NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.9049 8.3393 109.7353 45.0652 0.0000 173.3695 1 S 4.0535 8.4797 116.3569 56.0402 63.5060 172.5672 2 S 4.3218 8.3880 117.0920 58.1140 65.2317 175.7339 3 G 4.1073 8.1080 112.6162 45.1265 0.0000 172.8165 4 S 4.6437 8.0039 113.7450 54.5260 62.5972 172.9360 5 S 4.4099 8.2122 117.0090 59.0938 65.2083 171.5105 6 G 3.9761 8.9343 122.4247 45.3138 0.0000 173.6993 7 T 4.7553 8.1080 113.2676 59.1097 72.6635 173.9871 8 P 4.5717 0.0000 0.0000 66.1668 31.6382 178.1862 9 L 4.6619 8.0249 121.5090 57.4343 41.9815 179.0247 10 S 4.2536 7.8912 113.3377 61.3661 62.1651 176.0652 11 L 4.3336 8.1864 121.1476 57.9191 41.6207 179.4717 12 T 4.2250 9.3358 110.9979 65.1237 68.8257 176.7332 13 L 3.9879 8.3784 121.8359 57.3279 41.6900 179.0499 14 D 4.4554 8.4341 118.3226 56.5940 41.2434 177.6531 15 H 4.6233 7.6019 116.6622 54.4570 29.9271 176.6274 16 W 4.4201 8.1087 132.3327 60.9733 30.3844 176.1463 17 S 3.7945 7.9751 112.2722 61.3964 61.6473 175.7923 18 E 3.7809 8.2612 122.0826 59.2685 29.2236 178.8059 19 I 3.4325 7.1177 119.3314 64.2963 37.0312 178.5000 20 R 3.3010 7.6125 119.1392 58.5997 29.6227 179.0811 21 S 3.9527 7.5984 113.2002 61.4682 62.4721 176.4383 22 R 3.8856 8.0748 120.5309 59.0592 29.2593 178.9958 23 A 4.0144 7.5199 120.8897 55.1730 18.3903 179.1570 24 H 4.3037 8.0461 116.8401 59.5637 29.7854 177.1419 25 N 4.3585 8.3146 117.7042 56.1506 38.8430 176.0311 26 L 4.2574 7.6664 118.4447 54.2056 42.5681 176.0141 27 S 3.9149 8.1333 112.0966 59.3615 60.6608 169.7960 28 V 4.6611 8.9989 110.9621 59.4629 35.7690 174.9106 29 E 4.7623 8.6835 121.5072 54.4539 32.1783 174.9357 30 I 4.8755 8.0298 116.8399 59.5079 40.4251 173.8518 31 K 4.9643 9.1049 120.1217 54.8462 34.5870 177.1300 32 K 2.7700 8.2076 119.2495 56.9207 32.1271 178.7708 33 G 3.4435 7.6779 106.0177 47.5550 0.0000 174.0475 34 P 3.8600 0.0000 0.0000 64.8216 31.3399 177.8356 35 W 4.5851 7.9435 126.5963 60.6053 30.7952 177.7009 36 R 4.0976 7.6311 118.3545 59.5837 29.6467 178.2989 37 T 3.6335 7.3999 115.3847 66.8930 68.3972 176.5410 38 F 4.0598 8.3499 120.2883 59.6437 38.3708 176.2802 39 C 4.2111 6.9145 115.3804 58.9111 31.4765 173.7689 40 A 4.4298 7.8746 122.0510 53.4937 19.3730 181.0525 41 S 4.5885 7.4046 109.0118 57.5870 62.4774 174.2347 42 E 4.7989 8.0958 118.0517 56.4679 31.7532 177.7291 43 W 3.1307 7.7965 119.0926 58.7195 28.9387 176.3177 44 P 5.2276 0.0000 0.0000 63.3924 31.2955 176.3495 45 T 4.6665 7.5795 107.9503 61.7863 68.9561 175.5299 46 F 4.6034 8.2187 121.3425 58.1366 39.4563 173.0412 47 D 4.5131 9.5862 121.3820 54.0595 38.1935 171.7887 48 V 4.6360 7.8112 114.6832 62.8948 40.2601 173.6410 49 G 3.1317 7.7232 107.7064 45.0609 0.0000 172.9559 50 W 4.5665 8.1950 131.0724 54.3341 32.5354 173.6025 51 P 4.7631 0.0000 0.0000 61.5291 31.7110 175.3589 52 P 4.5390 0.0000 0.0000 65.0991 31.9720 177.3307 53 E 4.1011 7.9732 118.4104 56.9411 29.9796 175.9710 54 G 3.6945 7.7481 102.2230 44.9534 0.0000 172.4751 55 T 4.2249 6.3494 109.9290 61.2325 69.7638 172.9320 56 F 5.0527 8.6600 126.0657 57.8384 39.7517 176.2928 57 D 4.7549 7.4723 120.9692 52.7482 41.6961 174.7787 58 L 3.9213 8.7139 129.8033 58.8895 41.7469 178.8776 59 T 3.8809 8.0837 114.8130 66.8455 68.4421 176.6326 60 V 3.7469 7.7317 119.4522 65.7739 31.6086 178.0310 61 I 3.7520 8.6060 120.4753 64.6065 37.0394 178.3671 62 F 4.1689 9.6187 119.2698 60.3658 38.5309 177.8282 63 E 3.9773 7.9890 118.4190 59.5287 29.3363 179.4805 64 V 3.6072 7.4577 117.9409 65.7811 30.9903 177.9305 65 K 3.9415 8.3916 119.5968 59.1483 31.6712 178.5468 66 A 4.0265 7.7084 120.5837 55.3872 18.5435 179.4089 67 I 3.7393 7.5729 117.7927 64.2833 37.0466 178.8658 68 V 3.7275 8.5732 119.4211 65.7308 31.5480 177.7711 69 F 4.6757 9.4185 116.5894 57.7425 40.0339 175.7550 70 Q 4.3696 7.7401 118.3267 55.2420 30.8309 173.4331 71 D 4.7158 8.3601 116.7139 53.9614 42.6477 175.9256 72 G 3.7810 8.5070 110.7516 43.6949 0.0000 171.7139 73 P 4.4457 0.0000 0.0000 63.7760 31.6845 177.5333 74 G 3.6053 8.1124 108.1821 47.6117 0.0000 174.6537 75 S 4.0931 7.1034 112.6420 59.1296 63.2163 174.3020 76 H 4.6785 9.0192 120.8194 53.4811 28.4030 173.2216 77 P 4.4387 0.0000 0.0000 64.0713 31.5595 177.3437 78 D 4.5736 7.8312 118.6757 56.6322 40.8794 177.8973 79 Q 3.6169 7.4903 116.8903 57.0157 28.4966 177.7226 80 Q 4.0619 8.0201 120.4820 58.6944 28.6488 177.4835 81 P 4.6526 0.0000 0.0000 65.5453 31.4592 178.1483 82 Y 4.5607 7.9694 117.3839 61.3870 38.0346 177.7682 83 I 3.4970 9.4734 120.1921 63.9184 37.8524 178.0087 84 T 3.9024 8.2346 116.9942 66.7001 68.3218 176.3922 85 V 3.7813 7.9131 120.1005 66.2017 31.6148 177.8401 86 W 4.4214 8.5650 118.6537 60.1706 28.9661 178.3274 87 Q 4.1977 8.3935 119.4185 59.2813 28.4787 177.6588 88 D 4.4315 8.5981 119.4735 57.1233 40.7233 178.0274 89 L 3.9734 8.8539 120.0982 58.2829 41.5121 179.0630 90 V 3.6019 7.6984 115.7332 66.7894 31.4213 177.5331 91 Q 3.9146 8.0530 116.4285 58.9782 30.1570 179.1070 92 N 4.8292 8.3109 120.9135 50.1543 35.9658 174.2085 93 S 3.9395 7.7578 114.1367 56.9809 63.6543 173.8268 94 P 4.3234 0.0000 0.0000 61.0974 31.9192 175.4567 95 P 4.4428 0.0000 0.0000 64.3090 31.5286 177.4418 96 W 4.4478 7.7053 114.3017 57.7518 28.6101 176.6494 97 I 3.7577 6.5765 118.7922 62.1068 37.4106 175.4247 98 K 4.3462 7.9755 121.1119 54.5278 33.3870 175.3312 99 S 4.7982 8.2233 118.7611 56.4195 64.2456 173.0537 100 G 4.1070 7.9357 113.8766 44.3088 0.0000 171.7805 101 P 4.2141 0.0000 0.0000 65.1706 31.6501 175.7876 102 S 3.5516 8.0045 118.2173 57.5638 58.9624 169.1695 103 S 3.9943 8.0827 115.4376 61.0606 62.9450 175.6151 104 G 3.9867 8.7712 113.6007 45.5319 0.0000 172.2450 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 0 G 8.34 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 1 S 8.48 4.05 0.00 4.08 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 2 S 8.39 4.32 0.00 3.94 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 3 G 8.11 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 0.00 0.00 0.00 4 S 8.00 4.64 0.00 3.94 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 5 S 8.21 4.41 0.00 3.81 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 6 G 8.93 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 7 T 8.11 4.76 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 1.27 0.00 0.00 8 P 0.00 4.57 0.00 2.21 1.94 0.00 3.95 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.01 0.00 9 L 8.02 4.66 0.00 2.27 1.97 1.35 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 10 S 7.89 4.25 0.00 4.21 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 11 L 8.19 4.33 0.00 2.35 2.48 1.16 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 12 T 9.34 4.23 4.58 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 1.41 0.00 0.00 13 L 8.38 3.99 0.00 1.74 1.77 1.01 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 14 D 8.43 4.46 0.00 2.72 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 15 H 7.60 4.62 0.00 1.72 2.24 0.00 5.65 0.00 0.00 0.00 0.00 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 W 8.11 4.42 0.00 3.31 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 17 S 7.98 3.79 0.00 3.82 3.71 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 18 E 8.26 3.78 0.00 1.85 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 0.00 2.66 2.48 0.00 19 I 7.12 3.43 0.80 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.40 -0.33 0.00 0.00 20 R 7.61 3.30 0.00 1.43 1.53 0.00 2.84 0.00 0.00 2.83 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 21 S 7.60 3.95 0.00 4.01 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 22 R 8.07 3.89 0.00 1.96 2.00 0.00 3.40 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.85 0.00 23 A 7.52 4.01 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.05 4.30 0.00 3.31 3.26 0.00 5.61 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 25 N 8.31 4.36 0.00 2.89 2.84 0.00 0.00 7.29 8.20 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 26 L 7.67 4.26 0.00 1.92 1.76 1.04 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 27 S 8.13 3.91 0.00 4.04 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 28 V 9.00 4.66 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 0.81 0.00 0.00 1.04 0.00 0.00 29 E 8.68 4.76 0.00 1.93 1.86 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 2.26 2.30 0.00 30 I 8.03 4.88 1.14 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.58 0.65 0.00 0.00 31 K 9.10 4.96 0.00 2.08 1.85 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.53 1.49 7.81 32 K 8.21 2.77 0.00 0.79 1.20 0.00 1.17 0.00 0.00 0.70 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.97 0.59 7.81 33 G 7.68 3.44 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 0.00 34 P 0.00 3.86 0.00 2.17 2.00 0.00 3.87 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 2.57 2.16 0.00 35 W 7.94 4.59 0.00 3.78 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 36 R 7.63 4.10 0.00 1.95 1.99 0.00 3.20 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 1.58 1.68 0.00 37 T 7.40 3.63 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 0.88 0.00 0.00 38 F 8.35 4.06 0.00 2.12 1.45 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 0.00 39 C 6.91 4.21 0.00 2.44 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 40 A 7.87 4.43 1.26 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 0.00 0.00 41 S 7.40 4.59 0.00 3.75 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 42 E 8.10 4.80 0.00 1.87 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 2.33 2.32 0.00 43 W 7.80 3.13 0.00 2.29 1.74 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 44 P 0.00 5.23 0.00 2.30 2.68 0.00 3.24 0.00 0.00 4.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 45 T 7.58 4.67 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 46 F 8.22 4.60 0.00 3.17 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 47 D 9.59 4.51 0.00 2.87 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 48 V 7.81 4.64 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 0.71 0.00 0.00 1.07 0.00 0.00 49 G 7.72 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 0.00 0.00 0.00 50 W 8.19 4.57 0.00 3.35 3.01 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 51 P 0.00 4.76 0.00 2.08 2.03 0.00 2.53 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 52 P 0.00 4.54 0.00 2.22 2.26 0.00 3.72 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 1.99 2.00 0.00 53 E 7.97 4.10 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 2.39 0.00 54 G 7.75 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 6.35 4.22 3.76 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 0.00 0.00 0.56 0.00 0.00 56 F 8.66 5.05 0.00 3.13 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.47 4.75 0.00 2.86 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 58 L 8.71 3.92 0.00 1.81 1.57 1.07 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.08 3.88 4.64 0.00 0.00 0.00 0.00 0.00 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 60 V 7.73 3.75 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 1.21 0.00 0.00 1.04 0.00 0.00 61 I 8.61 3.75 2.25 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.81 1.01 0.00 0.00 62 F 9.62 4.17 0.00 3.13 3.11 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 63 E 7.99 3.98 0.00 2.24 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 2.52 2.56 0.00 64 V 7.46 3.61 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 -0.28 0.00 0.00 0.42 0.00 0.00 65 K 8.39 3.94 0.00 1.54 1.50 0.00 0.94 0.00 0.00 0.76 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.78 0.73 7.81 66 A 7.71 4.03 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 67 I 7.57 3.74 1.85 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.82 0.43 0.00 0.00 68 V 8.57 3.73 2.45 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 1.12 0.00 0.00 1.20 0.00 0.00 69 F 9.42 4.68 0.00 3.04 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.74 4.37 0.00 2.13 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.21 0.00 71 D 8.36 4.72 0.00 2.62 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 72 G 8.51 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 73 P 0.00 4.45 0.00 2.15 2.14 0.00 3.72 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 74 G 8.11 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 7.10 4.09 0.00 3.91 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 76 H 9.02 4.68 0.00 3.08 3.16 0.00 5.61 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 77 P 0.00 4.44 0.00 2.18 2.09 0.00 3.31 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.85 0.00 78 D 7.83 4.57 0.00 2.61 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.49 3.62 0.00 1.87 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 6.48 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 80 Q 8.02 4.06 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.55 0.00 0.00 0.00 0.00 0.00 1.16 1.61 0.00 81 P 0.00 4.65 0.00 2.52 2.49 0.00 3.96 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.25 0.00 82 Y 7.97 4.56 0.00 3.39 3.42 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 83 I 9.47 3.50 1.46 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 1.10 0.90 1.19 0.00 0.00 84 T 8.23 3.90 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 85 V 7.91 3.78 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 1.28 0.00 0.00 1.12 0.00 0.00 86 W 8.57 4.42 0.00 3.59 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 87 Q 8.39 4.20 0.00 2.34 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.92 0.00 0.00 0.00 0.00 0.00 2.55 2.59 0.00 88 D 8.60 4.43 0.00 2.96 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 89 L 8.85 3.97 0.00 2.19 1.81 1.10 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.70 3.60 2.40 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 0.90 0.00 0.00 1.39 0.00 0.00 91 Q 8.05 3.91 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.20 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 92 N 8.31 4.83 0.00 2.81 2.75 0.00 0.00 7.21 8.04 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 93 S 7.76 3.94 0.00 3.71 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 94 P 0.00 4.32 0.00 0.73 1.97 0.00 2.90 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.25 0.00 95 P 0.00 4.44 0.00 2.22 2.19 0.00 3.37 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.91 0.00 96 W 7.71 4.45 0.00 3.64 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 97 I 6.58 3.76 0.87 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 0.63 -0.36 0.03 0.00 0.00 98 K 7.98 4.35 0.00 1.52 1.59 0.00 1.57 0.00 0.00 1.50 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.16 1.28 7.81 99 S 8.22 4.80 0.00 3.79 3.72 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 0.00 100 G 7.94 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 0.00 0.00 0.00 101 P 0.00 4.21 0.00 2.18 2.18 0.00 3.89 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 1.97 1.98 0.00 102 S 8.00 3.55 0.00 4.03 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 0.00 103 S 8.08 3.99 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 0.00 104 G 8.77 3.99 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 0.00 0.00 0.00