NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9628 8.3393 109.7370 45.8648 0.0000 171.8048 2 S 4.3732 8.8248 111.7889 58.4509 64.4750 172.5206 3 S 4.6558 7.9810 114.3798 55.5138 65.7780 174.4825 4 G 4.0377 8.4103 115.4390 44.7902 0.0000 172.0873 5 S 4.5151 8.0033 113.2093 57.2677 65.4586 172.4989 6 S 4.7899 8.4169 115.9151 56.1655 65.0961 172.2926 7 G 4.1827 8.2114 111.1082 42.9008 0.0000 172.4182 8 A 4.0773 8.4620 122.6622 52.0132 18.6769 178.0242 9 V 4.3430 8.0165 116.6780 59.4004 34.1545 175.6354 10 S 4.3739 8.5379 116.7271 57.9433 62.8690 174.5325 11 G 4.7601 8.3713 117.7631 45.4146 0.0000 173.6855 12 L 4.0393 8.4338 124.7644 57.4404 41.5300 177.0538 13 Y 4.5440 7.6037 116.5481 57.0132 40.2335 174.1869 14 S 4.7210 9.0943 114.9579 57.3923 67.1094 176.0151 15 S 4.2135 8.9092 118.5739 61.4812 62.8293 175.9840 16 S 4.2008 8.3167 114.7805 61.3610 62.5496 174.4616 17 D 4.6234 7.5482 118.9698 53.7652 41.1926 175.7448 18 D 4.4485 8.4648 117.7418 56.3830 41.2744 177.0149 19 V 3.9841 7.5903 119.4728 62.6082 32.3400 174.9046 20 I 4.1019 8.1148 128.1979 60.3514 38.2936 174.8878 21 E 4.0765 8.9049 128.7907 56.4565 28.9088 175.4129 22 L 4.3658 8.2431 126.7411 54.1703 42.6461 176.6736 23 T 4.4102 8.1851 112.2129 58.9116 71.9430 172.7128 24 P 4.6330 0.0000 0.0000 63.5287 30.7266 177.0568 25 S 4.6881 7.9826 115.7550 58.6579 65.2898 174.5983 26 N 4.8982 7.7220 114.9246 52.1308 39.1391 176.2550 27 F 3.4950 8.7455 121.7394 61.2093 39.2740 176.9291 28 N 4.3760 8.1320 116.1570 56.6220 38.8722 176.5640 29 R 4.1282 7.7312 115.7333 57.2810 30.3976 177.1666 30 E 4.2394 7.9493 118.0428 57.8561 31.0724 177.0512 31 V 2.3096 6.6778 117.0610 63.9631 31.8788 177.5652 32 I 3.8844 7.3792 119.1813 64.2899 37.1805 176.6030 33 Q 4.5075 8.4045 118.0209 55.8130 29.1556 175.9209 34 S 4.5844 8.3567 114.5346 55.9123 63.0126 173.4212 35 D 4.5326 8.9265 127.5512 56.8685 41.3943 177.7648 36 G 3.9090 7.3929 106.0654 45.0838 0.0000 171.9612 37 L 4.9427 8.2479 120.7454 53.8369 44.4344 176.8056 38 W 5.2052 9.1618 123.7177 54.9668 33.6780 174.2269 39 L 5.2839 9.2385 124.8501 53.2868 43.3449 175.0706 40 V 4.5659 8.8193 124.8777 61.1331 33.6084 173.9326 41 E 4.6507 8.5944 128.5743 54.3383 32.0580 174.5533 42 F 4.7607 9.6317 127.1741 56.0914 39.7964 174.5395 43 Y 5.0934 7.6750 122.2776 54.9184 41.8786 174.1196 44 A 4.6643 8.3101 119.6708 49.4212 21.7736 175.1958 45 P 4.5223 0.0000 0.0000 63.5393 31.4398 176.7121 46 W 4.7135 7.2101 114.7389 56.6194 29.7542 175.1560 47 C 4.4962 6.9345 119.6669 58.5958 31.8411 172.6758 48 G 3.8032 7.6163 106.9756 46.2298 0.0000 175.1426 49 H 4.1443 7.7923 117.1406 58.3104 28.3329 177.3967 50 C 4.2098 7.9554 118.6154 62.9800 28.0094 175.8157 51 Q 4.1829 7.7305 117.4630 58.1590 28.3123 178.1277 52 R 4.3394 7.2502 115.9937 56.3181 30.7288 176.8735 53 L 4.6033 7.9833 120.5753 55.1431 42.2220 177.8082 54 T 3.5416 7.7213 117.1703 65.9840 68.4892 174.6743 55 P 4.2541 0.0000 0.0000 65.7928 31.4943 178.3055 56 E 4.0070 8.1388 117.9284 58.9249 29.6622 178.9667 57 W 4.4537 8.5954 128.4647 60.4567 30.8654 178.0112 58 K 3.9160 8.4736 118.5603 59.5065 31.5141 179.0022 59 K 3.7819 8.0351 118.3661 59.8242 32.0561 179.0740 60 A 3.8619 7.9039 119.7406 55.0674 17.7834 179.3669 61 A 3.7570 7.4486 118.9169 55.1643 18.0859 180.1375 62 T 4.2317 7.7248 114.9569 66.2286 68.6270 176.6102 63 A 4.1114 7.4387 120.9508 54.8263 18.7617 178.7789 64 L 4.2362 7.9226 116.0085 54.5001 41.4287 178.4951 65 K 3.6195 7.1013 121.9050 59.3678 32.0196 177.4449 66 D 4.5028 7.7193 115.0863 55.0660 41.3142 177.4628 67 V 3.6486 7.0495 118.7988 63.7770 32.1239 175.1061 68 V 4.0648 7.6746 120.8943 60.4013 33.9362 174.7489 69 K 3.1385 7.8102 127.5308 56.8018 32.3870 176.3817 70 V 4.1577 7.7139 126.6625 61.7561 31.8712 174.5499 71 G 4.9157 8.3308 119.8731 46.0738 0.0000 170.7106 72 A 4.3668 8.0212 118.0662 51.1977 22.6519 175.9988 73 V 4.2699 7.6212 122.9355 60.8641 34.3637 174.6698 74 N 3.8371 8.5823 126.6624 52.6276 37.8137 174.3491 75 A 3.7785 8.1461 127.8454 55.0842 18.9803 179.2176 76 D 4.4937 8.0611 113.4651 57.5541 41.4770 177.5953 77 K 4.1135 7.9724 118.2374 59.7380 32.8370 178.2608 78 H 4.7657 8.4586 116.4385 55.3808 28.8309 177.4890 79 Q 4.5492 8.5673 121.8590 58.2392 28.5568 179.1463 80 S 4.1512 8.0083 115.0219 61.3241 63.1047 176.3259 81 L 4.0456 7.8824 121.8677 57.4919 41.6653 179.1890 82 G 3.3309 8.3680 105.1633 47.8778 0.0000 175.4544 83 G 3.6502 8.0728 107.9262 47.2028 0.0000 175.1103 84 Q 4.0346 8.1347 120.8528 58.5307 28.9480 177.3852 85 Y 4.3899 8.1359 115.9562 59.4013 39.4033 175.1469 86 G 3.4532 7.4188 108.3125 45.3036 0.0000 173.6611 87 V 3.9445 7.5420 121.2519 61.8632 31.6388 175.2855 88 Q 4.5678 8.9014 125.2692 55.6482 31.2763 175.7853 89 G 3.7884 8.0307 105.2599 43.6569 0.0000 172.0116 90 F 5.0701 7.4682 124.3016 55.0040 40.8282 174.0845 91 P 4.8469 0.0000 0.0000 63.5464 32.4221 176.4325 92 T 4.5840 8.7326 117.5231 62.2757 71.5905 172.9966 93 I 4.6817 8.3893 127.6461 60.3184 39.5340 175.3022 94 K 5.1008 9.4304 124.6154 54.9022 36.3933 175.1496 95 I 4.9641 8.7226 125.1429 59.9040 39.6104 174.5242 96 F 4.5924 9.4667 126.0129 57.0979 41.0075 173.9226 97 G 4.2530 9.2653 116.7958 45.7018 0.0000 173.9317 98 A 3.8690 8.5573 123.8091 54.1827 19.4966 178.3712 99 N 4.8346 7.7239 121.0800 51.2214 39.2016 175.4869 100 K 4.3460 8.6971 125.7508 59.0021 32.4575 178.3424 101 N 4.5719 8.3245 115.1514 54.7142 38.8921 174.9822 102 K 4.2777 7.9612 116.5528 53.4383 33.5372 173.9578 103 P 4.3943 0.0000 0.0000 62.5776 32.8352 175.0138 104 E 4.7156 8.7746 118.9744 54.4110 32.1951 175.8234 105 D 4.8140 8.7297 123.1425 54.3936 41.5878 175.5138 106 Y 4.5086 8.6703 125.8980 58.2360 39.0767 176.2908 107 Q 4.2025 8.8444 125.4944 56.1358 30.6084 175.9876 108 G 3.7848 7.5017 105.9848 44.8593 0.0000 172.8322 109 G 3.7324 8.3483 107.7121 45.8862 0.0000 173.5549 110 R 4.7747 8.4249 121.1430 56.4258 30.9383 176.2462 111 T 4.7180 7.8091 107.6758 59.6225 70.9392 175.3804 112 G 4.3865 8.4414 110.8248 47.7977 0.0000 175.7063 113 E 4.1067 8.2071 119.9146 58.9707 29.7239 178.4908 114 A 4.0577 7.7280 119.6892 55.6874 18.5232 179.4042 115 I 4.2248 8.1159 119.5934 64.0371 37.2337 178.5479 116 V 3.4796 7.6291 118.1812 66.2399 31.3623 177.6565 117 D 4.3473 8.1150 116.8927 56.9777 41.0986 177.9352 118 A 4.0208 8.4469 121.6728 55.1724 18.4585 179.2640 119 A 3.8584 8.3591 119.6542 55.4207 18.3762 179.7442 120 L 3.8516 7.7604 116.7874 57.9229 41.5514 179.3088 121 S 4.0777 7.9287 111.8763 61.7641 62.0916 176.2087 122 A 4.1252 8.0322 123.0069 54.9311 18.1706 178.9287 123 L 3.8832 7.9447 119.0887 58.6548 41.8343 179.1145 124 R 3.8598 7.6993 116.2623 59.8249 30.1986 178.2503 125 S 4.2483 7.5309 110.4702 60.4367 62.5987 174.9615 126 G 4.0328 7.7498 109.6403 43.6626 0.0000 172.0861 127 P 4.2006 0.0000 0.0000 65.0896 31.6361 175.0700 128 S 4.0389 8.1680 113.6543 57.9289 61.6318 173.8070 129 S 4.2555 8.2286 121.8899 58.3452 63.6890 174.8119 130 G 3.9973 8.7013 108.8474 45.9592 0.0000 173.7568 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 1 G 8.34 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 0.00 0.00 0.00 2 S 8.82 4.37 0.00 4.05 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 3 S 7.98 4.66 0.00 3.80 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 4 G 8.41 4.04 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 0.00 0.00 0.00 5 S 8.00 4.52 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 6 S 8.42 4.79 0.00 3.83 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 7 G 8.21 4.18 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 0.00 0.00 0.00 8 A 8.46 4.08 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 9 V 8.02 4.34 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 0.86 0.00 0.00 0.98 0.00 0.00 10 S 8.54 4.37 0.00 3.91 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 11 G 8.37 4.76 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 0.00 0.00 0.00 0.00 12 L 8.43 4.04 0.00 1.06 1.30 0.63 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 7.60 4.54 0.00 3.28 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 14 S 9.09 4.72 0.00 3.99 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 15 S 8.91 4.21 0.00 3.99 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 16 S 8.32 4.20 0.00 4.00 4.06 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 17 D 7.55 4.62 0.00 2.79 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 18 D 8.46 4.45 0.00 2.69 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 19 V 7.59 3.98 2.20 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 0.66 0.00 0.00 0.98 0.00 0.00 20 I 8.11 4.10 2.05 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.74 1.10 0.00 0.00 21 E 8.90 4.08 0.00 2.01 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 2.35 2.46 0.00 22 L 8.24 4.37 0.00 1.51 1.32 0.31 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.19 4.41 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 1.29 0.00 0.00 24 P 0.00 4.63 0.00 2.17 2.12 0.00 3.46 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 25 S 7.98 4.69 0.00 3.85 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 26 N 7.72 4.90 0.00 2.73 2.96 0.00 0.00 5.76 8.23 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 27 F 8.75 3.50 0.00 3.16 2.91 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 28 N 8.13 4.38 0.00 2.91 2.79 0.00 0.00 7.24 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 29 R 7.73 4.13 0.00 1.86 1.92 0.00 3.38 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 30 E 7.95 4.24 0.00 1.43 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 2.12 2.24 0.00 31 V 6.68 2.31 1.10 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 -0.04 0.00 0.00 -1.14 0.00 0.00 32 I 7.38 3.88 2.02 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.19 1.03 0.00 0.00 33 Q 8.40 4.51 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 34 S 8.36 4.58 0.00 4.21 4.06 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 35 D 8.93 4.53 0.00 2.69 2.75 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 0.00 0.00 0.00 36 G 7.39 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 37 L 8.25 4.94 0.00 1.78 1.47 1.05 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 38 W 9.16 5.21 0.00 3.26 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 39 L 9.24 5.28 0.00 1.41 1.81 0.69 0.65 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 40 V 8.82 4.57 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 0.42 0.00 0.00 0.46 0.00 0.00 41 E 8.59 4.65 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 1.90 1.75 0.00 42 F 9.63 4.76 0.00 2.95 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 43 Y 7.68 5.09 0.00 3.01 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 44 A 8.31 4.66 0.24 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 P 0.00 4.52 0.00 2.32 2.37 0.00 3.65 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 2.16 2.07 0.00 46 W 7.21 4.71 0.00 3.50 3.29 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 47 C 6.93 4.50 0.00 1.67 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.62 3.80 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 0.00 0.00 0.00 49 H 7.79 4.14 0.00 3.37 3.64 0.00 5.48 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 50 C 7.96 4.21 0.00 2.99 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 51 Q 7.73 4.18 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.91 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 52 R 7.25 4.34 0.00 1.97 1.96 0.00 3.15 0.00 0.00 3.15 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.88 0.00 53 L 7.98 4.60 0.00 1.85 1.77 1.06 0.78 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 54 T 7.72 3.54 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 0.13 0.00 0.00 55 P 0.00 4.25 0.00 2.26 2.27 0.00 3.66 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 2.07 2.02 0.00 56 E 8.14 4.01 0.00 2.15 2.30 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 2.45 2.37 0.00 57 W 8.60 4.45 0.00 3.71 3.37 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 58 K 8.47 3.92 0.00 1.96 1.87 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.65 1.87 7.81 59 K 8.04 3.78 0.00 2.06 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.10 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.67 7.81 60 A 7.90 3.86 0.98 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 61 A 7.45 3.76 1.14 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 62 T 7.72 4.23 4.29 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 1.25 0.00 0.00 63 A 7.44 4.11 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 64 L 7.92 4.24 0.00 1.50 1.63 0.71 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.10 3.62 0.00 1.79 1.86 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.32 7.81 66 D 7.72 4.50 0.00 2.62 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 67 V 7.05 3.65 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 0.68 0.00 0.00 0.90 0.00 0.00 68 V 7.67 4.06 1.87 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 0.69 0.00 0.00 0.84 0.00 0.00 69 K 7.81 3.14 0.00 0.79 0.74 0.00 1.37 0.00 0.00 0.98 0.00 0.00 2.69 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.80 0.78 7.81 70 V 7.71 4.16 1.60 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 -0.12 0.00 0.00 0.48 0.00 0.00 71 G 8.33 4.92 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 0.00 0.00 0.00 0.00 0.00 0.00 72 A 8.02 4.37 0.95 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 73 V 7.62 4.27 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 1.01 0.00 0.00 0.93 0.00 0.00 74 N 8.58 3.84 0.00 2.59 2.41 0.00 0.00 6.99 8.19 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 75 A 8.15 3.78 0.46 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 0.00 0.00 76 D 8.06 4.49 0.00 3.12 3.09 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 77 K 7.97 4.11 0.00 1.71 1.71 0.00 1.44 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.33 1.43 7.81 78 H 8.46 4.77 0.00 3.18 3.25 0.00 5.70 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 8.57 4.55 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.21 0.00 0.00 0.00 0.00 0.00 2.81 2.33 0.00 80 S 8.01 4.15 0.00 4.05 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 81 L 7.88 4.05 0.00 1.88 1.78 0.91 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.37 3.33 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 0.00 83 G 8.07 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 84 Q 8.13 4.03 0.00 2.20 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 85 Y 8.14 4.39 0.00 2.80 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 86 G 7.42 3.45 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 0.00 0.00 0.00 87 V 7.54 3.94 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 0.80 0.00 0.00 -0.08 0.00 0.00 88 Q 8.90 4.57 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.57 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 89 G 8.03 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 90 F 7.47 5.07 0.00 3.03 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 91 P 0.00 4.85 0.00 2.06 2.09 0.00 3.54 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 92 T 8.73 4.58 4.38 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 1.27 0.00 0.00 93 I 8.39 4.68 2.20 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.94 1.15 0.00 0.00 94 K 9.43 5.10 0.00 2.13 1.82 0.00 1.76 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.61 1.86 7.81 95 I 8.72 4.96 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.82 0.97 0.00 0.00 96 F 9.47 4.59 0.00 3.29 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 97 G 9.27 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 0.00 0.00 0.00 0.00 98 A 8.56 3.87 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 99 N 7.72 4.83 0.00 2.79 2.89 0.00 0.00 6.98 7.06 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 0.00 100 K 8.70 4.35 0.00 1.92 2.09 0.00 2.08 0.00 0.00 2.09 0.00 0.00 3.39 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.60 1.54 7.81 101 N 8.32 4.57 0.00 2.91 2.83 0.00 0.00 6.73 7.63 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 0.00 102 K 7.96 4.28 0.00 1.64 1.66 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.27 1.30 7.81 103 P 0.00 4.39 0.00 1.75 0.49 0.00 3.72 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 2.05 2.02 0.00 104 E 8.77 4.72 0.00 1.96 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 2.24 2.25 0.00 105 D 8.73 4.81 0.00 2.59 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 0.00 106 Y 8.67 4.51 0.00 3.15 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 0.00 107 Q 8.84 4.20 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.70 0.00 0.00 0.00 0.00 0.00 2.25 2.50 0.00 108 G 7.50 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 0.00 109 G 8.35 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 0.00 110 R 8.42 4.77 0.00 1.86 2.04 0.00 3.18 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 111 T 7.81 4.72 4.29 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 1.33 0.00 0.00 112 G 8.44 4.39 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 0.00 113 E 8.21 4.11 0.00 2.05 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 2.41 2.40 0.00 114 A 7.73 4.06 1.51 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 0.00 0.00 115 I 8.12 4.22 1.88 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.64 0.00 0.00 116 V 7.63 3.48 2.28 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 0.91 0.00 0.00 0.92 0.00 0.00 117 D 8.11 4.35 0.00 2.78 2.78 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 0.00 118 A 8.45 4.02 1.54 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 0.00 119 A 8.36 3.86 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 120 L 7.76 3.85 0.00 1.85 1.71 0.92 0.97 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 0.00 121 S 7.93 4.08 0.00 4.06 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 0.00 122 A 8.03 4.13 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 0.00 123 L 7.94 3.88 0.00 1.85 1.81 0.94 0.94 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 0.00 124 R 7.70 3.86 0.00 1.97 2.02 0.00 3.25 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 125 S 7.53 4.25 0.00 3.89 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 0.00 126 G 7.75 4.03 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 0.00 0.00 0.00 127 P 0.00 4.20 0.00 2.20 2.20 0.00 3.82 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 128 S 8.17 4.04 0.00 3.87 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 0.00 129 S 8.23 4.26 0.00 4.01 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 0.00 130 G 8.70 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 0.00 0.00 0.00