NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.4624 8.4293 116.2145 55.1132 30.3529 173.2669 2 C 4.1630 7.6829 114.1315 56.8888 30.0707 172.0017 3 D 4.5681 8.4100 118.4611 55.2323 40.0647 175.6682 4 L 4.0829 8.0795 120.2527 56.9856 42.2571 175.7508 5 P 4.5695 0.0000 0.0000 62.5047 32.1182 175.6029 6 C 4.2408 8.5144 114.0424 58.0037 30.4986 174.9022 7 G 3.9752 8.2823 107.6596 45.4861 0.0000 172.9118 8 V 4.3151 7.2141 119.2499 61.0988 32.7370 174.4507 9 Y 4.7315 8.1940 123.5346 56.6922 42.1332 174.2980 10 D 3.8814 8.1071 120.0242 51.5437 44.1430 174.4764 11 P 4.0926 0.0000 0.0000 65.0139 31.1498 178.0893 12 A 3.9793 8.6102 120.2883 55.0331 17.6039 179.6415 13 Q 3.7715 8.0074 116.5587 59.0700 28.7062 178.8277 14 A 4.0720 7.7923 121.2150 55.0550 18.5166 179.4127 15 R 3.8281 8.0923 117.3528 59.7687 30.1955 178.8287 16 I 3.7817 8.0524 119.8669 64.4455 37.0822 178.3603 17 E 3.9961 7.9815 118.2098 59.3223 29.2851 179.2557 18 A 4.0617 8.2950 120.9836 55.0794 18.3052 179.5119 19 E 3.9538 8.7834 117.9471 59.5318 29.4976 179.7138 20 S 4.1083 8.0802 114.4194 61.2805 63.0431 176.5934 21 V 3.5368 7.8522 121.9153 65.7353 31.1887 177.9521 22 K 4.1185 8.2364 119.0142 59.4632 31.9613 178.5744 23 A 4.2510 8.2973 122.7694 54.5841 18.1983 179.7645 24 V 3.5364 8.2742 117.1678 66.1957 31.6373 178.0988 25 Q 4.0090 8.1963 117.7816 59.1975 28.4137 178.9325 26 E 3.9889 8.4583 119.5650 59.5364 29.5256 179.7163 27 K 4.2007 8.4242 118.5285 59.6321 31.8636 179.3405 28 M 4.3829 8.3718 118.4278 58.0950 31.9059 177.5521 29 A 4.1647 7.9863 120.4379 53.7746 18.7632 178.1058 30 G 3.9355 7.8286 103.1370 45.0643 0.0000 173.5071 31 N 4.5257 7.7224 118.7564 52.5208 39.6159 173.1228 32 D 4.6820 8.5261 124.2528 53.1730 40.1490 176.7118 33 D 4.3750 8.4131 120.8653 54.5511 42.0046 174.9190 34 P 4.2724 0.0000 0.0000 66.0742 31.4245 178.0896 35 H 4.1660 8.3269 116.4518 59.1761 29.8307 176.8148 36 F 4.0548 8.5721 122.4778 61.4899 39.2306 177.0541 37 Q 3.9779 8.5231 117.8247 59.2818 28.4934 179.0755 38 T 3.8247 8.1056 116.8129 66.6673 68.4368 176.9123 39 R 3.7684 7.9303 119.7518 59.1901 30.0327 178.9468 40 A 3.7152 7.8763 120.8299 55.3051 18.2565 179.8821 41 T 3.7464 7.7384 114.1957 66.5737 68.6290 176.8614 42 V 3.5167 7.7445 120.1654 66.3449 31.4525 178.2460 43 I 3.8703 7.8489 119.3998 64.1226 36.9481 178.2090 44 K 3.8249 8.3953 121.0032 59.5440 31.9631 178.3672 45 E 3.9161 8.1493 119.4345 59.3746 29.5852 178.8704 46 Q 3.9633 7.9487 117.7767 59.1472 28.7786 179.0262 47 R 3.9634 8.2804 119.0263 59.0054 30.0943 178.9328 48 A 3.9905 8.1734 120.7956 55.0063 18.3653 179.2514 49 E 3.8786 8.1664 117.8335 59.4034 29.6923 179.0282 50 L 3.9214 7.9098 118.7273 57.7831 41.6895 179.3193 51 A 4.0678 8.1938 120.6849 55.1250 18.2007 179.7952 52 K 3.8991 8.1992 116.9519 59.7845 32.0878 178.9196 53 H 4.1057 8.2429 118.3850 59.7243 29.8099 176.9479 54 H 4.2128 8.2481 117.9283 58.8932 28.6268 178.0237 55 V 3.6477 8.0182 120.0284 66.0082 31.3097 177.9094 56 S 4.2866 8.4239 113.2802 61.5972 62.1429 176.3884 57 V 3.7044 8.0875 120.9384 65.8578 31.1934 177.7703 58 L 4.0118 8.1439 118.8677 57.7865 41.3156 179.4623 59 W 4.7149 8.2552 126.7506 60.6638 30.8127 177.8160 60 S 4.0334 8.6430 113.4496 60.5650 62.8370 175.1358 61 D 4.7335 8.3234 120.9220 55.5355 41.9395 177.3369 62 Y 3.4934 7.5600 118.6491 59.9600 39.0706 175.6641 63 F 4.1444 7.8635 117.6133 57.0409 39.7285 174.8218 64 K 4.6852 7.9746 121.9963 53.0404 36.2225 175.3204 65 P 4.4912 0.0000 0.0000 65.8730 31.0583 177.2306 66 P 4.2294 0.0000 0.0000 65.6838 31.0991 178.4263 67 H 4.3865 7.9970 115.3485 58.9139 28.4926 177.8600 68 F 4.4094 7.6222 119.0794 60.2560 38.4923 177.3147 69 E 3.9713 8.2231 118.6496 59.2437 29.6006 178.5081 70 K 4.0155 7.9494 118.3551 57.9492 33.6373 176.4004 71 Y 4.9113 8.2049 117.0437 54.3021 37.5767 174.2797 72 P 4.7211 0.0000 0.0000 63.9547 31.8172 178.1107 73 E 4.2676 8.1612 116.6194 57.4198 30.5656 178.2466 74 L 3.9897 8.2827 122.6041 58.5304 42.0575 178.1991 75 H 4.2978 8.2770 115.7448 59.2166 28.6527 177.4100 76 Q 3.8672 8.0440 120.6655 58.7753 28.8955 177.6478 77 L 3.8261 8.0637 121.6474 58.0995 42.1411 179.1669 78 V 3.3831 7.9490 118.5277 65.9203 31.3536 177.4388 79 N 3.9756 7.8419 116.7485 56.7561 38.6331 176.6112 80 D 4.0868 8.0360 120.4188 57.2222 40.7838 178.9279 81 T 3.4655 7.5138 116.4142 66.4411 68.4624 176.7442 82 L 3.9401 7.7716 120.8626 57.7584 41.6222 179.7608 83 K 3.9234 8.1257 118.2912 59.3334 31.9268 179.2902 84 A 4.0540 8.1481 121.4943 55.2222 18.2632 179.3904 85 M 4.0161 8.1869 116.8852 58.8667 32.3427 178.5946 86 S 4.1030 8.2462 115.1795 61.6031 62.7573 176.5945 87 A 4.0265 8.0224 122.3506 55.0066 18.5037 179.2635 88 A 4.1621 7.9707 120.8089 54.4512 18.2026 179.7548 89 K 3.9458 8.0587 116.6217 59.7468 32.3223 179.0965 90 G 3.8129 7.6813 102.2175 44.9772 0.0000 173.1492 91 S 4.7935 7.1300 114.1223 56.4712 65.3687 173.6866 92 K 4.2951 8.4375 122.4084 56.3388 32.7112 176.2366 93 D 4.5516 8.2532 121.1622 52.9177 41.3439 175.2144 94 P 4.9843 0.0000 0.0000 64.7317 31.2376 178.3319 95 A 4.1298 8.5501 120.3399 55.0172 17.8224 179.7306 96 T 3.9749 8.2203 109.1871 64.8310 68.9590 177.2256 97 G 3.6198 8.1535 108.1796 47.5914 0.0000 175.2594 98 Q 3.9878 8.5270 122.5378 58.6723 29.0552 178.2424 99 K 3.7997 8.3282 120.6172 59.3839 32.1707 178.5631 100 A 4.1900 8.0423 121.0344 55.3228 18.2402 179.5159 101 L 3.9589 8.0898 117.3964 58.1798 41.5457 179.5942 102 D 4.3212 8.3923 119.0188 57.4764 40.6841 178.4648 103 Y 4.2445 8.0817 117.3375 61.1583 37.8979 178.4407 104 I 3.7736 8.2524 120.8057 64.4211 37.1128 178.3546 105 A 4.2438 8.3812 121.7296 55.0676 18.1760 179.7952 106 Q 3.9746 7.9164 116.6932 59.2185 28.8406 178.8997 107 I 3.7511 7.8302 120.8569 64.4231 37.1608 177.9057 108 D 4.4322 8.7745 119.2066 57.1963 41.1516 178.1438 109 K 4.0717 8.4405 120.2603 59.6968 32.2531 178.7469 110 I 3.4693 7.5991 119.3718 64.2443 36.7686 177.7819 111 F 3.9887 8.4850 120.4117 61.5959 39.3947 177.1896 112 W 4.3106 8.4231 117.9810 59.6058 28.8361 178.4543 113 E 4.1403 8.3608 118.9160 59.5865 28.7281 179.2636 114 T 4.1153 7.7581 108.2819 63.9112 68.9839 176.1167 115 K 4.1045 7.4127 119.7310 57.6248 32.3560 176.8641 116 K 4.2253 7.7811 122.9526 56.5374 32.1225 176.4794 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 H 8.43 4.46 0.00 3.19 3.17 0.00 5.48 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.68 4.16 0.00 3.12 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 3 D 8.41 4.57 0.00 2.87 2.84 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 4 L 8.08 4.08 0.00 1.60 1.75 0.91 0.98 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 5 P 0.00 4.57 0.00 2.28 2.09 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 6 C 8.51 4.24 0.00 3.01 2.99 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 7 G 8.28 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 8 V 7.21 4.32 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 0.88 0.00 0.00 0.91 0.00 0.00 9 Y 8.19 4.73 0.00 2.80 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 10 D 8.11 3.88 0.00 2.62 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.09 0.00 2.26 1.94 0.00 2.99 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.28 0.00 12 A 8.61 3.98 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 13 Q 8.01 3.77 0.00 1.79 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 14 A 7.79 4.07 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 15 R 8.09 3.83 0.00 1.89 2.06 0.00 3.15 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.69 0.00 16 I 8.05 3.78 1.86 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 1.52 0.55 0.91 0.00 0.00 17 E 7.98 4.00 0.00 2.06 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 0.00 2.55 2.55 0.00 18 A 8.29 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 19 E 8.78 3.95 0.00 2.16 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 2.34 2.50 0.00 20 S 8.08 4.11 0.00 4.07 4.13 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 21 V 7.85 3.54 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.97 0.00 0.00 22 K 8.24 4.12 0.00 1.88 1.92 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.19 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.62 7.81 23 A 8.30 4.25 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 24 V 8.27 3.54 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 1.09 0.00 0.00 0.96 0.00 0.00 25 Q 8.20 4.01 0.00 2.31 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 26 E 8.46 3.99 0.00 2.19 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 2.34 2.48 0.00 27 K 8.42 4.20 0.00 2.08 2.17 0.00 1.77 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.66 7.81 28 M 8.37 4.38 0.00 2.03 2.34 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.55 0.00 29 A 7.99 4.16 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 30 G 7.83 3.94 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 0.00 0.00 0.00 31 N 7.72 4.53 0.00 2.21 2.12 0.00 0.00 7.10 8.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.53 4.68 0.00 2.83 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 33 D 8.41 4.38 0.00 2.85 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.27 0.00 2.24 2.12 0.00 3.70 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 2.14 2.18 0.00 35 H 8.33 4.17 0.00 3.25 3.60 0.00 5.87 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.57 4.05 0.00 3.13 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 37 Q 8.52 3.98 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.70 2.62 0.00 38 T 8.11 3.82 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 1.17 0.00 0.00 39 R 7.93 3.77 0.00 1.70 1.80 0.00 3.00 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 40 A 7.88 3.72 0.97 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 0.00 0.00 41 T 7.74 3.75 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 1.18 0.00 0.00 42 V 7.74 3.52 2.17 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 0.99 0.00 0.00 0.96 0.00 0.00 43 I 7.85 3.87 1.86 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.43 0.87 0.00 0.00 44 K 8.40 3.82 0.00 1.79 1.96 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.15 3.92 0.00 2.28 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 2.29 2.38 0.00 46 Q 7.95 3.96 0.00 2.31 2.12 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 2.36 2.52 0.00 47 R 8.28 3.96 0.00 1.81 2.11 0.00 3.28 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.78 0.00 48 A 8.17 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 49 E 8.17 3.88 0.00 2.19 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 2.39 0.00 50 L 7.91 3.92 0.00 1.95 1.69 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.19 4.07 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 52 K 8.20 3.90 0.00 1.99 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.66 7.81 53 H 8.24 4.11 0.00 3.23 3.42 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 H 8.25 4.21 0.00 3.38 3.30 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.02 3.65 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 1.00 0.00 0.00 1.02 0.00 0.00 56 S 8.42 4.29 0.00 4.04 4.02 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 57 V 8.09 3.70 2.26 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 1.32 0.00 0.00 0.88 0.00 0.00 58 L 8.14 4.01 0.00 2.11 1.84 0.83 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.26 4.71 0.00 3.46 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 60 S 8.64 4.03 0.00 4.00 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 61 D 8.32 4.73 0.00 3.01 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 62 Y 7.56 3.49 0.00 1.43 2.51 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 63 F 7.86 4.14 0.00 3.21 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 0.00 0.00 0.00 0.00 64 K 7.97 4.69 0.00 1.44 1.49 0.00 1.46 0.00 0.00 1.68 0.00 0.00 2.75 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.35 7.81 65 P 0.00 4.49 0.00 2.16 2.19 0.00 3.56 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 2.14 2.29 0.00 66 P 0.00 4.23 0.00 1.97 2.01 0.00 3.37 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.09 0.00 67 H 8.00 4.39 0.00 2.84 3.22 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 7.62 4.41 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 69 E 8.22 3.97 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 70 K 7.95 4.02 0.00 1.62 1.51 0.00 1.61 0.00 0.00 1.46 0.00 0.00 2.66 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.30 1.02 7.81 71 Y 8.20 4.91 0.00 3.11 2.88 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 72 P 0.00 4.72 0.00 2.21 2.21 0.00 3.44 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.93 0.00 73 E 8.16 4.27 0.00 2.18 2.29 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 2.40 2.30 0.00 74 L 8.28 3.99 0.00 1.83 1.94 0.60 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.28 4.30 0.00 3.23 3.33 0.00 5.67 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 8.04 3.87 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 77 L 8.06 3.83 0.00 1.87 1.86 1.13 0.73 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 78 V 7.95 3.38 1.54 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 0.54 0.00 0.00 1.00 0.00 0.00 79 N 7.84 3.98 0.00 2.58 2.70 0.00 0.00 7.27 8.09 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 80 D 8.04 4.09 0.00 2.35 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 T 7.51 3.47 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 1.22 0.00 0.00 82 L 7.77 3.94 0.00 1.68 1.62 0.76 0.77 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 83 K 8.13 3.92 0.00 1.80 1.80 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.47 7.81 84 A 8.15 4.05 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 M 8.19 4.02 0.00 2.24 2.07 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.79 0.00 86 S 8.25 4.10 0.00 4.07 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 87 A 8.02 4.03 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 88 A 7.97 4.16 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 89 K 8.06 3.95 0.00 1.95 2.02 0.00 1.69 0.00 0.00 1.90 0.00 0.00 3.20 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.62 7.81 90 G 7.68 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 91 S 7.13 4.79 0.00 3.88 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 92 K 8.44 4.30 0.00 1.79 1.84 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.41 7.81 93 D 8.25 4.55 0.00 2.75 2.56 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 94 P 0.00 4.98 0.00 2.20 2.10 0.00 3.94 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 95 A 8.55 4.13 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 96 T 8.22 3.97 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 1.22 0.00 0.00 97 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 98 Q 8.53 3.99 0.00 2.14 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 99 K 8.33 3.80 0.00 1.95 1.94 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.30 7.81 100 A 8.04 4.19 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 0.00 101 L 8.09 3.96 0.00 1.90 1.75 0.93 0.99 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 0.00 102 D 8.39 4.32 0.00 2.68 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 0.00 103 Y 8.08 4.24 0.00 3.22 2.88 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 0.00 104 I 8.25 3.77 2.04 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 1.50 0.80 0.94 0.00 0.00 105 A 8.38 4.24 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 0.00 106 Q 7.92 3.97 0.00 2.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 107 I 7.83 3.75 2.07 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.73 1.10 0.00 0.00 108 D 8.77 4.43 0.00 2.88 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 0.00 109 K 8.44 4.07 0.00 2.06 2.03 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.58 7.81 110 I 7.60 3.47 1.82 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.74 -0.09 0.00 0.00 111 F 8.48 3.99 0.00 2.89 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 0.00 112 W 8.42 4.31 0.00 3.58 3.28 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 0.00 113 E 8.36 4.14 0.00 2.34 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 0.00 2.46 2.66 0.00 114 T 7.76 4.12 4.18 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 0.00 0.00 0.00 1.38 0.00 0.00 115 K 7.41 4.10 0.00 1.98 1.96 0.00 1.57 0.00 0.00 1.39 0.00 0.00 2.39 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.48 0.73 7.81 116 K 7.78 4.23 0.00 1.82 1.76 0.00 1.81 0.00 0.00 1.80 0.00 0.00 3.14 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.68 7.81