NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2945 8.3044 120.3458 55.6048 33.0684 174.2878 2 H 4.4839 8.7884 126.7920 54.3619 30.4227 172.4337 3 L 4.7071 7.8209 126.1621 52.4143 46.1625 176.4127 4 T 4.2306 8.1712 111.0228 60.6151 71.1272 174.0193 5 P 4.1876 0.0000 0.0000 65.6112 31.2668 178.7474 6 E 3.9304 8.0605 115.8512 59.6364 29.5570 178.9316 7 E 3.9105 7.9051 119.6924 58.7781 29.5014 179.5731 8 K 3.8696 8.2102 118.6544 59.4252 32.0858 179.3690 9 S 4.0562 8.2246 113.2205 61.3432 62.1930 176.0703 10 A 4.1071 8.1835 123.5676 54.9458 18.1763 179.8806 11 V 3.5529 7.7316 117.0482 66.4440 31.7891 178.4878 12 T 4.0077 8.0787 109.4284 64.6217 68.3841 176.2192 13 A 4.0217 8.2922 123.2426 55.0465 18.6727 179.1302 14 L 3.8932 7.8487 118.9302 57.9021 42.1377 178.9225 15 W 4.3086 8.5472 128.0514 60.0585 30.4216 178.0751 16 G 3.8178 8.0993 104.5168 46.7531 0.0000 174.6837 17 K 4.4898 7.8321 118.8240 55.1688 32.6964 176.1346 18 V 3.7782 6.8347 120.5575 61.5642 32.2379 175.7343 19 N 4.4547 8.3120 125.5146 52.6850 38.9650 175.4340 20 V 3.4560 8.1015 128.5580 66.0119 31.7890 177.3606 21 D 4.3257 8.0556 118.1097 57.2452 40.7365 178.1284 22 E 3.8547 8.3835 119.7025 59.4759 29.6184 179.1582 23 V 3.6080 8.0113 118.5642 65.6100 31.4975 178.2409 24 G 3.6890 8.5255 106.2911 47.6876 0.0000 175.9070 25 G 3.6213 8.1462 108.3671 47.3656 0.0000 175.4063 26 E 3.8543 8.3309 121.5032 58.9758 29.7321 178.8692 27 A 3.9123 8.2465 121.1692 55.0818 18.5089 179.3963 28 L 3.9886 8.1069 119.1189 58.1027 42.1318 179.4127 29 G 3.5416 8.0597 105.7545 47.9592 0.0000 175.9694 30 R 3.9094 8.2181 120.9350 58.5267 29.9920 178.8233 31 L 4.0003 7.9761 120.2925 58.3931 42.2381 179.2270 32 L 4.0756 7.8040 119.8479 56.7510 41.2304 179.6095 33 V 3.5950 7.3670 117.8193 65.6217 31.6681 177.8606 34 V 3.5969 8.0143 117.0642 64.0410 32.8228 175.5929 35 Y 3.8716 7.2987 115.9170 54.4383 37.7847 174.2076 36 P 4.8130 0.0000 0.0000 63.8277 31.9802 177.6847 37 W 4.3111 7.9722 115.7232 59.1662 28.1895 177.6748 38 T 4.2966 7.7837 110.4013 63.7279 68.2298 176.1515 39 Q 4.4211 8.3948 122.0258 58.3112 28.4533 178.1030 40 R 3.7837 7.5904 116.6280 58.9324 29.1638 177.9970 41 F 4.2147 7.1382 115.0225 57.9236 39.1964 176.0151 42 F 4.5033 7.9166 117.8536 56.8751 39.6236 177.0096 43 E 4.0200 8.3738 122.4534 58.9976 29.2986 177.9722 44 S 4.6469 8.0808 111.4511 58.6253 63.4241 174.6694 45 F 4.6084 8.4602 120.2130 58.2568 40.1182 176.1276 46 G 4.0509 8.0986 104.9150 44.1013 0.0000 174.9621 47 D 4.5601 8.6701 126.5242 53.9895 41.1315 175.5716 48 L 4.9028 8.3470 126.6512 54.4873 42.9844 178.0493 49 S 4.3083 8.3121 116.4711 60.6001 63.3934 174.5203 50 T 4.7450 7.4447 109.8519 58.2597 73.1384 172.6869 51 P 4.1917 0.0000 0.0000 66.0317 31.3338 178.7597 52 D 4.4121 8.0531 116.9018 57.1210 40.5567 178.4989 53 A 3.9866 7.6245 120.1743 55.0083 18.7037 179.5280 54 V 3.6856 7.9723 116.8634 66.6529 31.4770 178.3197 55 M 4.2445 8.4937 117.0863 57.4172 31.8037 177.9404 56 G 4.0311 7.6499 103.4898 43.2338 0.0000 172.9933 57 N 4.5639 7.7089 121.9032 52.2068 39.6434 174.1342 58 P 4.2482 0.0000 0.0000 65.8545 31.2534 178.7542 59 K 3.7007 8.9631 118.8409 58.7748 31.7789 179.4028 60 V 3.7499 7.9497 118.0859 66.1257 31.5824 177.9863 61 K 3.9023 8.1750 117.9410 59.4837 31.9972 179.2024 62 A 3.9921 8.0163 120.9556 55.3955 18.2106 179.1949 63 H 4.3714 8.7000 117.3189 59.4031 30.0183 177.7301 64 G 3.6132 8.5431 107.9816 47.5530 0.0000 175.6402 65 K 3.9936 8.1663 121.9260 59.1323 32.1320 178.9038 66 K 3.9744 7.8949 119.6663 59.4659 32.1869 178.9558 67 V 3.5976 8.0225 118.8034 66.1194 31.5687 177.7639 68 L 4.3949 8.1026 119.6743 57.5423 41.8338 178.9760 69 G 3.7880 8.4246 106.0322 47.7907 0.0000 175.6373 70 A 4.1142 8.1131 122.9763 54.6452 18.1651 179.4602 71 F 4.1094 8.2802 118.6440 61.5126 39.7897 176.7585 72 S 4.1940 8.8730 113.0169 61.8703 62.3259 175.8363 73 D 4.5015 8.5388 121.6338 57.5318 40.4823 179.2491 74 G 3.5935 8.0943 105.9377 47.5405 0.0000 175.4660 75 L 3.7494 7.3462 119.5684 56.4682 41.6127 178.2212 76 A 4.2839 7.4703 118.9525 52.4905 19.6588 176.5927 77 H 4.9092 8.0584 115.2796 54.8615 29.7434 175.7711 78 L 3.9610 7.9502 120.3248 57.8667 41.8455 178.6457 79 D 4.5413 7.9075 115.8864 55.6466 41.8039 175.9951 80 N 5.0076 8.2734 119.1270 51.3747 39.5617 175.4189 81 L 4.0998 7.9043 121.7185 57.7941 42.1161 179.4089 82 K 4.0855 8.0578 118.1753 59.4103 31.8691 179.4503 83 G 3.5647 8.0431 103.9403 48.2335 0.0000 175.1788 84 T 3.7600 7.4494 117.1574 65.4708 68.6350 175.5451 85 F 4.7551 7.7892 115.9509 56.6808 39.7045 177.0098 86 A 4.0724 7.7263 122.7172 55.9907 18.1846 180.2379 87 T 3.9012 7.8701 113.3389 66.7067 68.6035 176.8953 88 L 4.1405 8.0125 120.5427 57.6557 41.7226 179.4094 89 S 4.3321 8.5254 113.6283 61.5469 62.4069 175.9784 90 E 3.9070 8.2028 121.3009 59.3809 29.2083 179.1499 91 L 3.9529 8.0049 120.2598 58.5887 42.1173 178.7965 92 H 4.2965 8.5447 115.9062 58.4229 28.5143 177.1838 93 C 3.5899 7.6673 120.8098 62.2481 31.2112 175.3444 94 D 4.3055 8.3092 120.1175 56.2739 40.5072 177.3364 95 K 4.2869 7.7241 116.3545 57.6184 33.7599 177.2304 96 L 4.1987 7.6926 115.9922 54.6551 42.3546 176.1486 97 H 4.1625 7.1467 114.4254 56.6814 26.6296 175.3036 98 V 4.0300 7.9315 118.5464 60.8949 32.2958 174.7179 99 D 4.3359 8.8160 127.4647 53.8849 41.5257 175.1427 100 P 2.9855 0.0000 0.0000 64.3086 31.8182 177.9180 101 E 3.8644 8.1765 119.3132 59.3599 29.2403 178.4093 102 N 4.2868 8.1884 116.7911 56.2584 38.4803 177.3024 103 F 4.4361 7.3685 119.1940 60.5405 38.9067 177.9760 104 R 3.9864 7.8047 117.3947 59.0741 29.9262 178.7611 105 L 3.8013 7.7703 118.8205 57.6507 41.5405 179.3781 106 L 4.0312 8.2156 120.4770 58.0077 42.0339 178.9272 107 G 3.8077 8.2193 105.7637 48.2946 0.0000 175.3469 108 N 4.4709 8.2593 118.8942 55.8949 38.5855 177.8272 109 V 3.6669 8.1887 120.0769 65.7568 31.5071 177.8886 110 L 3.9104 8.3701 120.7608 58.0322 41.9236 179.0850 111 V 3.5658 7.8578 118.2805 66.1729 31.3811 177.8060 112 C 4.0956 8.0462 116.3909 62.7868 27.8839 176.2657 113 V 3.5119 7.7642 119.8006 65.9613 31.1058 178.0648 114 L 3.8633 7.9667 118.6899 57.5999 41.3192 179.4160 115 A 3.7278 7.2479 120.7347 55.2045 18.0694 179.2026 116 H 4.1365 8.0237 116.1245 59.6266 29.9956 176.7418 117 H 3.9286 8.2762 119.6258 58.0991 29.9572 176.2281 118 F 4.8117 8.2515 117.3187 55.4541 40.5267 177.2457 119 G 3.8782 8.8603 108.7758 45.9688 0.0000 177.6500 120 K 4.1272 8.8960 123.2495 59.1630 32.2977 177.6031 121 E 4.0894 8.1441 119.7879 58.2899 29.9426 177.0370 122 F 4.5353 8.2238 123.3004 57.2266 37.8792 175.3147 123 T 4.2108 7.3590 115.8462 59.9734 71.3960 173.5546 124 P 4.1589 0.0000 0.0000 65.6666 31.3841 177.2835 125 P 4.2370 0.0000 0.0000 65.2441 31.2594 178.9431 126 V 3.5585 7.3780 117.4181 65.7740 31.3350 177.8383 127 Q 3.5998 7.9588 119.5314 58.9800 28.9344 178.0185 128 A 3.9963 8.1055 121.5779 55.1511 18.4439 179.4480 129 A 3.8952 7.9357 119.0140 55.6989 18.4383 179.5836 130 Y 3.8637 8.3164 115.1450 61.1433 37.8819 178.7746 131 Q 4.1207 8.6196 119.6993 58.8513 28.7971 178.8329 132 K 4.0039 8.0706 119.5276 59.3582 31.9724 179.6505 133 V 3.5236 7.5442 118.0901 66.0990 31.4067 178.6261 134 V 3.7957 8.2542 112.1338 64.1749 31.2697 178.4613 135 A 4.1061 8.2033 121.0285 54.9298 18.2074 179.8830 136 G 3.5134 8.2142 104.3120 47.8651 0.0000 176.1076 137 V 3.3187 8.0609 121.0390 65.4945 31.3580 177.7355 138 A 3.9077 7.8260 119.1513 55.4247 18.4818 179.0135 139 N 4.4218 8.4896 114.8838 56.4777 38.5003 177.5677 140 A 4.0428 8.0570 122.1169 55.1409 18.2830 179.6336 141 L 3.8672 7.8277 116.0772 56.7413 41.9634 178.4273 142 A 4.5099 7.6410 119.1416 52.7310 19.1563 178.3024 143 H 4.2491 8.0116 117.0103 58.4023 29.9731 175.7991 144 K 4.4924 7.9850 117.4933 56.1407 32.2329 176.1976 145 Y 4.1816 7.9591 117.6823 58.4254 38.3825 175.7506 146 H 4.4624 8.4281 117.9376 56.1523 28.3019 173.2516 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 4.29 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00 2 H 8.79 4.48 0.00 3.22 3.18 0.00 5.72 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 3 L 7.82 4.71 0.00 1.51 1.41 0.79 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.17 4.23 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 1.18 0.00 0.00 5 P 0.00 4.19 0.00 2.15 2.13 0.00 3.57 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 2.13 0.00 6 E 8.06 3.93 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 7.91 3.91 0.00 2.18 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 2.29 2.32 0.00 8 K 8.21 3.87 0.00 1.85 1.80 0.00 1.60 0.00 0.00 1.49 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.35 7.81 9 S 8.22 4.06 0.00 3.88 4.04 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 0.00 0.00 0.00 10 A 8.18 4.11 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 11 V 7.73 3.55 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 0.62 0.00 0.00 0.50 0.00 0.00 12 T 8.08 4.01 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 13 A 8.29 4.02 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 14 L 7.85 3.89 0.00 1.73 1.87 0.04 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.55 4.31 0.00 3.84 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 16 G 8.10 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 17 K 7.83 4.49 0.00 1.96 2.08 0.00 1.70 0.00 0.00 1.55 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.46 7.81 18 V 6.83 3.78 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 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 19 N 8.31 4.45 0.00 2.72 2.60 0.00 0.00 6.85 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 8.10 3.46 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 1.27 0.00 0.00 0.92 0.00 0.00 21 D 8.06 4.33 0.00 2.91 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 8.38 3.85 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 23 V 8.01 3.61 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.66 0.00 0.00 24 G 8.53 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 25 G 8.15 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.33 3.85 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 27 A 8.25 3.91 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 28 L 8.11 3.99 0.00 1.82 1.63 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.06 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.22 3.91 0.00 1.89 1.93 0.00 3.09 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 31 L 7.98 4.00 0.00 1.86 1.86 0.96 0.46 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 32 L 7.80 4.08 0.00 1.83 1.67 0.67 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.37 3.59 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.93 0.00 0.00 34 V 8.01 3.60 1.60 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 -0.14 0.00 0.00 0.76 0.00 0.00 35 Y 7.30 3.87 0.00 2.54 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 36 P 0.00 4.81 0.00 2.24 2.10 0.00 3.90 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.09 0.00 37 W 7.97 4.31 0.00 3.54 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 38 T 7.78 4.30 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 1.14 0.00 0.00 39 Q 8.39 4.42 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 40 R 7.59 3.78 0.00 1.70 2.01 0.00 2.95 0.00 0.00 2.54 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 7.14 4.21 0.00 1.61 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 0.00 0.00 0.00 0.00 42 F 7.92 4.50 0.00 2.76 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 0.00 0.00 0.00 43 E 8.37 4.02 0.00 1.96 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 2.27 2.21 0.00 44 S 8.08 4.65 0.00 4.10 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.46 4.61 0.00 3.18 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 46 G 8.10 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 0.00 0.00 0.00 0.00 47 D 8.67 4.56 0.00 2.65 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 48 L 8.35 4.90 0.00 1.65 1.62 0.98 1.03 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 49 S 8.31 4.31 0.00 4.02 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 50 T 7.44 4.75 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.05 4.41 0.00 2.67 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 53 A 7.62 3.99 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 54 V 7.97 3.69 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 1.05 0.00 0.00 0.96 0.00 0.00 55 M 8.49 4.24 0.00 1.95 2.10 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.89 0.00 56 G 7.65 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 57 N 7.71 4.56 0.00 2.98 2.82 0.00 0.00 6.91 7.47 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 58 P 0.00 4.25 0.00 2.24 2.26 0.00 3.73 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.96 3.70 0.00 1.51 0.74 0.00 1.13 0.00 0.00 1.33 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.26 1.53 7.81 60 V 7.95 3.75 2.27 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 1.13 0.00 0.00 1.05 0.00 0.00 61 K 8.17 3.90 0.00 1.95 1.83 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.55 7.81 62 A 8.02 3.99 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 63 H 8.70 4.37 0.00 3.55 3.50 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 8.54 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.17 3.99 0.00 1.86 2.02 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.47 1.69 7.81 66 K 7.89 3.97 0.00 1.97 2.00 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.52 7.81 67 V 8.02 3.60 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.87 0.00 0.00 68 L 8.10 4.39 0.00 2.07 1.80 0.79 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.42 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 0.00 0.00 0.00 70 A 8.11 4.11 1.49 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 0.00 0.00 0.00 71 F 8.28 4.11 0.00 3.05 3.36 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 72 S 8.87 4.19 0.00 4.52 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 0.00 73 D 8.54 4.50 0.00 2.84 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 74 G 8.09 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.35 3.75 0.00 1.48 1.43 -0.35 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.47 4.28 1.15 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 0.00 0.00 77 H 8.06 4.91 0.00 3.07 3.14 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.95 3.96 0.00 1.54 1.64 0.77 0.94 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 79 D 7.91 4.54 0.00 2.64 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 8.27 5.01 0.00 2.68 2.61 0.00 0.00 7.10 6.21 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 81 L 7.90 4.10 0.00 1.76 1.83 0.85 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.06 4.09 0.00 1.75 1.80 0.00 1.54 0.00 0.00 1.40 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.45 7.81 83 G 8.04 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.45 3.76 3.97 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 0.00 0.00 0.43 0.00 0.00 85 F 7.79 4.76 0.00 3.13 2.92 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 86 A 7.73 4.07 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 87 T 7.87 3.90 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 88 L 8.01 4.14 0.00 2.06 1.87 1.19 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.53 4.33 0.00 4.02 4.15 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 90 E 8.20 3.91 0.00 2.07 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 2.33 2.58 0.00 91 L 8.00 3.95 0.00 1.78 1.83 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.54 4.30 0.00 3.55 3.71 0.00 5.86 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 7.67 3.59 0.00 1.24 2.55 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 0.00 0.00 0.00 0.00 94 D 8.31 4.31 0.00 2.72 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 95 K 7.72 4.29 0.00 1.83 1.78 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.35 7.81 96 L 7.69 4.20 0.00 1.73 1.62 0.70 1.10 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 7.15 4.16 0.00 3.54 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.93 4.03 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 0.25 0.00 0.00 0.54 0.00 0.00 99 D 8.82 4.34 0.00 2.78 2.59 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 0.00 0.00 0.00 0.00 100 P 0.00 2.99 0.00 1.93 1.78 0.00 3.40 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.49 0.00 101 E 8.18 3.86 0.00 2.03 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 0.00 2.32 2.40 0.00 102 N 8.19 4.29 0.00 2.47 2.75 0.00 0.00 6.94 8.42 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 0.00 103 F 7.37 4.44 0.00 3.08 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 0.00 104 R 7.80 3.99 0.00 1.99 1.97 0.00 3.28 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 105 L 7.77 3.80 0.00 1.69 1.30 0.72 -0.09 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 0.00 106 L 8.22 4.03 0.00 1.78 1.84 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.22 3.81 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 0.00 108 N 8.26 4.47 0.00 2.93 2.94 0.00 0.00 6.70 7.79 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 0.00 109 V 8.19 3.67 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 1.04 0.00 0.00 1.16 0.00 0.00 110 L 8.37 3.91 0.00 1.73 1.81 0.92 0.26 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 0.00 111 V 7.86 3.57 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 1.28 0.00 0.00 1.18 0.00 0.00 112 C 8.05 4.10 0.00 3.20 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 3.51 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 1.03 0.00 0.00 0.89 0.00 0.00 114 L 7.97 3.86 0.00 1.11 1.17 0.74 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.25 3.73 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 0.00 116 H 8.02 4.14 0.00 3.14 3.42 0.00 5.78 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 0.00 117 H 8.28 3.93 0.00 2.95 2.84 0.00 5.96 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 8.25 4.81 0.00 3.29 3.05 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 0.00 119 G 8.86 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 0.00 120 K 8.90 4.13 0.00 1.92 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.48 7.81 121 E 8.14 4.09 0.00 2.07 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 0.00 2.32 2.27 0.00 122 F 8.22 4.54 0.00 3.03 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 0.00 123 T 7.36 4.21 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.24 0.00 2.11 2.06 0.00 3.48 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.38 3.56 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.89 0.00 0.00 127 Q 7.96 3.60 0.00 1.68 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 128 A 8.11 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 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.94 3.90 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 8.32 3.86 0.00 3.35 3.31 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 0.00 131 Q 8.62 4.12 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.73 2.62 0.00 132 K 8.07 4.00 0.00 1.96 1.83 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 133 V 7.54 3.52 1.93 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 0.89 0.00 0.00 0.75 0.00 0.00 134 V 8.25 3.80 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 0.97 0.00 0.00 1.13 0.00 0.00 135 A 8.20 4.11 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.21 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 0.00 0.00 0.00 137 V 8.06 3.32 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 0.80 0.00 0.00 138 A 7.83 3.91 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 0.00 139 N 8.49 4.42 0.00 2.92 2.89 0.00 0.00 6.96 7.75 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 0.00 140 A 8.06 4.04 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 0.00 141 L 7.83 3.87 0.00 1.07 0.64 -0.05 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.64 4.51 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 8.01 4.25 0.00 3.34 3.44 0.00 5.74 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.99 4.49 0.00 1.87 1.85 0.00 1.88 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.52 1.78 7.81 145 Y 7.96 4.18 0.00 3.13 2.97 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 0.00 0.00 0.00 146 H 8.43 4.46 0.00 3.21 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