NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4562 8.3193 116.7989 58.8198 64.5054 173.5306 3 T 4.4050 7.9002 113.5636 59.5677 71.7815 172.7218 4 L 3.8091 8.9743 121.5817 59.2915 42.8878 180.1188 5 Y 4.2312 8.2150 118.6954 60.9416 38.3952 178.0164 6 E 3.6856 7.9199 119.6708 59.2902 29.7074 178.9936 7 K 4.0009 7.9184 116.3903 58.6957 32.2899 178.4106 8 L 4.3652 7.4854 117.1932 54.2563 42.4467 177.0166 9 G 3.7819 7.1942 107.0508 45.9239 0.0000 173.0556 10 G 3.5487 7.8542 104.9298 44.1457 0.0000 175.3698 11 T 3.9988 8.9175 114.1203 67.1107 68.1972 177.0700 12 T 3.8924 7.9085 116.7994 66.4740 68.6177 176.5012 13 A 3.9620 7.9581 122.2359 55.2146 18.3646 179.7331 14 V 3.4606 7.8521 116.6341 66.0683 31.5662 177.6503 15 D 4.3019 8.6031 118.1808 57.2248 41.0788 177.8096 16 L 3.9217 8.2139 120.8095 58.1902 42.0732 178.5811 17 A 4.0370 7.9492 120.5091 55.4648 18.3217 179.8812 18 V 3.7640 8.0789 116.6225 66.2913 31.5568 177.9865 19 D 4.5055 8.4342 118.8818 57.3675 40.6407 178.9928 20 K 4.0488 8.2830 119.0610 59.2728 32.0453 179.2443 21 F 4.5383 8.3556 122.3116 61.0015 39.3563 176.2555 22 Y 3.8161 8.4646 119.5769 60.8089 38.2916 177.8427 23 E 3.5904 8.1879 118.7141 59.1726 29.8656 178.4912 24 R 3.9708 8.1067 118.7191 59.4310 30.2032 178.6908 25 V 3.4426 7.6849 118.1442 65.7562 31.2177 177.5450 26 L 3.7014 7.6056 119.5988 57.6543 41.7965 178.0639 27 Q 4.6107 7.3437 114.9200 54.6147 29.3178 174.9454 28 D 4.6843 7.6573 121.8417 52.4993 40.8760 176.7190 29 D 4.5399 8.5304 127.3012 56.6536 41.1588 178.4431 30 R 4.1860 8.0715 118.0212 58.1803 30.3543 177.2718 31 I 4.8820 7.5768 108.2436 59.8878 39.3657 177.2206 32 K 4.1242 8.2868 121.7054 60.2341 32.3358 178.6085 33 H 4.2995 7.8621 113.2460 57.3778 28.6260 176.3187 34 F 4.0809 7.5806 118.6640 59.6069 38.9837 175.9943 35 F 4.6574 8.1789 118.5064 56.9961 38.9357 177.4735 36 A 4.0673 8.1355 126.4257 54.8260 18.2218 178.6828 37 D 4.8600 8.0461 112.8882 52.8577 39.7756 175.9304 38 V 4.4108 7.6473 119.2336 60.9782 34.0298 175.8103 39 D 4.7680 8.4647 126.8485 52.8696 41.9243 177.3104 40 M 4.1246 8.4931 118.3650 58.4168 31.8810 178.6685 41 A 3.8726 7.9865 120.4934 55.1929 18.5566 179.4622 42 K 3.9615 8.3281 117.9228 59.3911 32.3996 178.9085 43 Q 3.9151 8.3264 120.1627 59.0986 28.9657 178.2313 44 R 3.7562 8.1291 119.6320 59.3175 30.0295 178.3766 45 A 4.0321 8.0970 120.6004 55.1814 18.1988 179.1510 46 H 4.1024 8.3108 117.0666 59.6793 29.9931 177.6240 47 Q 3.9578 8.0126 119.5540 58.5759 28.3773 178.5899 48 K 4.0717 8.3734 120.7626 59.2910 32.2107 178.6810 49 A 4.2134 8.1936 122.4590 54.6297 18.2751 179.2218 50 F 3.8731 8.4526 119.4194 61.4457 39.5747 176.9829 51 L 4.1444 8.5744 119.8713 58.6423 41.8373 179.1125 52 T 4.0134 8.2310 115.7172 66.7381 68.5166 175.9149 53 Y 4.2073 8.4790 121.6720 60.8951 38.7679 178.2277 54 A 3.5474 8.0410 121.2375 54.0491 18.1529 178.4565 55 F 4.3854 7.6560 114.5786 57.3107 39.1846 176.3834 56 G 4.0642 7.7642 106.8147 45.4463 0.0000 174.2328 57 G 4.1596 8.0014 108.0899 45.3609 0.0000 176.6388 58 T 4.4045 8.7196 119.0515 67.3609 68.9634 178.0188 59 D 4.3009 7.0113 119.8425 56.7586 41.2082 177.7546 60 K 4.4073 7.2893 113.4559 56.1689 32.8613 176.7151 61 Y 4.9541 7.7609 116.7829 55.3096 37.8963 174.3632 62 D 4.5300 8.2444 119.5970 54.9350 43.0760 176.6691 63 G 4.1460 8.8770 114.0927 47.5317 0.0000 175.9418 64 R 4.0086 8.6767 120.3716 59.1748 29.9747 178.4291 65 Y 4.3658 8.0853 119.0599 61.0603 38.5368 177.7305 66 M 3.9750 8.3134 119.7233 58.1910 31.7932 178.7781 67 R 4.0844 8.0490 118.1514 59.5286 30.5130 177.9341 68 E 4.0879 8.2406 118.8240 59.2422 29.4428 178.5951 69 A 4.0216 8.3124 120.2143 54.3725 18.6632 178.2112 70 H 4.6886 7.6438 111.9510 55.2385 29.6147 176.0112 71 K 4.2886 7.7098 125.0367 59.2443 31.9792 178.5330 72 E 4.0907 8.1582 118.0204 59.0787 29.3891 179.1955 73 L 4.1164 7.8630 118.9645 57.7877 41.5472 179.4562 74 V 3.6331 7.7178 117.0444 66.0531 31.5675 177.5327 75 E 4.2362 8.1848 117.0706 58.2027 29.6012 177.2202 76 N 4.8782 8.4336 114.0375 53.4085 40.8247 174.9031 77 H 4.6221 8.3739 112.3248 54.7494 29.7836 174.6255 78 G 3.9305 8.3289 107.0072 46.1056 0.0000 173.6606 79 L 4.0342 8.1414 122.0692 54.8924 42.6517 175.8922 80 N 4.9751 8.6712 121.6143 50.7963 40.2471 174.7010 81 G 3.6664 8.8869 103.6371 48.1552 0.0000 174.9410 82 E 3.9457 8.1681 121.1917 59.5539 29.6681 178.8131 83 H 4.1778 8.1306 115.3295 58.8084 28.9062 177.1113 84 F 3.8062 8.1230 122.3738 61.7220 39.1766 177.0090 85 D 4.5680 8.7746 118.3312 57.3043 40.5400 178.6522 86 A 4.0730 7.9895 121.4600 54.9569 18.3340 179.8929 87 V 3.3651 7.5685 116.0400 65.9313 31.5873 178.0908 88 A 4.0841 7.6810 120.3650 55.2779 18.2928 178.8883 89 E 3.8914 8.5998 118.2107 59.8655 29.5910 178.9173 90 D 4.3938 8.3198 118.6277 57.1575 40.9006 178.4499 91 L 3.2642 7.8906 120.7921 58.1056 42.0706 179.1365 92 L 3.9537 7.9381 118.5693 57.6756 41.6058 179.4355 93 A 4.0421 8.2374 120.9332 55.2336 17.9222 179.8683 94 T 3.8631 7.8366 114.3637 66.8963 68.5786 176.9583 95 L 4.1203 8.0227 120.9043 57.6258 41.4814 179.5373 96 K 3.9950 8.1007 119.6822 59.4839 31.9287 178.8029 97 E 4.0430 8.0500 117.6838 58.7059 29.3297 177.8814 98 M 4.4821 7.3368 115.0734 54.5531 32.3669 176.1465 99 G 3.9056 7.7093 104.2443 45.9957 0.0000 174.4714 100 V 3.6837 7.5605 119.4396 61.7652 32.1791 174.8405 101 P 4.3156 0.0000 0.0000 63.0997 32.9889 177.3474 102 E 3.9863 8.8096 121.8559 59.0501 29.7592 178.8030 103 D 4.3517 8.0665 119.1605 56.4867 39.3242 178.5784 104 L 3.9665 7.7024 119.9060 57.4565 41.8206 179.0783 105 I 3.5566 7.8794 119.5685 64.4631 36.9289 178.3357 106 A 4.0041 8.0230 121.5006 54.8970 17.6472 179.2419 107 E 3.7842 7.9487 117.4010 59.6685 29.7008 179.6241 108 V 3.5715 8.0452 113.5292 63.4087 31.4625 178.2169 109 A 3.9662 8.3936 120.9475 55.3358 17.9122 179.5808 110 A 3.9713 7.5627 117.8924 54.8340 18.7054 179.8530 111 V 3.5664 7.3723 115.7904 65.8514 31.4758 177.8490 112 A 3.9559 7.9561 120.8212 55.1669 18.2157 178.4531 113 G 4.1703 8.0606 101.5574 45.4567 0.0000 174.1474 114 A 4.1726 8.0469 123.2402 50.8611 19.9393 177.5266 115 P 4.1056 0.0000 0.0000 65.9921 31.6189 178.9933 116 A 3.9607 7.9399 120.1103 54.6692 18.3434 179.3411 117 A 3.9786 7.9673 118.9099 54.8677 18.4229 179.5935 118 K 3.2281 7.6590 118.4168 59.5543 32.1139 179.1110 119 R 4.0334 7.8271 120.1100 58.6578 30.0033 178.3625 120 D 4.2642 7.8165 118.4730 57.2881 40.7134 178.4286 121 V 3.7047 7.6126 117.4446 66.2706 31.5974 177.4894 122 L 4.1795 7.9320 114.8369 54.3217 42.0529 176.3514 123 N 4.1833 8.1756 116.3121 54.3806 36.4340 174.4571 124 Q 4.1924 8.3327 122.0608 56.1599 28.9351 176.1594 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 2 S 8.32 4.46 0.00 3.98 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 3 T 7.90 4.40 4.31 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 1.25 0.00 0.00 4 L 8.97 3.81 0.00 1.79 1.74 0.37 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 5 Y 8.22 4.23 0.00 3.03 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 6 E 7.92 3.69 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 7 K 7.92 4.00 0.00 1.76 1.95 0.00 1.97 0.00 0.00 1.97 0.00 0.00 3.19 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.62 7.81 8 L 7.49 4.37 0.00 1.43 1.57 0.55 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 9 G 7.19 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 10 G 7.85 3.55 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 0.00 0.00 0.00 11 T 8.92 4.00 4.32 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 1.23 0.00 0.00 12 T 7.91 3.89 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 13 A 7.96 3.96 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 14 V 7.85 3.46 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 1.08 0.00 0.00 1.03 0.00 0.00 15 D 8.60 4.30 0.00 2.81 2.83 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 16 L 8.21 3.92 0.00 1.80 1.94 0.95 1.30 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 17 A 7.95 4.04 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 18 V 8.08 3.76 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 1.04 0.00 0.00 1.07 0.00 0.00 19 D 8.43 4.51 0.00 2.86 2.78 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 20 K 8.28 4.05 0.00 1.97 1.93 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.58 1.63 7.81 21 F 8.36 4.54 0.00 3.16 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 22 Y 8.46 3.82 0.00 2.93 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 23 E 8.19 3.59 0.00 2.11 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 0.00 2.27 2.26 0.00 24 R 8.11 3.97 0.00 2.05 2.12 0.00 3.42 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 25 V 7.68 3.44 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 0.64 0.00 0.00 0.62 0.00 0.00 26 L 7.61 3.70 0.00 1.14 1.51 0.71 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 7.34 4.61 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.60 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 28 D 7.66 4.68 0.00 2.84 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 29 D 8.53 4.54 0.00 2.71 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.07 4.19 0.00 1.98 2.07 0.00 3.13 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 31 I 7.58 4.88 2.07 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 1.53 0.84 1.04 0.00 0.00 32 K 8.29 4.12 0.00 2.01 2.13 0.00 1.44 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.39 7.81 33 H 7.86 4.30 0.00 3.10 3.38 0.00 5.72 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 F 7.58 4.08 0.00 2.64 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 35 F 8.18 4.66 0.00 3.29 3.04 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 36 A 8.14 4.07 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 37 D 8.05 4.86 0.00 2.80 2.78 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 38 V 7.65 4.41 2.42 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 1.00 0.00 0.00 1.01 0.00 0.00 39 D 8.46 4.77 0.00 3.01 2.83 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 40 M 8.49 4.12 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.72 0.00 41 A 7.99 3.87 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.33 3.96 0.00 2.08 1.87 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.65 7.81 43 Q 8.33 3.92 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.58 0.00 0.00 0.00 0.00 0.00 2.20 1.48 0.00 44 R 8.13 3.76 0.00 1.20 1.77 0.00 2.72 0.00 0.00 2.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.11 0.00 45 A 8.10 4.03 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 46 H 8.31 4.10 0.00 3.46 3.52 0.00 5.59 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 47 Q 8.01 3.96 0.00 2.21 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 1.65 1.16 0.00 48 K 8.37 4.07 0.00 1.88 2.02 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.53 7.81 49 A 8.19 4.21 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 50 F 8.45 3.87 0.00 3.12 3.35 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 51 L 8.57 4.14 0.00 2.26 2.04 1.05 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.23 4.01 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 53 Y 8.48 4.21 0.00 2.79 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.04 3.55 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 7.66 4.39 0.00 3.18 3.08 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 56 G 7.76 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.00 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 0.00 0.00 0.00 58 T 8.72 4.40 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 1.49 0.00 0.00 59 D 7.01 4.30 0.00 2.68 2.67 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 60 K 7.29 4.41 0.00 1.43 1.33 0.00 1.55 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.24 1.26 7.81 61 Y 7.76 4.95 0.00 3.12 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 62 D 8.24 4.53 0.00 2.78 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 63 G 8.88 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 0.00 0.00 0.00 64 R 8.68 4.01 0.00 2.04 2.05 0.00 3.16 0.00 0.00 3.12 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 65 Y 8.09 4.37 0.00 2.96 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 66 M 8.31 3.97 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.84 0.00 67 R 8.05 4.08 0.00 1.98 1.99 0.00 3.29 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 68 E 8.24 4.09 0.00 2.22 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 2.37 2.43 0.00 69 A 8.31 4.02 0.98 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 70 H 7.64 4.69 0.00 3.33 3.25 0.00 5.83 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 K 7.71 4.29 0.00 1.95 1.83 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.14 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.51 7.81 72 E 8.16 4.09 0.00 2.08 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 2.42 2.42 0.00 73 L 7.86 4.12 0.00 1.81 1.67 0.69 0.67 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 74 V 7.72 3.63 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 0.99 0.00 0.00 75 E 8.18 4.24 0.00 2.09 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 2.35 2.49 0.00 76 N 8.43 4.88 0.00 2.88 2.77 0.00 0.00 6.92 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.37 4.62 0.00 3.54 3.28 0.00 5.79 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.33 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.14 4.03 0.00 1.54 1.57 0.10 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.67 4.98 0.00 2.98 2.97 0.00 0.00 6.14 6.96 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 81 G 8.89 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 82 E 8.17 3.95 0.00 2.06 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 2.28 2.36 0.00 83 H 8.13 4.18 0.00 3.31 3.24 0.00 5.89 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 84 F 8.12 3.81 0.00 3.12 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.77 4.57 0.00 2.94 2.78 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 86 A 7.99 4.07 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 87 V 7.57 3.37 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 0.75 0.00 0.00 88 A 7.68 4.08 1.56 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 89 E 8.60 3.89 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 90 D 8.32 4.39 0.00 3.10 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 7.89 3.26 0.00 0.82 1.68 0.42 0.69 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 92 L 7.94 3.95 0.00 1.73 1.68 0.92 0.81 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 93 A 8.24 4.04 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 94 T 7.84 3.86 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 1.35 0.00 0.00 95 L 8.02 4.12 0.00 1.84 1.75 0.88 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.10 4.00 0.00 1.85 2.01 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.48 7.81 97 E 8.05 4.04 0.00 2.21 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 2.36 2.54 0.00 98 M 7.34 4.48 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 99 G 7.71 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.56 3.68 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 0.86 0.00 0.00 1.05 0.00 0.00 101 P 0.00 4.32 0.00 2.20 2.04 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 102 E 8.81 3.99 0.00 2.07 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 2.37 2.41 0.00 103 D 8.07 4.35 0.00 2.97 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.70 3.97 0.00 1.85 1.77 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 105 I 7.88 3.56 1.98 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 1.44 0.69 0.87 0.00 0.00 106 A 8.02 4.00 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 0.00 107 E 7.95 3.78 0.00 2.12 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 2.20 2.29 0.00 108 V 8.05 3.57 1.58 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 0.02 0.00 0.00 0.55 0.00 0.00 109 A 8.39 3.97 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 0.00 110 A 7.56 3.97 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.37 3.57 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 0.40 0.00 0.00 0.75 0.00 0.00 112 A 7.96 3.96 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 0.00 113 G 8.06 4.17 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 0.00 0.00 0.00 114 A 8.05 4.17 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 0.00 115 P 0.00 4.11 0.00 2.24 2.29 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.02 0.00 116 A 7.94 3.96 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 0.00 117 A 7.97 3.98 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 0.00 118 K 7.66 3.23 0.00 1.12 1.71 0.00 0.99 0.00 0.00 1.26 0.00 0.00 2.63 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.96 0.21 7.81 119 R 7.83 4.03 0.00 2.01 2.03 0.00 3.17 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.50 0.00 120 D 7.82 4.26 0.00 2.92 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 0.00 121 V 7.61 3.70 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 0.74 0.00 0.00 0.93 0.00 0.00 122 L 7.93 4.18 0.00 1.65 1.66 0.82 1.40 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 0.00 123 N 8.18 4.18 0.00 2.94 2.88 0.00 0.00 6.89 6.89 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 0.00 124 Q 8.33 4.19 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.55 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00