NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 P 4.3162 0.0000 0.0000 63.7552 32.4756 176.8086 14 G 3.7321 8.6298 107.9733 44.2574 0.0000 172.8037 15 G 3.7306 8.0573 108.0784 45.2672 0.0000 171.1711 16 D 4.9866 8.1020 112.7178 52.8580 40.7179 169.3313 17 T 4.8142 7.2436 111.5957 59.3296 72.7276 174.9096 18 I 3.6548 8.2287 120.7447 64.9478 36.8776 178.5306 19 F 4.7338 7.8297 118.3415 60.0812 38.6500 178.0705 20 G 3.6535 8.0419 106.0817 47.6162 0.0000 176.0527 21 K 4.0654 7.9981 120.4725 59.1267 32.1462 179.4104 22 I 3.8994 7.4457 121.2395 63.8209 36.7363 178.5270 23 I 3.7116 7.6490 119.6269 64.3890 37.1132 178.1187 24 R 4.1541 7.8483 115.4301 55.9734 29.9877 176.9784 25 K 3.9816 7.6253 117.0111 57.3620 30.1727 176.8734 26 E 4.1248 8.3465 121.6416 58.3394 29.3060 177.6721 27 I 4.5292 7.3810 112.0294 57.8605 40.0204 173.2986 28 P 4.2555 0.0000 0.0000 62.6875 31.9106 174.7927 29 A 4.6251 7.7553 120.6469 50.7567 22.7934 177.3485 30 K 4.3734 8.3212 119.7620 55.1975 30.5423 176.2387 31 I 4.3873 7.6416 121.0009 61.5160 37.8365 176.2028 32 I 4.4626 8.4455 117.7597 60.3102 38.7974 175.2938 33 F 4.5011 7.8599 122.0287 57.8031 42.5579 172.0715 34 E 5.2121 7.8208 125.7434 55.4192 32.6533 173.5298 35 D 4.8385 8.9849 125.8070 51.5192 42.6861 175.4914 36 D 4.3991 8.7459 117.2466 55.6129 39.7462 176.6494 37 Q 4.6374 8.1420 118.7815 57.2108 31.3886 174.8401 38 C 5.1640 9.4307 112.6919 57.1728 34.0024 172.6357 39 L 5.4561 9.1343 119.1640 53.6181 45.7388 174.6142 40 A 5.2776 9.3070 126.1681 50.2234 22.4415 175.0116 41 F 5.2895 8.1220 115.5942 55.4672 41.9440 173.5304 42 H 4.7358 8.6150 117.2665 55.7775 29.2088 175.2297 43 D 4.5177 8.9163 123.0369 53.9877 41.5620 176.5166 44 I 3.9495 8.4746 125.7799 63.1805 38.8489 175.8152 45 S 4.7682 8.5470 115.4976 55.7116 62.9511 172.1173 46 P 4.3387 0.0000 0.0000 63.8115 31.6399 177.0020 47 Q 4.4976 8.8766 118.8570 55.4200 29.2581 174.6205 48 A 4.5505 7.5971 119.0797 50.5391 21.9501 174.8023 49 P 4.3987 0.0000 0.0000 65.5078 31.5981 177.2500 50 T 4.7276 8.0596 114.6438 61.9063 71.6185 173.4263 51 H 5.1464 8.8323 126.6794 55.5627 32.4103 171.8103 52 F 5.4512 8.5205 120.7671 55.0488 42.0537 173.4716 53 L 5.0514 8.8101 118.0803 52.7324 45.4245 176.0657 54 V 4.8357 8.3703 120.8811 61.0989 34.3905 174.4081 55 I 5.1000 8.8957 121.4009 58.3366 40.9981 173.2964 56 P 4.9492 0.0000 0.0000 62.3003 32.3023 176.6992 57 K 4.1979 8.9009 120.4426 58.9056 32.3204 178.1026 58 K 4.0428 7.8962 119.9370 56.2030 32.6421 175.6308 59 H 4.4678 8.7906 126.1186 55.5521 29.6890 174.1909 60 I 4.4091 7.7940 128.4340 59.0486 39.3330 176.9834 61 S 4.6371 9.0126 120.4202 60.7513 63.3447 174.2076 62 Q 4.5294 7.6269 115.3966 54.8581 30.6598 174.1846 63 I 3.7374 8.3637 119.6925 64.3433 37.9428 178.0884 64 S 4.1910 8.4547 113.2876 60.2983 62.8544 174.5679 65 A 4.4365 8.1393 122.4862 51.8167 19.3826 177.1370 66 A 4.1470 7.6547 119.3497 52.0289 19.1108 176.9072 67 E 4.7176 9.2985 120.2390 54.2469 32.3592 177.1178 68 D 4.3576 8.6680 119.0806 57.8096 40.4536 179.0300 69 A 4.1640 7.9139 119.3077 54.3222 18.6673 178.1225 70 D 4.6513 8.0523 116.6736 54.5652 40.8558 177.9768 71 E 3.9562 7.9112 121.3344 59.7844 29.5015 179.2964 72 S 4.1183 8.0746 114.4063 61.5173 63.0493 176.3627 73 L 3.9666 7.9121 122.3291 58.3073 41.9890 178.8884 74 L 4.1330 8.2710 119.1829 57.8455 41.5655 179.8530 75 G 3.7214 8.4274 105.8442 47.8991 0.0000 175.2412 76 H 4.1731 8.6280 120.9546 59.0457 29.8210 177.3345 77 L 3.9316 7.7555 120.5372 58.0713 41.3547 179.4340 78 M 4.0955 7.7020 117.2560 58.2670 31.8910 178.8679 79 I 3.6524 7.8130 120.0642 64.3968 37.1978 178.6960 80 V 3.2448 7.8585 119.3759 65.5689 31.2324 178.3108 81 G 3.6589 7.9582 105.8744 47.6444 0.0000 175.8532 82 K 4.0647 8.2723 123.0367 58.8955 32.5294 179.6237 83 K 3.8946 7.8907 119.7071 59.5210 31.9320 179.1136 84 C 4.1468 8.3885 118.4497 62.0796 27.8926 175.9489 85 A 3.9503 8.0271 122.1291 55.1024 17.8290 179.5783 86 A 3.9533 7.8256 119.1743 55.4780 18.0545 179.6204 87 D 4.3511 8.2709 117.7381 57.2873 40.6569 178.1460 88 L 4.4663 8.0035 116.8174 54.1699 41.8004 176.8855 89 G 3.8527 7.8418 106.8946 46.9176 0.0000 175.3676 90 L 4.4435 7.9773 121.6581 53.6982 40.3007 179.0354 91 K 4.1195 7.8262 121.1460 57.1429 32.4158 179.6524 92 K 4.2245 7.8888 114.6785 56.4050 32.4246 175.2900 93 G 3.4968 7.9620 104.6777 45.0949 0.0000 171.4436 94 Y 4.7384 6.9986 115.1101 56.7363 41.0389 172.4648 95 R 4.7068 8.9174 119.2004 54.9061 33.3617 173.7082 96 M 5.1763 8.7736 125.0684 53.7760 34.4439 175.5141 97 V 4.5057 8.7817 121.9964 61.1645 35.6352 174.0739 98 V 4.6585 8.3807 126.1620 61.2693 33.8416 174.1724 99 N 4.8382 8.7731 125.2288 51.5494 40.2690 173.9418 100 E 4.5710 8.2924 122.2635 55.0362 32.4228 176.9518 101 G 4.1392 8.9264 116.3905 45.9345 0.0000 172.8076 102 S 4.0759 8.7091 111.2976 61.9957 62.1171 177.0630 103 D 4.5159 8.1165 119.7892 57.0850 40.6798 178.5106 104 G 3.7663 7.7106 105.3173 45.7084 0.0000 174.7490 105 G 3.9062 7.6551 108.3248 45.2318 0.0000 173.0863 106 Q 4.0645 7.8081 121.4507 55.6602 29.2831 175.9184 107 S 4.6374 8.5857 118.2437 57.7222 65.2156 173.9189 108 V 4.1364 7.5207 120.4839 61.3045 32.6255 175.9340 109 Y 4.3039 8.3335 128.2882 56.0639 36.4182 173.8894 110 H 5.0393 7.7430 118.5602 54.4791 33.1919 172.9146 111 V 3.8685 8.7048 128.0456 64.2306 31.6546 174.9105 112 H 5.1499 8.6206 121.6710 54.0025 32.0293 172.1333 113 L 4.7051 8.8007 123.3504 53.7978 43.8958 175.0195 114 H 4.8710 9.2841 124.5533 55.2885 30.6923 174.8074 115 V 4.4710 8.2237 121.4941 61.1435 34.2258 173.9944 116 L 5.1282 8.6701 128.4986 53.3450 45.1488 176.4216 117 G 4.1418 9.2310 108.6387 46.3326 0.0000 173.8123 118 G 4.1939 11.0463 108.4350 45.1686 0.0000 173.0269 119 R 4.5434 7.0773 113.5410 54.6983 32.0024 174.2445 120 Q 4.0629 8.4964 120.3223 56.3177 29.4839 175.2312 121 M 4.3761 8.4335 125.0424 54.3601 33.2522 175.6876 122 N 4.8457 8.4447 121.3960 52.3063 40.7790 173.5254 123 W 5.1749 8.2507 128.3953 54.6396 33.6550 172.6643 124 P 2.9700 0.0000 0.0000 61.5755 31.8991 174.5830 125 P 4.3220 0.0000 0.0000 61.5931 30.4318 176.4746 126 G 3.8901 7.6202 110.6323 46.3854 0.0000 172.2713 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 13 P 0.00 4.32 0.00 2.26 2.27 0.00 3.71 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 1.98 1.99 0.00 14 G 8.63 3.73 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 0.00 0.00 0.00 15 G 8.06 3.73 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 0.00 0.00 0.00 16 D 8.10 4.99 0.00 2.66 2.46 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 0.00 17 T 7.24 4.81 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 1.27 0.00 0.00 18 I 8.23 3.65 1.55 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 1.60 1.20 1.00 0.00 0.00 19 F 7.83 4.73 0.00 2.85 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 20 G 8.04 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 21 K 8.00 4.07 0.00 1.91 1.86 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.71 7.81 22 I 7.45 3.90 1.85 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.54 0.31 0.00 0.00 23 I 7.65 3.71 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.64 0.95 0.00 0.00 24 R 7.85 4.15 0.00 1.80 1.97 0.00 3.29 0.00 0.00 3.38 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 25 K 7.63 3.98 0.00 1.92 1.89 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.57 7.81 26 E 8.35 4.12 0.00 1.95 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 2.33 2.23 0.00 27 I 7.38 4.53 1.84 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 1.44 0.89 0.89 0.00 0.00 28 P 0.00 4.26 0.00 2.17 2.06 0.00 3.71 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 1.96 1.94 0.00 29 A 7.76 4.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 8.32 4.37 0.00 1.97 1.93 0.00 1.73 0.00 0.00 1.85 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.58 1.47 7.81 31 I 7.64 4.39 1.88 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 1.50 0.62 0.95 0.00 0.00 32 I 8.45 4.46 1.71 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 0.96 0.49 0.76 0.00 0.00 33 F 7.86 4.50 0.00 2.97 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 34 E 7.82 5.21 0.00 1.97 1.66 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 2.14 2.31 0.00 35 D 8.98 4.84 0.00 2.94 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 36 D 8.75 4.40 0.00 2.81 2.85 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 37 Q 8.14 4.64 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.55 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 38 C 9.43 5.16 0.00 3.17 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 39 L 9.13 5.46 0.00 1.83 1.60 1.04 1.30 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 40 A 9.31 5.28 1.15 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 41 F 8.12 5.29 0.00 3.13 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 42 H 8.61 4.74 0.00 3.22 3.34 0.00 5.65 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.92 4.52 0.00 2.41 2.38 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 44 I 8.47 3.95 1.96 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 1.46 0.84 0.98 0.00 0.00 45 S 8.55 4.77 0.00 3.84 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 46 P 0.00 4.34 0.00 2.37 2.14 0.00 3.83 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 2.03 2.04 0.00 47 Q 8.88 4.50 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.29 0.00 48 A 7.60 4.55 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 49 P 0.00 4.40 0.00 2.08 2.19 0.00 3.84 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 2.19 2.16 0.00 50 T 8.06 4.73 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 1.44 0.00 0.00 51 H 8.83 5.15 0.00 3.18 3.15 0.00 5.63 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.52 5.45 0.00 2.99 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 53 L 8.81 5.05 0.00 0.42 1.06 0.73 0.62 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 54 V 8.37 4.84 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 1.02 0.00 0.00 0.98 0.00 0.00 55 I 8.90 5.10 1.95 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 0.63 0.59 0.00 0.00 56 P 0.00 4.95 0.00 2.26 2.14 0.00 4.09 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 2.19 2.03 0.00 57 K 8.90 4.20 0.00 1.79 1.97 0.00 1.92 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.54 1.57 7.81 58 K 7.90 4.04 0.00 1.75 1.75 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.45 7.81 59 H 8.79 4.47 0.00 3.21 3.27 0.00 5.74 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.79 4.41 1.84 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 1.45 0.48 0.92 0.00 0.00 61 S 9.01 4.64 0.00 4.13 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 62 Q 7.63 4.53 0.00 2.48 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.86 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 63 I 8.36 3.74 1.86 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 1.47 1.19 1.03 0.00 0.00 64 S 8.45 4.19 0.00 4.05 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 65 A 8.14 4.44 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 66 A 7.65 4.15 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 67 E 9.30 4.72 0.00 1.97 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 2.23 2.25 0.00 68 D 8.67 4.36 0.00 2.69 2.74 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 69 A 7.91 4.16 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 70 D 8.05 4.65 0.00 2.84 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 71 E 7.91 3.96 0.00 1.97 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 2.34 2.62 0.00 72 S 8.07 4.12 0.00 3.87 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 73 L 7.91 3.97 0.00 1.77 1.88 0.96 0.68 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 74 L 8.27 4.13 0.00 1.87 1.71 0.93 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.43 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 0.00 0.00 0.00 76 H 8.63 4.17 0.00 3.39 3.54 0.00 5.79 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 77 L 7.76 3.93 0.00 1.91 1.68 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 78 M 7.70 4.10 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 79 I 7.81 3.65 1.89 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 1.61 0.88 0.86 0.00 0.00 80 V 7.86 3.24 1.90 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 0.14 0.00 0.00 0.56 0.00 0.00 81 G 7.96 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 82 K 8.27 4.06 0.00 2.12 2.16 0.00 1.63 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.32 7.81 83 K 7.89 3.89 0.00 1.78 1.82 0.00 1.57 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.59 7.81 84 C 8.39 4.15 0.00 2.49 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 0.00 0.00 0.00 85 A 8.03 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.83 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 87 D 8.27 4.35 0.00 2.74 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 88 L 8.00 4.47 0.00 1.72 1.72 0.71 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 89 G 7.84 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 0.00 0.00 0.00 90 L 7.98 4.44 0.00 1.92 2.00 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.83 4.12 0.00 1.77 1.73 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.03 7.81 92 K 7.89 4.22 0.00 1.76 1.88 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.44 7.81 93 G 7.96 3.50 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 0.00 0.00 0.00 94 Y 7.00 4.74 0.00 3.06 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 95 R 8.92 4.71 0.00 1.88 1.78 0.00 3.12 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 96 M 8.77 5.18 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 97 V 8.78 4.51 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 0.84 0.00 0.00 0.91 0.00 0.00 98 V 8.38 4.66 2.07 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 0.84 0.00 0.00 0.91 0.00 0.00 99 N 8.77 4.84 0.00 2.70 2.67 0.00 0.00 6.86 7.66 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 0.00 100 E 8.29 4.57 0.00 1.97 1.75 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 2.26 2.34 0.00 101 G 8.93 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 0.00 0.00 0.00 102 S 8.71 4.08 0.00 3.95 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 0.00 103 D 8.12 4.52 0.00 2.68 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 0.00 104 G 7.71 3.77 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 0.00 0.00 0.00 105 G 7.66 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 0.00 106 Q 7.81 4.06 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 1.40 2.05 0.00 107 S 8.59 4.64 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 0.00 108 V 7.52 4.14 1.61 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 -0.20 0.00 0.00 0.59 0.00 0.00 109 Y 8.33 4.30 0.00 3.17 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 0.00 110 H 7.74 5.04 0.00 3.22 3.40 0.00 5.95 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.70 3.87 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 0.82 0.00 0.00 1.00 0.00 0.00 112 H 8.62 5.15 0.00 3.04 3.27 0.00 5.55 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.80 4.71 0.00 1.71 1.62 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 114 H 9.28 4.87 0.00 3.10 3.11 0.00 5.61 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 8.22 4.47 0.67 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 0.48 0.00 0.00 0.54 0.00 0.00 116 L 8.67 5.13 0.00 1.56 1.43 0.84 0.32 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 0.00 117 G 9.23 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 0.00 0.00 0.00 118 G 11.05 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 119 R 7.08 4.54 0.00 1.90 1.90 0.00 3.06 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 120 Q 8.50 4.06 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.88 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 121 M 8.43 4.38 0.00 2.10 2.01 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 2.59 2.48 0.00 122 N 8.44 4.85 0.00 2.72 2.79 0.00 0.00 6.75 7.95 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 0.00 123 W 8.25 5.17 0.00 3.25 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 0.00 124 P 0.00 2.97 0.00 1.94 1.58 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.77 0.00 125 P 0.00 4.32 0.00 2.07 2.02 0.00 2.66 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 1.54 1.33 0.00 126 G 7.62 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 0.00 0.00 0.00