NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.3193 8.1127 119.7065 55.4784 32.2567 176.7115 3 R 3.8813 8.0794 118.7370 58.6140 30.2296 175.6194 4 R 4.0882 8.0118 118.1296 56.0392 31.3430 177.0507 5 V 3.6253 8.3446 114.8494 63.4544 31.7591 175.4053 6 I 3.6287 7.8966 120.3585 61.7842 36.2353 174.2594 7 G 3.8972 8.1534 111.7580 45.7536 0.0000 172.2654 8 Q 4.3908 7.6273 118.5979 53.2621 31.0925 175.9079 9 R 4.2356 8.1553 118.2443 54.7418 29.3733 176.7323 10 K 4.0526 8.4793 125.0645 56.2973 32.7481 175.9009 11 I 4.7451 7.8836 118.0470 58.3202 40.8690 174.7804 12 L 4.1450 8.1911 120.7880 54.8390 40.8832 175.5463 13 P 4.4824 0.0000 0.0000 62.1440 32.1014 175.6578 14 D 4.6374 7.8202 118.7776 52.5671 39.9896 174.7900 15 P 4.3988 0.0000 0.0000 64.0186 32.0092 176.9293 16 K 4.0444 8.1811 117.8079 57.2033 33.4603 176.9243 17 F 4.9640 7.9626 112.4585 56.5158 40.3344 175.2340 18 G 3.9051 8.3936 108.0440 46.0457 0.0000 173.3709 19 S 4.7696 8.4405 114.5829 55.7357 65.0139 175.1809 20 E 4.0289 8.7426 123.4690 59.3806 29.0529 178.4243 21 L 3.9893 8.0603 120.2426 58.5249 41.8674 178.6747 22 L 3.8114 7.9427 117.6517 57.8753 41.6393 179.1608 23 A 3.9842 8.0419 120.0363 55.3264 18.4227 179.1809 24 K 3.8157 8.5183 117.2321 59.6747 32.3518 178.4402 25 F 4.1880 8.7035 121.1908 61.8066 39.4149 177.6285 26 V 3.8144 8.1873 118.4424 64.6573 31.0688 177.2080 27 N 4.6987 8.3116 114.2598 53.9118 38.2709 175.9647 28 I 4.1439 7.2093 121.5031 63.3214 38.0734 177.2433 29 L 3.9444 7.9288 120.8033 58.7798 41.5402 179.9173 30 M 3.5910 8.3298 118.3319 58.2153 31.6659 177.2147 31 V 3.2175 7.3797 105.0198 63.3918 31.1000 174.5280 32 D 4.6619 8.4036 116.9016 54.4135 44.8900 174.9314 33 G 3.8106 8.4856 111.0791 44.2510 0.0000 174.1424 34 K 3.6526 9.9128 118.1227 58.8610 32.2257 179.5622 35 K 4.0399 7.4819 117.4350 56.8920 35.7541 176.4414 36 S 4.1079 7.9754 112.9330 62.3615 62.9848 176.7957 37 T 3.8649 7.9713 116.5330 64.2808 67.0502 175.7170 38 A 4.0824 7.9954 122.4157 55.0476 18.4798 179.2757 39 E 3.9970 8.3356 117.3055 59.5395 29.5944 179.4993 40 S 4.2960 8.0428 112.9755 61.2777 62.3426 176.3074 41 I 3.8011 8.0019 122.7918 64.3465 36.8837 178.5869 42 V 3.7493 8.1678 119.2697 65.8492 31.3627 177.1407 43 Y 4.2045 8.0887 119.6318 61.1881 38.4891 178.4577 44 S 4.1437 8.2172 112.9413 61.1555 62.3071 175.9055 45 A 4.1728 8.3515 125.3788 54.7477 18.3198 179.6870 46 L 4.0873 8.2480 117.3676 57.7985 41.6306 179.6943 47 E 4.1039 8.5484 119.1424 59.6242 29.1025 179.3499 48 T 4.0716 8.4476 109.9420 64.0872 68.9326 176.3578 49 L 3.9730 8.2969 123.7874 58.3234 42.1731 178.6057 50 A 4.0490 8.0389 120.1680 55.3982 18.0381 179.2240 51 Q 4.2174 7.9678 116.8377 58.9494 29.0947 178.3517 52 R 4.1234 8.0654 118.6579 58.4826 30.0628 177.4442 53 S 4.4223 7.7469 110.3594 57.2561 65.0617 175.1730 54 G 3.8669 8.8281 107.5407 45.3349 0.0000 172.5740 55 K 4.5453 7.8083 118.7307 54.1571 35.7712 174.7974 56 S 4.2015 8.4086 113.2527 58.4343 61.7854 174.5316 57 E 4.0672 8.0110 123.5597 58.1478 30.5563 178.1700 58 L 3.8842 8.0857 119.6573 59.3701 39.7655 178.8566 59 E 3.9963 8.1598 117.6188 58.2054 29.6737 178.0057 60 A 4.5277 8.0642 119.9590 52.3847 19.6822 178.5393 61 F 3.9633 8.0571 120.0111 61.3889 39.3855 176.4535 62 E 4.0071 8.4639 118.4949 59.2841 29.3702 178.7248 63 V 3.6512 7.7001 117.3032 66.1175 32.1190 177.7055 64 A 4.1427 8.1027 120.3484 55.1286 18.3354 179.4062 65 L 4.0202 7.6233 118.3079 57.5542 41.8392 178.6009 66 E 3.9736 7.9190 118.2069 59.6389 29.5160 178.1546 67 N 4.6750 7.8820 112.8783 53.9158 38.9776 175.7911 68 V 4.3325 7.4988 118.5865 63.0433 34.0100 176.0684 69 R 4.2500 8.4671 116.5497 55.1887 29.4906 174.7091 70 P 4.9338 0.0000 0.0000 61.8853 34.1700 173.8997 71 T 4.3934 8.6355 109.4312 64.0053 68.7713 174.8511 72 V 4.2927 7.6086 112.5455 61.2003 32.5673 175.1728 73 E 4.8289 8.3071 123.4295 54.7244 33.0210 174.7638 74 V 4.4562 8.5292 118.6194 59.6907 33.3879 175.5535 75 K 4.4559 8.5459 124.3537 53.9384 34.4918 174.9475 76 S 4.0414 8.5547 115.7464 58.7433 61.8703 174.1990 77 R 4.5561 8.4255 126.4489 54.7799 32.5112 175.7646 78 R 5.0541 8.4238 117.4741 54.8643 30.0213 177.2590 79 V 3.7968 8.1255 116.7183 64.7499 31.4576 175.8524 80 G 3.8551 7.5404 107.9037 45.9034 0.0000 174.6110 81 G 3.8163 9.0372 106.2263 45.0505 0.0000 173.5578 82 S 4.4706 7.3076 113.0071 57.3421 65.8595 174.7559 83 T 4.2150 8.6912 117.6207 64.6556 67.9408 173.9373 84 Y 4.6306 8.6731 127.8584 55.3488 39.0471 172.5479 85 Q 4.3966 8.2995 121.8345 54.1694 30.2736 175.3978 86 V 3.2419 8.2151 123.5100 63.1491 28.9851 170.2858 87 P 4.2763 0.0000 0.0000 64.1850 32.0505 174.7722 88 V 3.2030 7.8038 121.8548 60.8304 32.2754 171.7649 89 E 4.5479 8.5084 119.3828 56.4350 30.2750 176.9264 90 V 3.8724 8.4513 116.6732 61.2828 32.3370 176.5851 91 R 4.1031 8.6254 123.2943 55.5033 30.6855 175.7433 92 P 4.2038 0.0000 0.0000 66.1967 31.4379 179.4436 93 V 3.9009 7.6859 109.5096 63.9905 31.8854 178.2634 94 R 4.0674 8.4952 119.2307 58.5982 29.2237 178.8161 95 R 3.8515 7.2077 118.7062 59.3828 30.0873 177.8463 96 N 4.6541 8.0650 114.2159 54.6681 39.2576 177.0622 97 A 3.9998 8.0699 121.3741 55.2686 18.4148 178.9438 98 L 3.6715 8.1561 118.6381 58.0140 42.0165 178.9925 99 A 4.1426 7.7817 120.2811 55.2794 18.3501 179.0184 100 M 3.8372 8.0219 117.3092 58.9238 32.0185 179.1352 101 R 3.8853 7.4751 117.5694 59.2136 29.6770 179.2481 102 W 4.4455 7.9396 118.1234 59.6310 29.0867 178.5277 103 I 3.7265 8.1729 120.1647 64.2916 36.6041 178.2166 104 V 3.5134 8.0940 119.5752 66.3201 31.1114 177.9517 105 E 4.1137 8.3608 114.9092 58.4715 29.6546 178.6376 106 A 4.1131 7.7823 121.5171 55.0364 18.3508 178.9508 107 A 3.9176 8.2320 119.6378 55.7005 18.1346 179.5338 108 R 3.8701 7.5737 115.6280 59.1272 30.3687 177.0088 109 K 4.5470 7.8953 114.0747 55.3903 34.1640 177.6047 110 R 3.8614 7.5243 118.7988 57.6659 30.0101 177.1575 111 G 3.9297 8.0073 104.6163 46.1042 0.0000 173.4203 112 D 4.7400 7.6176 119.5618 52.7679 42.1021 177.3040 113 K 3.7107 8.4979 119.6879 59.3725 32.1893 176.6742 114 S 4.5282 7.3661 111.3217 56.7780 64.7305 175.5961 115 M 3.9710 8.6827 118.3462 59.0571 31.6867 178.0461 116 A 4.1830 7.9967 120.2059 55.3518 18.7746 179.2673 117 L 4.0988 7.5194 116.7773 56.7854 41.6088 179.8904 118 R 4.1038 7.7949 118.8371 59.3537 30.0095 178.8737 119 L 4.0816 7.5216 117.7664 57.4252 41.6452 179.0175 120 A 4.0581 8.3207 121.0055 55.5242 18.3358 179.4506 121 N 4.2702 8.0371 113.9582 56.5457 38.7085 177.4043 122 E 4.0532 8.5171 120.8661 58.9678 29.7403 178.2097 123 L 4.1158 8.2870 119.9205 56.8694 42.2652 178.5230 124 S 4.0320 8.2585 113.8728 61.5101 62.2976 175.2948 125 D 4.3823 8.5202 121.7175 57.5567 40.7276 178.8663 126 A 3.9298 8.0576 120.5676 55.3588 18.1175 179.2288 127 A 3.9459 7.4637 116.9463 55.4978 18.5178 178.9395 128 E 4.2048 7.7614 112.6099 55.9940 29.8143 177.7181 129 N 4.3030 7.9534 115.0714 53.6065 37.6131 175.2892 130 K 4.0507 7.7680 118.8188 58.2127 32.7794 177.9760 131 G 3.7889 7.9080 105.8128 45.3147 0.0000 174.1124 132 T 3.8448 8.8360 120.2323 66.6482 68.5529 176.7804 133 A 3.9936 8.7508 122.8998 54.9891 18.3021 179.8161 134 V 3.4693 7.6906 116.4428 65.8942 31.6164 178.1263 135 K 3.7756 7.9907 119.3067 59.4092 32.2263 178.7606 136 K 3.4789 7.9476 119.0592 59.5738 31.8359 178.9308 137 R 2.5100 7.2554 118.5194 58.7669 30.0280 178.0408 138 E 3.7978 8.0980 118.2641 59.8489 29.5735 179.3993 139 D 4.2974 8.2793 118.8945 57.4086 40.8440 178.9655 140 V 3.7595 7.1586 117.0469 65.5352 31.8310 177.6878 141 H 4.3737 8.0993 116.2971 58.8612 28.3671 177.7222 142 R 3.9879 8.4305 119.5384 59.3881 29.2598 177.0487 143 M 4.0957 8.2298 118.3325 57.2676 31.8694 177.9472 144 A 3.8238 8.4839 120.3372 55.3827 19.0736 179.4286 145 E 3.8319 7.6686 116.5276 59.0851 29.5083 179.1539 146 A 3.9533 7.4847 121.4188 55.1408 18.5742 178.9787 147 N 4.5088 7.8046 113.4278 54.6032 38.2990 176.7866 148 K 3.8213 7.4525 121.3805 58.7497 32.1996 177.0840 149 A 4.6139 7.7436 118.5175 51.9130 19.3664 176.6187 150 F 4.5557 8.1830 120.0479 58.6564 41.7116 175.1200 151 A 3.6934 8.0363 126.8269 52.3538 18.0584 176.8561 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 R 8.11 4.32 0.00 1.89 2.03 0.00 3.10 0.00 0.00 3.34 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 3 R 8.08 3.88 0.00 1.85 1.97 0.00 3.24 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 4 R 8.01 4.09 0.00 1.90 1.85 0.00 3.27 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 5 V 8.34 3.63 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 0.70 0.00 0.00 0.93 0.00 0.00 6 I 7.90 3.63 1.87 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 1.35 0.46 0.91 0.00 0.00 7 G 8.15 3.90 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 0.00 0.00 0.00 8 Q 7.63 4.39 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.02 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 9 R 8.16 4.24 0.00 1.79 1.91 0.00 3.21 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 10 K 8.48 4.05 0.00 1.69 1.71 0.00 1.60 0.00 0.00 1.76 0.00 0.00 3.14 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.49 7.81 11 I 7.88 4.75 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.85 0.91 0.00 0.00 12 L 8.19 4.14 0.00 1.77 1.71 0.91 0.64 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 13 P 0.00 4.48 0.00 2.04 1.96 0.00 3.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 14 D 7.82 4.64 0.00 2.73 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 15 P 0.00 4.40 0.00 2.11 2.16 0.00 3.58 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.93 0.00 16 K 8.18 4.04 0.00 0.79 0.74 0.00 1.42 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.63 0.21 7.81 17 F 7.96 4.96 0.00 2.98 2.65 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 0.00 18 G 8.39 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 19 S 8.44 4.77 0.00 3.90 3.89 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 20 E 8.74 4.03 0.00 2.04 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 2.40 2.36 0.00 21 L 8.06 3.99 0.00 1.78 1.57 1.16 0.79 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 22 L 7.94 3.81 0.00 1.61 1.60 -0.17 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.04 3.98 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 24 K 8.52 3.82 0.00 1.96 1.90 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.48 7.81 25 F 8.70 4.19 0.00 3.42 3.27 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 26 V 8.19 3.81 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 0.93 0.00 0.00 1.04 0.00 0.00 27 N 8.31 4.70 0.00 2.97 2.91 0.00 0.00 6.95 8.16 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 28 I 7.21 4.14 1.77 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.75 0.84 0.00 0.00 29 L 7.93 3.94 0.00 1.73 1.81 0.83 1.02 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 30 M 8.33 3.59 0.00 2.25 2.05 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 2.84 2.75 0.00 31 V 7.38 3.22 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 0.58 0.00 0.00 0.93 0.00 0.00 32 D 8.40 4.66 0.00 2.56 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.49 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 34 K 9.91 3.65 0.00 1.95 1.96 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.42 7.81 35 K 7.48 4.04 0.00 1.89 1.93 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.23 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.42 1.49 7.81 36 S 7.98 4.11 0.00 4.09 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.97 3.86 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 38 A 8.00 4.08 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 39 E 8.34 4.00 0.00 2.22 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 2.37 2.57 0.00 40 S 8.04 4.30 0.00 3.97 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 41 I 8.00 3.80 2.06 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 1.44 0.69 0.96 0.00 0.00 42 V 8.17 3.75 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 1.22 0.00 0.00 1.20 0.00 0.00 43 Y 8.09 4.20 0.00 3.03 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 44 S 8.22 4.14 0.00 3.95 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 A 8.35 4.17 1.55 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 46 L 8.25 4.09 0.00 2.06 1.88 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.55 4.10 0.00 2.20 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 2.69 2.48 0.00 48 T 8.45 4.07 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 1.24 0.00 0.00 49 L 8.30 3.97 0.00 2.06 1.96 0.97 1.31 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 50 A 8.04 4.05 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.97 4.22 0.00 2.09 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.94 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 52 R 8.07 4.12 0.00 1.98 2.00 0.00 3.18 0.00 0.00 3.29 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 53 S 7.75 4.42 0.00 3.93 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.83 3.87 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 0.00 0.00 0.00 55 K 7.81 4.55 0.00 1.82 1.82 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.38 7.81 56 S 8.41 4.20 0.00 3.85 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 57 E 8.01 4.07 0.00 2.11 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 2.50 2.39 0.00 58 L 8.09 3.88 0.00 1.54 1.67 0.46 -0.50 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 59 E 8.16 4.00 0.00 2.13 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 2.24 0.00 60 A 8.06 4.53 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 61 F 8.06 3.96 0.00 3.10 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 E 8.46 4.01 0.00 2.17 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 2.39 2.45 0.00 63 V 7.70 3.65 2.24 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 0.90 0.00 0.00 0.98 0.00 0.00 64 A 8.10 4.14 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 65 L 7.62 4.02 0.00 1.66 1.90 0.98 1.18 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 66 E 7.92 3.97 0.00 2.13 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 2.51 2.52 0.00 67 N 7.88 4.67 0.00 2.80 2.90 0.00 0.00 6.75 7.65 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 68 V 7.50 4.33 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 1.03 0.00 0.00 1.01 0.00 0.00 69 R 8.47 4.25 0.00 2.12 2.14 0.00 3.14 0.00 0.00 3.17 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.60 0.00 70 P 0.00 4.93 0.00 2.50 2.63 0.00 3.92 0.00 0.00 3.85 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 71 T 8.64 4.39 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 1.19 0.00 0.00 72 V 7.61 4.29 2.15 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 0.71 0.00 0.00 1.02 0.00 0.00 73 E 8.31 4.83 0.00 1.97 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 74 V 8.53 4.46 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 0.80 0.00 0.00 0.98 0.00 0.00 75 K 8.55 4.46 0.00 1.72 1.72 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.26 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.46 7.81 76 S 8.55 4.04 0.00 3.84 3.89 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 77 R 8.43 4.56 0.00 1.99 2.03 0.00 3.16 0.00 0.00 3.48 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 78 R 8.42 5.05 0.00 1.97 2.13 0.00 3.15 0.00 0.00 3.24 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 79 V 8.13 3.80 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 0.79 0.00 0.00 0.97 0.00 0.00 80 G 7.54 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 81 G 9.04 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 82 S 7.31 4.47 0.00 4.09 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 0.00 83 T 8.69 4.21 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 1.26 0.00 0.00 84 Y 8.67 4.63 0.00 3.02 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 85 Q 8.30 4.40 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.41 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 86 V 8.22 3.24 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 0.81 0.00 0.00 0.99 0.00 0.00 87 P 0.00 4.28 0.00 2.10 2.10 0.00 3.88 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 88 V 7.80 3.20 2.10 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 0.82 0.00 0.00 0.95 0.00 0.00 89 E 8.51 4.55 0.00 2.08 2.01 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 2.29 2.36 0.00 90 V 8.45 3.87 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 0.66 0.00 0.00 0.99 0.00 0.00 91 R 8.63 4.10 0.00 1.81 1.86 0.00 3.21 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 92 P 0.00 4.20 0.00 2.17 2.14 0.00 3.60 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 2.13 2.15 0.00 93 V 7.69 3.90 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 0.70 0.00 0.00 0.93 0.00 0.00 94 R 8.50 4.07 0.00 1.95 1.93 0.00 3.28 0.00 0.00 3.13 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 95 R 7.21 3.85 0.00 2.27 2.03 0.00 3.32 0.00 0.00 3.36 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 96 N 8.06 4.65 0.00 2.79 2.94 0.00 0.00 6.83 7.70 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 97 A 8.07 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 98 L 8.16 3.67 0.00 1.72 1.16 0.76 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.78 4.14 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 0.00 100 M 8.02 3.84 0.00 1.98 2.24 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.86 0.00 101 R 7.48 3.89 0.00 1.52 1.83 0.00 3.18 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.56 0.00 102 W 7.94 4.45 0.00 3.53 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 0.00 103 I 8.17 3.73 1.89 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.86 0.86 0.00 0.00 104 V 8.09 3.51 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 0.99 0.00 0.00 0.80 0.00 0.00 105 E 8.36 4.11 0.00 2.19 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 2.58 2.40 0.00 106 A 7.78 4.11 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 0.00 107 A 8.23 3.92 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 0.00 108 R 7.57 3.87 0.00 2.00 2.02 0.00 3.20 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 109 K 7.90 4.55 0.00 1.73 1.75 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.48 7.81 110 R 7.52 3.86 0.00 2.01 1.98 0.00 3.48 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 111 G 8.01 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 0.00 112 D 7.62 4.74 0.00 2.73 2.62 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 0.00 113 K 8.50 3.71 0.00 1.75 1.90 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.45 7.81 114 S 7.37 4.53 0.00 3.78 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 M 8.68 3.97 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.58 0.00 116 A 8.00 4.18 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 0.00 117 L 7.52 4.10 0.00 1.92 1.75 0.94 0.94 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 0.00 118 R 7.79 4.10 0.00 1.84 1.99 0.00 3.13 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.84 0.00 119 L 7.52 4.08 0.00 1.99 1.94 0.87 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.32 4.06 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 0.00 121 N 8.04 4.27 0.00 2.92 2.89 0.00 0.00 6.76 7.78 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 0.00 122 E 8.52 4.05 0.00 2.15 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 2.32 2.38 0.00 123 L 8.29 4.12 0.00 1.90 1.61 0.65 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.26 4.03 0.00 4.03 3.95 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 0.00 125 D 8.52 4.38 0.00 2.85 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 0.00 126 A 8.06 3.93 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 0.00 127 A 7.46 3.95 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 7.76 4.20 0.00 2.08 1.98 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 2.32 2.47 0.00 129 N 7.95 4.30 0.00 2.90 2.94 0.00 0.00 6.85 7.58 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 0.00 130 K 7.77 4.05 0.00 1.66 1.97 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.37 7.81 131 G 7.91 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 0.00 132 T 8.84 3.84 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 1.18 0.00 0.00 133 A 8.75 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 0.00 134 V 7.69 3.47 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 1.15 0.00 0.00 0.95 0.00 0.00 135 K 7.99 3.78 0.00 1.80 1.81 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.39 7.81 136 K 7.95 3.48 0.00 1.34 1.08 0.00 1.87 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.49 7.81 137 R 7.26 2.51 0.00 1.60 1.83 0.00 3.27 0.00 0.00 2.85 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 2.11 0.00 138 E 8.10 3.80 0.00 1.93 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 2.29 2.45 0.00 139 D 8.28 4.30 0.00 2.47 2.61 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 0.00 140 V 7.16 3.76 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 1.23 0.00 0.00 1.01 0.00 0.00 141 H 8.10 4.37 0.00 3.33 3.30 0.00 5.69 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 0.00 142 R 8.43 3.99 0.00 1.87 1.95 0.00 3.11 0.00 0.00 3.11 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 143 M 8.23 4.10 0.00 2.14 1.88 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 2.52 2.52 0.00 144 A 8.48 3.82 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 0.00 145 E 7.67 3.83 0.00 2.01 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 2.19 2.33 0.00 146 A 7.48 3.95 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 0.00 147 N 7.80 4.51 0.00 2.83 3.06 0.00 0.00 6.69 7.96 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 0.00 148 K 7.45 3.82 0.00 1.71 1.98 0.00 1.78 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.48 7.81 149 A 7.74 4.61 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 0.00 150 F 8.18 4.56 0.00 2.93 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 A 8.04 3.69 1.21 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 0.00 0.00