72 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 2.97 0.00 1.86 1.67 0.00 3.38 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.45 0.00 101 E 8.72 3.84 0.00 2.02 1.83 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 2.23 2.30 0.00 102 N 8.19 4.31 0.00 2.60 2.79 0.00 0.00 6.87 7.76 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 0.00 103 F 7.01 4.41 0.00 3.03 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 0.00 104 R 7.53 3.96 0.00 1.98 2.00 0.00 3.26 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 105 L 7.80 3.78 0.00 1.71 1.35 0.51 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.03 4.12 0.00 1.89 1.97 0.99 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.29 3.73 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 0.00 0.00 0.00 108 N 8.53 4.48 0.00 2.81 2.96 0.00 0.00 6.67 8.11 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 0.00 109 V 8.14 3.63 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 1.16 0.00 0.00 1.17 0.00 0.00 110 L 8.31 3.86 0.00 1.80 1.91 0.87 0.25 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 0.00 111 V 7.90 3.58 2.31 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 1.19 0.00 0.00 1.17 0.00 0.00 112 C 8.36 4.03 0.00 3.22 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.76 3.52 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 0.93 0.00 0.00 0.91 0.00 0.00 114 L 7.80 3.92 0.00 1.26 1.46 0.55 0.85 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 0.00 115 A 7.04 3.36 1.10 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 0.00 0.00 116 H 7.69 4.13 0.00 3.14 3.48 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.07 4.04 0.00 2.59 2.39 0.00 5.69 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.32 4.74 0.00 3.13 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 0.00 119 G 8.44 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 0.00 120 K 9.19 3.86 0.00 1.80 1.97 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.44 7.81 121 E 8.32 4.07 0.00 2.17 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 2.35 2.30 0.00 122 F 8.41 4.61 0.00 3.02 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 0.00 123 T 7.26 4.17 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.16 0.00 3.60 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 125 P 0.00 4.18 0.00 2.11 2.09 0.00 3.47 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 2.09 2.13 0.00 126 V 7.14 3.58 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 1.00 0.00 0.00 0.87 0.00 0.00 127 Q 7.78 3.57 0.00 1.64 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 128 A 8.07 3.97 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 0.00 129 A 7.84 3.92 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 0.00 130 Y 8.13 3.87 0.00 3.28 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 9.05 4.25 0.00 2.29 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.69 2.64 0.00 132 K 8.00 4.05 0.00 2.05 1.82 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.55 7.81 133 V 7.38 3.46 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 0.85 0.00 0.00 0.75 0.00 0.00 134 V 8.39 3.72 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 1.03 0.00 0.00 1.21 0.00 0.00 135 A 8.03 4.06 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 0.00 136 G 8.16 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 0.00 137 V 8.45 3.27 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 0.27 0.00 0.00 0.39 0.00 0.00 138 A 7.88 3.78 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 0.00 139 N 8.38 4.26 0.00 2.74 2.86 0.00 0.00 6.91 8.76 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 0.00 140 A 7.60 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 0.00 141 L 7.32 3.87 0.00 0.89 0.59 0.09 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.70 4.32 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.79 4.10 0.00 3.28 3.62 0.00 5.76 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.75 4.47 0.00 1.77 1.80 0.00 1.51 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.72 7.81 145 Y 8.14 4.10 0.00 3.10 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 0.00 146 H 8.27 4.51 0.00 3.17 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00