NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.4064 0.0000 0.0000 61.8453 32.8001 176.0891 3 K 4.1521 8.4677 122.5482 55.4241 33.0281 174.9499 4 K 4.2612 9.3384 125.8106 56.1773 34.0379 175.3734 5 V 5.4868 8.2987 126.3171 60.5177 33.7371 174.4250 6 L 4.7459 8.3458 126.6889 53.2620 45.4412 175.3182 7 T 4.8725 7.9983 115.6215 62.3723 72.3783 173.9535 8 G 4.5365 8.4119 111.2387 46.5321 0.0000 171.2125 9 V 4.7668 8.1020 118.8228 61.0025 33.9903 175.7635 10 V 4.1264 8.8262 128.0870 62.9989 32.2444 176.3907 11 V 4.5613 8.8072 119.7549 60.9292 33.3994 175.8452 12 S 4.4930 7.5794 115.4757 57.4686 67.2932 174.9669 13 D 4.8504 8.6537 125.5978 53.9877 41.6557 176.3819 14 K 4.2392 8.2776 116.3056 57.2462 32.5703 176.8776 15 M 4.7336 7.5334 117.9730 53.0351 34.5618 175.4978 16 Q 4.0845 8.4911 120.4422 57.2990 29.6092 176.7318 17 K 4.9682 8.5967 121.2181 56.0205 30.6283 174.2848 18 T 5.2878 7.3227 111.5379 62.5067 73.1033 174.1526 19 V 4.7338 8.4270 116.5048 59.9851 36.5033 174.7676 20 T 4.3087 8.6853 121.9445 63.2260 69.7828 173.9686 21 V 4.5226 8.5719 128.0452 60.6484 32.9490 174.7030 22 L 4.1705 8.4617 130.9597 55.7461 43.5329 176.5483 23 V 4.6392 8.2589 123.8505 61.6103 33.1470 172.8940 24 E 4.5446 8.4240 126.2937 56.1342 30.8106 175.1541 25 R 4.9521 9.5539 124.1084 55.1670 34.1432 173.5326 26 Q 5.2036 8.4863 120.3930 55.0163 32.1220 173.5624 27 F 4.9601 8.0756 113.9291 55.4088 41.7018 171.1447 28 P 4.7276 0.0000 0.0000 62.5463 32.2247 175.5837 29 H 4.3416 9.0957 124.1410 55.6152 30.2036 174.1999 30 P 4.2759 0.0000 0.0000 65.2062 31.0549 176.4579 31 L 4.3817 8.1982 117.7368 56.0161 43.9001 176.2230 32 Y 4.5542 7.7138 112.6977 57.6681 38.4003 175.7615 33 G 4.2436 7.6782 113.8578 46.1111 0.0000 173.9293 34 K 4.0563 7.4960 120.2876 53.8800 33.2736 174.6596 35 V 4.2299 8.5125 128.5395 62.7919 31.7896 174.7842 36 I 4.2980 8.1035 122.7343 59.3706 39.5707 175.4019 37 K 4.7352 8.3617 124.0235 56.0951 33.6488 175.5715 38 R 4.8886 9.1936 122.1904 55.9192 34.1935 173.4547 39 S 5.1852 8.2694 114.5819 57.5224 65.5212 173.9119 40 K 4.7068 8.6760 121.2946 54.7851 35.9326 174.9294 41 K 4.8012 8.5756 124.9902 55.6315 33.6032 175.5602 42 Y 4.5937 8.6637 121.7561 56.0404 41.2860 174.6464 43 L 4.8223 8.7395 123.8851 54.1274 42.7946 176.0449 44 A 5.1320 8.7070 125.5138 50.4012 22.7028 174.3948 45 H 4.9028 9.5703 120.7239 55.2909 31.8658 173.7721 46 D 4.3567 8.7028 124.7720 51.9161 42.8209 173.8875 47 P 4.1863 0.0000 0.0000 64.8640 32.3921 177.3429 48 E 4.3083 7.8292 116.7306 56.9118 29.6514 177.9522 49 E 3.5154 8.3579 119.3627 60.2933 30.9938 178.9058 50 K 3.8456 10.5256 108.5074 55.9372 33.6503 177.3974 51 Y 4.2549 6.7604 128.5209 58.5414 37.5646 175.7024 52 K 4.5467 9.6122 125.2424 53.7450 34.8609 175.2635 53 L 4.1416 8.2459 121.9266 56.7827 42.0101 176.5573 54 G 4.1254 8.4055 114.3280 45.4995 0.0000 173.7615 55 D 4.5613 8.1257 120.0387 54.3237 42.4017 175.7151 56 V 5.0187 8.3741 121.8365 60.8111 33.7327 174.9595 57 V 4.7053 8.1688 120.0995 59.6016 36.0012 174.1464 58 E 4.9520 8.9493 120.8460 55.0400 32.1192 175.5675 59 I 4.9108 8.8072 123.2025 59.4733 40.7240 174.3502 60 I 4.9901 8.9073 126.1514 58.6948 40.8810 174.1575 61 E 3.5678 9.5080 130.9592 57.1248 29.8705 175.9623 62 S 4.7615 7.8824 121.7405 56.2054 67.4810 173.5031 63 R 3.9489 8.5171 121.0935 55.4479 30.2562 173.8792 64 P 4.0638 0.0000 0.0000 63.2339 31.5248 175.6627 65 I 4.1547 8.0670 123.6896 62.3047 38.4693 175.2563 66 S 4.5078 7.3785 111.9287 56.6987 64.7166 173.1230 67 K 4.0318 8.3906 123.7092 57.2531 32.3984 176.5370 68 R 3.9704 8.9952 123.5402 56.6917 28.5342 176.6066 69 K 4.5403 7.3823 118.6241 55.4443 33.5524 175.5653 70 R 4.8170 8.2718 130.2381 54.5661 30.8540 174.3599 71 F 5.2587 8.1643 115.6091 56.2747 44.3152 174.8452 72 R 5.1289 9.1378 120.4464 54.1605 33.9525 175.4662 73 V 3.9787 8.2712 122.6552 62.8570 30.7445 175.4986 74 L 4.2617 8.7059 132.3057 56.8294 42.7709 176.9862 75 R 4.4456 7.2091 114.4324 56.0711 30.7953 172.0278 76 L 4.8092 8.4511 120.1926 53.6696 43.5964 175.7680 77 V 4.0362 9.0419 126.7948 64.2803 32.3955 176.1248 78 E 4.6198 7.6115 117.1051 54.7136 32.1198 174.3441 79 S 4.3726 8.7578 118.4714 58.6765 63.2640 172.4532 80 G 3.8152 8.7627 117.9148 45.6271 0.0000 171.5613 81 R 3.7136 8.1407 113.1297 56.1560 27.2045 175.1790 82 M 4.3950 8.0093 123.6096 57.2407 32.5166 177.0516 83 D 3.9385 8.0317 120.4580 56.2553 39.4003 178.1474 84 L 4.1792 7.7721 120.0118 57.0491 41.8555 179.1833 85 V 3.8515 7.6075 117.7898 65.5235 31.4576 177.8995 86 E 3.9493 9.0324 119.6074 59.3132 29.3513 178.9798 87 K 3.9241 7.5466 117.8364 59.8948 32.1985 178.5626 88 Y 4.0442 7.6701 117.7391 60.7912 38.5663 177.7586 89 L 3.6342 8.3640 118.8110 57.9686 41.9306 179.4672 90 I 3.7587 8.4691 120.5289 64.1984 37.2909 178.2038 91 R 3.7535 8.3115 119.9399 59.4633 29.6368 177.6902 92 R 2.9398 7.0231 114.5631 56.4596 30.1436 177.4109 93 Q 4.0059 8.4406 120.4960 59.8756 29.1152 177.2231 94 N 4.0718 8.2249 116.8214 56.5509 38.8909 176.5583 95 Y 3.9625 7.5726 113.2061 61.3043 38.0400 178.0934 96 Q 4.2816 8.7141 118.3192 58.6627 30.0258 177.1707 97 S 4.7361 9.0207 120.7014 57.7861 61.0884 179.6127 98 L 3.6629 7.7643 126.2201 57.6117 38.3359 175.1887 99 S 4.4148 7.1762 129.9665 59.3726 67.8955 179.0539 100 K 4.7478 8.5276 111.8219 53.6466 32.7946 174.8083 101 R 4.5036 7.0021 128.4124 56.5876 33.8277 175.5004 102 G 4.2556 8.6680 103.2638 44.6842 0.0000 173.7311 103 G 4.0941 8.1676 108.1263 45.6264 0.0000 172.9132 104 K 4.1903 7.9597 121.9201 55.6220 34.4609 175.6255 105 A 4.1358 7.8102 126.5624 52.8737 18.8400 176.3905 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 P 0.00 4.41 0.00 2.06 2.06 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 3 K 8.47 4.15 0.00 1.72 1.74 0.00 1.73 0.00 0.00 1.89 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.49 7.81 4 K 9.34 4.26 0.00 1.96 1.83 0.00 1.47 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.53 1.47 7.81 5 V 8.30 5.49 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 1.02 0.00 0.00 0.94 0.00 0.00 6 L 8.35 4.75 0.00 1.12 1.16 0.10 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.00 4.87 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 1.16 0.00 0.00 8 G 8.41 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.10 4.77 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 1.06 0.00 0.00 0.90 0.00 0.00 10 V 8.83 4.13 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 0.89 0.00 0.00 0.93 0.00 0.00 11 V 8.81 4.56 1.84 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 0.55 0.00 0.00 0.45 0.00 0.00 12 S 7.58 4.49 0.00 3.74 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 13 D 8.65 4.85 0.00 2.61 2.60 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 0.00 0.00 0.00 0.00 14 K 8.28 4.24 0.00 1.81 1.86 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.43 7.81 15 M 7.53 4.73 0.00 2.00 1.98 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 2.53 2.54 0.00 16 Q 8.49 4.08 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.25 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 17 K 8.60 4.97 0.00 1.92 1.94 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.64 1.37 7.81 18 T 7.32 5.29 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 1.35 0.00 0.00 19 V 8.43 4.73 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 0.81 0.00 0.00 0.93 0.00 0.00 20 T 8.69 4.31 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 1.13 0.00 0.00 21 V 8.57 4.52 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 0.84 0.00 0.00 22 L 8.46 4.17 0.00 1.52 1.39 0.83 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.26 4.64 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 0.65 0.00 0.00 0.73 0.00 0.00 24 E 8.42 4.54 0.00 2.02 1.85 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 2.46 2.34 0.00 25 R 9.55 4.95 0.00 1.88 1.78 0.00 3.01 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.69 0.00 26 Q 8.49 5.20 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 27 F 8.08 4.96 0.00 3.21 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 28 P 0.00 4.73 0.00 2.16 2.13 0.00 3.98 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 2.10 2.03 0.00 29 H 9.10 4.34 0.00 3.32 3.27 0.00 5.62 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 30 P 0.00 4.28 0.00 2.17 2.20 0.00 3.55 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 1.72 1.94 0.00 31 L 8.20 4.38 0.00 1.33 1.13 0.77 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.71 4.55 0.00 2.82 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 33 G 7.68 4.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 7.50 4.06 0.00 1.91 1.72 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.53 7.81 35 V 8.51 4.23 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 0.85 0.00 0.00 0.92 0.00 0.00 36 I 8.10 4.30 1.72 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.53 0.93 0.00 0.00 37 K 8.36 4.74 0.00 1.64 1.87 0.00 2.04 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.39 7.81 38 R 9.19 4.89 0.00 2.14 2.01 0.00 3.45 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 39 S 8.27 5.19 0.00 3.91 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 40 K 8.68 4.71 0.00 1.81 1.84 0.00 0.61 0.00 0.00 1.02 0.00 0.00 2.73 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.00 1.23 7.81 41 K 8.58 4.80 0.00 1.63 1.66 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.45 7.81 42 Y 8.66 4.59 0.00 2.64 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.74 4.82 0.00 1.75 1.67 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.71 5.13 1.24 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 0.00 0.00 0.00 0.00 0.00 0.00 45 H 9.57 4.90 0.00 3.26 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.70 4.36 0.00 2.86 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.19 0.00 2.09 2.02 0.00 3.76 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 48 E 7.83 4.31 0.00 2.07 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 0.00 2.23 2.20 0.00 49 E 8.36 3.52 0.00 2.05 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 2.22 2.24 0.00 50 K 10.53 3.85 0.00 1.14 0.74 0.00 1.27 0.00 0.00 1.11 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.13 1.31 7.81 51 Y 6.76 4.25 0.00 3.00 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 52 K 9.61 4.55 0.00 1.77 1.74 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.51 7.81 53 L 8.25 4.14 0.00 1.60 1.61 0.99 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.41 4.13 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 55 D 8.13 4.56 0.00 2.77 2.68 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 0.00 0.00 0.00 0.00 56 V 8.37 5.02 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 1.38 0.00 0.00 0.92 0.00 0.00 57 V 8.17 4.71 1.84 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 0.58 0.00 0.00 0.70 0.00 0.00 58 E 8.95 4.95 0.00 1.80 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 2.18 2.22 0.00 59 I 8.81 4.91 1.57 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.80 0.72 0.00 0.00 60 I 8.91 4.99 1.90 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 1.13 2.01 0.93 0.00 0.00 61 E 9.51 3.57 0.00 2.13 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 2.13 1.99 0.00 62 S 7.88 4.76 0.00 3.67 3.68 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 0.00 0.00 0.00 0.00 63 R 8.52 3.95 0.00 1.73 1.80 0.00 3.41 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 64 P 0.00 4.06 0.00 2.05 1.99 0.00 3.66 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 2.00 2.10 0.00 65 I 8.07 4.15 1.83 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 0.98 0.31 0.74 0.00 0.00 66 S 7.38 4.51 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 67 K 8.39 4.03 0.00 1.83 1.66 0.00 1.90 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.43 7.81 68 R 9.00 3.97 0.00 1.96 2.00 0.00 3.36 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 69 K 7.38 4.54 0.00 2.02 1.68 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.22 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.49 7.81 70 R 8.27 4.82 0.00 1.61 1.62 0.00 3.17 0.00 0.00 3.30 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 71 F 8.16 5.26 0.00 3.14 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 72 R 9.14 5.13 0.00 1.74 1.83 0.00 3.18 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 73 V 8.27 3.98 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 -0.53 0.00 0.00 0.86 0.00 0.00 74 L 8.71 4.26 0.00 1.69 1.64 0.93 1.05 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 75 R 7.21 4.45 0.00 2.09 2.06 0.00 3.01 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.39 0.00 76 L 8.45 4.81 0.00 1.95 1.72 1.03 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 77 V 9.04 4.04 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 0.84 0.00 0.00 0.90 0.00 0.00 78 E 7.61 4.62 0.00 2.13 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 2.25 2.29 0.00 79 S 8.76 4.37 0.00 3.87 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 80 G 8.76 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 81 R 8.14 3.71 0.00 2.26 2.34 0.00 3.15 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.41 0.00 82 M 8.01 4.40 0.00 2.07 2.15 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 2.70 2.55 0.00 83 D 8.03 3.94 0.00 2.87 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 84 L 7.77 4.18 0.00 1.83 1.74 0.91 1.20 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 85 V 7.61 3.85 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 1.15 0.00 0.00 1.00 0.00 0.00 86 E 9.03 3.95 0.00 2.15 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 2.34 2.50 0.00 87 K 7.55 3.92 0.00 1.96 1.93 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.49 7.81 88 Y 7.67 4.04 0.00 3.07 3.12 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 89 L 8.36 3.63 0.00 1.73 1.65 0.93 1.12 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 I 8.47 3.76 2.05 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 1.37 1.13 0.88 0.00 0.00 91 R 8.31 3.75 0.00 1.94 1.85 0.00 3.16 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 92 R 7.02 2.94 0.00 1.12 1.50 0.00 3.06 0.00 0.00 3.03 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.21 0.00 93 Q 8.44 4.01 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.66 6.49 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 94 N 8.22 4.07 0.00 2.95 2.96 0.00 0.00 6.99 7.48 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 95 Y 7.57 3.96 0.00 3.05 3.02 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 96 Q 8.71 4.28 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 97 S 9.02 4.74 0.00 3.85 3.05 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 98 L 7.76 3.66 0.00 1.74 1.94 0.91 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.18 4.41 0.00 3.93 3.36 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 0.00 100 K 8.53 4.75 0.00 1.72 1.77 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.31 1.37 7.81 101 R 7.00 4.50 0.00 1.75 1.14 0.00 3.44 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.35 0.00 102 G 8.67 4.26 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 0.00 103 G 8.17 4.09 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 0.00 0.00 0.00 104 K 7.96 4.19 0.00 1.70 1.61 0.00 1.83 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.34 7.81 105 A 7.81 4.14 1.19 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