NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 R 4.2942 8.0976 120.8559 55.3787 31.0020 176.0434 4 P 4.1866 0.0000 0.0000 65.4042 31.2521 175.0404 5 E 3.8888 8.9982 119.2653 59.6217 29.7404 180.5841 6 S 4.0211 7.6144 113.4858 61.5372 62.7515 176.4417 7 E 3.9422 8.0642 121.5602 58.9991 29.4662 178.6418 8 L 4.0278 7.7460 119.0959 57.6338 41.5924 179.5308 9 I 3.3680 7.5388 119.5880 64.3593 36.8908 178.4852 10 R 4.0345 8.0913 119.0603 59.7176 28.4264 179.2319 11 Q 4.1309 8.4921 118.0459 58.8911 28.2114 178.8207 12 S 4.6283 8.4270 115.5166 61.2000 63.2345 176.3768 13 W 4.5718 9.0048 132.1645 60.1887 30.2111 178.0388 14 R 3.8693 7.8009 117.5442 59.2116 29.7597 178.7362 15 V 3.6513 7.2065 117.3147 66.0823 31.5716 178.3355 16 V 2.9276 7.1300 117.2514 65.5693 31.1359 177.7489 17 S 3.6390 7.3627 112.0447 59.9892 62.8496 176.0673 18 R 4.0879 7.0929 121.5619 57.8620 31.4259 176.8605 19 S 4.6494 7.8082 112.8257 55.0036 62.9564 172.6214 20 P 4.1479 0.0000 0.0000 66.5460 31.4955 178.4904 21 L 3.9770 7.8148 119.6742 57.7800 41.9973 178.5003 22 E 3.9480 8.1208 118.0923 59.8232 29.4949 179.0021 23 H 4.2148 8.4296 116.2639 58.8371 28.7496 178.2089 24 G 3.7836 8.6312 107.9104 47.9084 0.0000 175.8903 25 T 3.9811 8.3046 118.4361 66.5711 68.3919 176.6846 26 V 3.6083 7.5414 120.2311 65.8744 31.4511 177.5973 27 L 3.8517 7.8240 119.8651 58.5060 41.9475 179.1523 28 F 3.4978 8.4634 117.3317 59.9275 38.7799 177.7008 29 A 4.0707 8.3784 120.9637 55.1569 18.2427 179.6350 30 R 3.5535 8.1457 117.4836 59.2259 30.0567 178.2173 31 L 3.8392 7.6938 121.7085 57.7142 41.7855 179.2073 32 F 4.7630 7.7755 115.5443 60.3214 38.8571 177.3379 33 A 4.1664 7.7750 120.1820 54.9608 18.1996 179.2868 34 L 4.2349 7.8190 116.7537 56.3268 43.3978 177.3052 35 E 4.6716 8.5439 119.4712 53.0106 29.7473 173.4469 36 P 4.4522 0.0000 0.0000 65.1834 31.9586 178.5428 37 S 4.3936 8.0018 110.5073 59.8431 63.3842 175.6048 38 L 4.3008 8.1543 122.0060 57.0461 41.2133 178.5225 39 L 3.6888 7.9603 121.0199 57.8471 41.7397 177.2699 40 P 4.3679 0.0000 0.0000 64.7204 31.3432 178.0667 41 L 4.2343 7.8286 117.2785 55.9062 42.2671 177.4237 42 F 4.2578 7.6924 118.3070 56.1739 37.9074 175.4268 43 Q 4.8068 7.2488 125.9839 53.5171 27.8362 174.7280 44 Y 4.3814 7.0026 117.9021 58.6703 39.2336 175.9283 45 N 4.3607 9.6666 120.5084 54.4685 36.1968 174.7365 46 G 3.9539 8.4672 102.1079 46.2851 0.0000 174.2380 47 R 4.6327 7.5747 117.5954 53.8115 33.1728 174.8558 48 Q 4.5442 8.1031 118.1155 54.0819 30.7484 175.4149 49 F 4.5412 7.9698 118.9685 57.6782 39.7741 176.0109 50 S 4.3015 9.0135 121.7988 61.0612 63.3869 174.6482 51 S 4.7562 8.5468 115.0148 55.6128 66.6018 173.2384 52 P 3.9650 0.0000 0.0000 65.5954 31.2275 178.8696 53 E 3.9493 8.0969 115.6611 59.1298 29.9727 178.6615 54 D 4.2563 7.9481 119.7286 57.1214 41.3016 178.8596 55 S 2.0000 7.1773 113.7204 60.3414 62.7212 176.2396 56 L 4.1551 7.0684 119.4776 56.3497 41.3514 177.6716 57 S 4.4232 7.4806 112.1028 58.3113 63.8399 174.3562 58 S 4.6350 7.7973 117.8853 56.5672 63.3188 172.4922 59 P 4.2379 0.0000 0.0000 66.0579 31.0769 178.3243 60 E 3.7027 7.9461 117.8216 58.9860 29.2673 178.9424 61 F 4.1431 8.0108 120.5931 61.2603 39.5026 177.2097 62 L 3.8698 8.1685 118.7307 57.8072 41.3140 179.1451 63 D 4.3357 8.4114 119.3159 57.6968 40.6870 178.3978 64 H 4.1254 8.1425 118.6381 59.0727 29.8001 177.3442 65 I 3.4446 7.1637 121.7176 64.4115 36.8744 178.4974 66 R 3.9680 7.9356 118.7397 59.2090 29.8618 179.3143 67 K 4.0035 8.2764 118.3901 59.3525 32.0295 179.4402 68 V 3.7322 7.9479 118.5870 66.6021 31.4234 178.1160 69 M 4.4085 8.3828 118.2070 58.3120 31.7443 178.8176 70 L 4.1201 8.2513 119.6424 57.6507 41.7744 179.6745 71 V 3.6354 8.1101 118.3146 65.9671 31.4720 177.9918 72 I 3.5922 7.9820 119.6864 64.5457 36.9606 177.6472 73 D 4.1733 8.4406 118.6557 57.4484 41.0006 178.3036 74 A 3.9474 8.2250 120.8867 55.0474 18.1375 179.4612 75 A 3.8638 7.6267 118.3196 55.2391 18.5153 179.7361 76 V 3.4078 7.4049 115.7794 66.3422 31.6179 177.9965 77 T 4.0477 7.7821 114.4132 65.9098 68.5631 175.3948 78 N 4.9318 7.8099 117.2702 52.8476 39.6202 177.6654 79 V 3.5277 7.7696 115.9176 64.6980 31.7645 177.9559 80 E 3.9440 8.0065 117.2185 58.9171 29.4667 176.5941 81 D 4.2815 7.6316 116.9290 52.8134 42.6412 174.4483 82 L 4.5273 8.3160 127.4386 55.2502 42.0907 179.0202 83 S 4.1732 7.7949 117.9664 61.5516 62.6447 176.3608 84 S 4.1371 8.1482 115.4632 60.9924 62.6421 175.5206 85 L 4.6313 7.6808 123.2724 55.4896 42.2422 178.7653 86 E 3.9864 7.8252 119.4459 61.4156 29.6113 184.6803 87 E 4.1511 8.1279 119.1717 59.1873 29.5417 178.5942 88 Y 4.0019 8.0269 119.0098 60.8550 38.8658 178.0867 89 L 3.7827 8.4167 120.1735 57.9588 41.6673 179.5699 90 T 3.9267 8.2260 116.0899 66.9655 68.3292 176.8531 91 S 4.0125 7.8720 116.8474 61.1577 62.7818 176.4117 92 L 3.8350 7.8324 123.7140 57.8624 41.6800 179.2962 93 G 3.4285 8.0769 105.7556 47.7217 0.0000 175.3931 94 R 3.5850 7.6783 121.6097 58.8563 29.9606 178.4045 95 K 3.7758 7.9930 119.3287 59.9596 32.1503 178.6078 96 H 4.2488 8.0961 116.3254 58.4347 28.6854 177.7759 97 R 3.7988 7.5467 121.0154 59.3213 29.5366 178.4695 98 A 3.9477 7.5223 119.2378 55.0907 18.4633 179.5383 99 V 3.7712 7.5593 109.1030 62.0853 31.7702 177.1994 100 G 4.1186 7.5159 106.1362 45.0513 0.0000 173.9061 101 V 3.9486 8.0190 120.5464 62.2901 32.2388 175.9629 102 R 4.4484 8.6099 126.3043 55.5504 31.1675 177.1209 103 L 3.0818 8.2912 123.5329 58.1505 41.8087 178.9934 104 S 4.0517 8.0891 112.4140 61.9077 62.0958 176.2965 105 S 4.2329 8.3227 117.1540 60.8764 62.4935 176.3133 106 F 4.2096 8.4137 120.8918 59.6372 38.5428 177.6692 107 S 4.2490 8.0018 114.3034 61.9510 62.7335 176.7465 108 T 3.8404 7.8245 119.2482 65.9256 68.1198 176.6160 109 V 3.4467 7.8013 120.4614 65.8350 31.4251 178.2824 110 G 2.8263 8.0218 105.3053 47.6868 0.0000 175.5215 111 E 3.9407 8.1060 121.2710 59.0880 29.1309 179.7018 112 S 3.9995 8.2152 115.6030 61.1869 62.7746 176.2578 113 L 3.8272 7.8454 123.2810 58.3390 41.7316 179.1584 114 L 3.8408 7.9283 118.8146 57.6860 41.4020 178.9488 115 Y 3.8854 8.1654 119.7624 60.8337 38.7777 177.7128 116 M 3.7388 8.1310 119.2093 58.6146 32.2013 178.2060 117 L 3.5226 7.5257 118.9191 57.5382 41.6604 179.2124 118 E 3.3755 7.3091 118.6547 59.2826 29.1521 179.7495 119 K 3.7456 7.3793 117.2994 59.1802 32.0686 179.2216 120 S 4.0943 7.6360 112.5690 61.2272 62.8278 175.6942 121 L 4.2701 8.1975 121.3459 53.9128 41.9591 178.4959 122 G 3.8344 8.6182 107.1490 45.7347 0.0000 175.2162 123 P 4.2382 0.0000 0.0000 65.3445 31.0502 176.7701 124 D 4.5659 7.9136 115.5874 55.7038 41.0930 177.0147 125 F 4.7271 7.9887 124.3609 56.9774 37.8174 175.5435 126 T 4.1311 7.4431 115.4494 60.1952 71.3203 173.3827 127 P 4.0704 0.0000 0.0000 66.1137 31.3398 178.7219 128 A 3.9942 7.8695 118.6237 55.2804 18.3197 179.7585 129 T 3.8293 7.5171 113.8400 66.6858 68.5264 176.7445 130 R 3.6550 7.3682 120.6615 59.8586 30.0213 178.5860 131 T 3.8615 7.8907 115.0125 66.4412 68.3496 176.4446 132 A 3.9436 8.0439 122.5791 55.1052 18.4229 179.7274 133 W 4.1323 8.3651 117.4106 60.0699 29.1705 178.7597 134 S 4.3658 8.6191 113.2169 61.4236 61.7912 176.5382 135 R 3.9718 8.2504 120.9568 58.9437 29.8400 178.7157 136 L 3.8703 8.1234 120.2626 58.2894 42.0695 178.2196 137 Y 4.2270 8.6462 120.0677 60.7834 38.6933 178.1976 138 G 3.6630 8.3279 106.3079 47.9394 0.0000 175.4196 139 A 3.9305 8.0947 123.1071 54.6711 18.3061 179.8129 140 V 3.4221 7.7327 116.7658 66.2774 31.5750 178.4918 141 V 3.2414 7.4640 117.9837 65.6051 30.9906 177.5882 142 Q 3.8451 7.8760 118.5350 59.0895 29.2693 178.0794 143 A 4.0916 7.7204 121.0609 55.6307 18.4245 179.3404 144 M 4.2030 8.1437 117.5738 58.7707 32.0241 179.2268 145 S 4.2345 8.5115 114.4329 61.2673 62.8306 176.6216 146 R 4.7771 7.2521 122.1171 58.3912 29.8196 178.4882 147 G 3.6473 8.2605 104.2196 45.7619 0.0000 173.6146 148 W 4.4307 8.4598 122.7952 56.7019 29.0390 177.2619 149 D 4.7216 8.0423 116.1425 53.2863 40.3291 173.8455 150 G 3.7373 7.3518 111.7183 47.1706 0.0000 172.3332 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 3 R 8.10 4.29 0.00 1.90 1.86 0.00 3.10 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 4 P 0.00 4.19 0.00 2.36 2.28 0.00 3.74 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 2.05 2.10 0.00 5 E 9.00 3.89 0.00 1.97 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 2.35 2.38 0.00 6 S 7.61 4.02 0.00 4.07 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.06 3.94 0.00 2.06 2.05 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 2.38 2.47 0.00 8 L 7.75 4.03 0.00 1.85 1.73 0.91 1.28 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 9 I 7.54 3.37 1.66 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.17 0.13 0.00 0.00 10 R 8.09 4.03 0.00 2.00 2.05 0.00 3.13 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 11 Q 8.49 4.13 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.65 2.55 0.00 12 S 8.43 4.63 0.00 4.45 4.44 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 13 W 9.00 4.57 0.00 3.92 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 14 R 7.80 3.87 0.00 2.03 2.00 0.00 3.24 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 1.71 1.89 0.00 15 V 7.21 3.65 2.22 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 0.96 0.00 0.00 0.98 0.00 0.00 16 V 7.13 2.93 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 0.42 0.00 0.00 0.81 0.00 0.00 17 S 7.36 3.64 0.00 3.61 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 18 R 7.09 4.09 0.00 1.97 1.96 0.00 3.04 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 19 S 7.81 4.65 0.00 3.94 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 20 P 0.00 4.15 0.00 2.29 2.29 0.00 3.64 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 2.05 1.98 0.00 21 L 7.81 3.98 0.00 1.77 1.69 0.90 0.98 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 22 E 8.12 3.95 0.00 2.17 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 0.00 2.38 2.39 0.00 23 H 8.43 4.21 0.00 3.15 3.29 0.00 5.82 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 24 G 8.63 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 25 T 8.30 3.98 4.46 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 1.26 0.00 0.00 26 V 7.54 3.61 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 1.19 0.00 0.00 0.95 0.00 0.00 27 L 7.82 3.85 0.00 1.74 1.82 0.86 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 28 F 8.46 3.50 0.00 3.14 3.06 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 29 A 8.38 4.07 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 30 R 8.15 3.55 0.00 1.59 1.99 0.00 2.68 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.34 0.00 31 L 7.69 3.84 0.00 1.45 1.32 0.75 0.72 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 32 F 7.78 4.76 0.00 3.12 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 33 A 7.78 4.17 1.31 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 0.00 0.00 34 L 7.82 4.23 0.00 1.71 1.68 0.79 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.54 4.67 0.00 1.91 1.82 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 2.25 2.28 0.00 36 P 0.00 4.45 0.00 2.23 2.11 0.00 3.68 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 37 S 8.00 4.39 0.00 4.00 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 38 L 8.15 4.30 0.00 2.29 2.18 0.97 0.53 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 39 L 7.96 3.69 0.00 1.25 1.57 0.14 0.61 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 40 P 0.00 4.37 0.00 2.05 2.22 0.00 3.82 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 2.03 2.16 0.00 41 L 7.83 4.23 0.00 1.55 1.52 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.69 4.26 0.00 3.30 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 43 Q 7.25 4.81 0.00 1.83 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.95 0.00 0.00 0.00 0.00 0.00 2.13 2.28 0.00 44 Y 7.00 4.38 0.00 3.07 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 45 N 9.67 4.36 0.00 2.90 2.92 0.00 0.00 7.00 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 46 G 8.47 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 0.00 0.00 0.00 47 R 7.57 4.63 0.00 1.87 1.69 0.00 3.10 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 48 Q 8.10 4.54 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.93 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 49 F 7.97 4.54 0.00 2.95 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 50 S 9.01 4.30 0.00 4.05 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 51 S 8.55 4.76 0.00 3.73 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 52 P 0.00 3.96 0.00 2.17 2.23 0.00 3.53 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 2.11 1.99 0.00 53 E 8.10 3.95 0.00 2.05 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 0.00 2.30 2.24 0.00 54 D 7.95 4.26 0.00 2.79 2.80 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 0.00 0.00 0.00 0.00 55 S 7.18 2.00 0.00 2.72 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 56 L 7.07 4.16 0.00 1.72 1.75 0.93 0.93 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 57 S 7.48 4.42 0.00 3.97 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 58 S 7.80 4.64 0.00 4.23 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 59 P 0.00 4.24 0.00 2.27 2.28 0.00 3.79 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 60 E 7.95 3.70 0.00 1.16 1.12 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 2.15 2.23 0.00 61 F 8.01 4.14 0.00 3.40 3.26 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 0.00 62 L 8.17 3.87 0.00 1.86 1.67 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.41 4.34 0.00 2.78 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 64 H 8.14 4.13 0.00 3.31 3.21 0.00 5.59 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 65 I 7.16 3.44 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 -0.14 0.95 0.00 0.00 66 R 7.94 3.97 0.00 2.03 1.99 0.00 3.12 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 67 K 8.28 4.00 0.00 1.94 1.92 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.74 7.81 68 V 7.95 3.73 2.44 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 1.28 0.00 0.00 1.12 0.00 0.00 69 M 8.38 4.41 0.00 2.31 2.23 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 3.05 0.00 70 L 8.25 4.12 0.00 1.98 1.76 0.95 0.73 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 71 V 8.11 3.64 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.20 0.00 0.00 72 I 7.98 3.59 1.92 0.00 0.00 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 1.51 0.67 0.32 0.00 0.00 73 D 8.44 4.17 0.00 3.36 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 74 A 8.22 3.95 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 75 A 7.63 3.86 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 76 V 7.40 3.41 1.80 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 0.84 0.00 0.00 0.23 0.00 0.00 77 T 7.78 4.05 4.37 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 1.20 0.00 0.00 78 N 7.81 4.93 0.00 2.85 2.96 0.00 0.00 7.00 7.68 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 79 V 7.77 3.53 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 0.55 0.00 0.00 0.87 0.00 0.00 80 E 8.01 3.94 0.00 1.92 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 2.27 2.21 0.00 81 D 7.63 4.28 0.00 2.58 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 82 L 8.32 4.53 0.00 1.70 1.62 0.87 0.93 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 83 S 7.79 4.17 0.00 4.19 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 84 S 8.15 4.14 0.00 4.01 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 85 L 7.68 4.63 0.00 1.81 1.80 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 86 E 7.83 3.99 0.00 1.92 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 2.25 2.25 0.00 87 E 8.13 4.15 0.00 2.01 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 2.41 2.32 0.00 88 Y 8.03 4.00 0.00 3.13 3.18 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 0.00 89 L 8.42 3.78 0.00 1.87 1.65 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 90 T 8.23 3.93 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 1.17 0.00 0.00 91 S 7.87 4.01 0.00 3.80 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 92 L 7.83 3.83 0.00 1.16 1.55 0.98 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.08 3.43 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 0.00 94 R 7.68 3.58 0.00 1.81 1.92 0.00 3.00 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.45 0.00 95 K 7.99 3.78 0.00 1.84 1.88 0.00 1.48 0.00 0.00 1.58 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.36 7.81 96 H 8.10 4.25 0.00 3.40 3.77 0.00 5.87 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 R 7.55 3.80 0.00 0.67 1.49 0.00 2.69 0.00 0.00 2.82 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.27 0.00 98 A 7.52 3.95 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 99 V 7.56 3.77 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 0.71 0.00 0.00 0.93 0.00 0.00 100 G 7.52 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 V 8.02 3.95 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 0.93 0.00 0.00 1.09 0.00 0.00 102 R 8.61 4.45 0.00 1.97 1.86 0.00 3.23 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.70 0.00 103 L 8.29 3.08 0.00 0.27 1.12 -0.02 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 104 S 8.09 4.05 0.00 3.89 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.32 4.23 0.00 3.93 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 0.00 106 F 8.41 4.21 0.00 3.14 3.18 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 0.00 107 S 8.00 4.25 0.00 4.09 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 0.00 108 T 7.82 3.84 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 1.14 0.00 0.00 109 V 7.80 3.45 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 1.13 0.00 0.00 0.63 0.00 0.00 110 G 8.02 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 0.00 0.00 0.00 111 E 8.11 3.94 0.00 2.08 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 2.51 2.48 0.00 112 S 8.22 4.00 0.00 3.71 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 0.00 113 L 7.85 3.83 0.00 1.48 1.54 0.77 0.96 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 0.00 114 L 7.93 3.84 0.00 1.87 1.80 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 115 Y 8.17 3.89 0.00 3.05 3.07 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 0.00 116 M 8.13 3.74 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.48 0.00 117 L 7.53 3.52 0.00 0.83 0.70 -0.31 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 118 E 7.31 3.38 0.00 1.78 1.82 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 2.54 2.31 0.00 119 K 7.38 3.75 0.00 1.25 1.56 0.00 1.39 0.00 0.00 1.21 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.48 0.63 7.81 120 S 7.64 4.09 0.00 3.77 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.20 4.27 0.00 1.82 1.79 1.08 1.23 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 0.00 122 G 8.62 3.83 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 0.00 0.00 0.00 123 P 0.00 4.24 0.00 2.07 2.15 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 124 D 7.91 4.57 0.00 2.91 2.79 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 0.00 125 F 7.99 4.73 0.00 2.86 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 0.00 126 T 7.44 4.13 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 1.27 0.00 0.00 127 P 0.00 4.07 0.00 2.13 2.14 0.00 3.56 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 128 A 7.87 3.99 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 0.00 129 T 7.52 3.83 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 1.60 0.00 0.00 130 R 7.37 3.65 0.00 1.12 1.80 0.00 3.17 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 1.62 1.76 0.00 131 T 7.89 3.86 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 132 A 8.04 3.94 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 0.00 133 W 8.37 4.13 0.00 3.59 3.38 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 0.00 134 S 8.62 4.37 0.00 4.13 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 0.00 135 R 8.25 3.97 0.00 2.13 1.95 0.00 3.18 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 1.66 1.65 0.00 136 L 8.12 3.87 0.00 1.56 1.57 0.80 0.34 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 0.00 137 Y 8.65 4.23 0.00 3.32 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.33 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 A 8.09 3.93 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 0.00 140 V 7.73 3.42 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 1.00 0.00 0.00 0.95 0.00 0.00 141 V 7.46 3.24 1.78 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 0.83 0.00 0.00 0.23 0.00 0.00 142 Q 7.88 3.85 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 143 A 7.72 4.09 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 0.00 144 M 8.14 4.20 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.60 0.00 145 S 8.51 4.23 0.00 3.91 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 R 7.25 4.78 0.00 1.99 2.06 0.00 3.12 0.00 0.00 3.08 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 147 G 8.26 3.65 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 0.00 0.00 0.00 148 W 8.46 4.43 0.00 3.57 3.07 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 0.00 149 D 8.04 4.72 0.00 2.83 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 0.00 150 G 7.35 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00