NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4229 8.3044 118.1953 55.4773 32.5655 174.3399 1 V 4.1381 7.7856 117.9299 61.3598 33.8815 172.0891 2 L 4.2317 8.3024 127.8101 54.1767 43.4061 177.0411 3 S 4.5406 8.6571 117.3852 57.7388 65.3970 175.1939 4 E 4.3202 8.7593 122.1014 59.3462 29.4850 178.8085 5 G 3.6672 8.1038 105.4732 47.7815 0.0000 175.4030 6 E 3.9185 8.1285 120.8022 58.9967 29.3955 179.3712 7 W 4.3749 8.0911 118.9464 59.8506 29.0748 178.5512 8 Q 4.1142 8.3091 117.9518 59.2046 28.2287 178.9125 9 L 4.1040 7.8930 119.5676 57.8224 41.5762 179.8910 10 V 3.8067 7.8655 118.2808 65.7968 31.6820 177.6903 11 L 4.4588 8.5231 117.9539 56.5751 41.4349 178.6348 12 H 4.3518 8.1557 118.6677 59.1313 30.3195 177.2425 13 V 3.7220 7.8536 120.3862 64.1931 31.3237 178.1146 14 W 3.8929 8.4766 129.1074 59.9929 30.2772 177.7598 15 A 4.0388 7.8607 119.8656 54.4778 18.0983 179.4081 16 K 3.9413 7.7746 117.5125 59.2646 32.2277 179.3810 17 V 2.8131 7.1519 117.9515 65.8751 31.0038 177.5681 18 E 3.8840 7.5151 115.9468 58.3061 29.2812 178.5777 19 A 4.2487 7.4278 120.1527 53.5425 19.8580 177.5590 20 D 4.6709 7.8394 117.1661 52.0108 42.2882 175.7254 21 V 3.5922 7.8559 123.7825 63.9965 31.8949 178.3285 22 A 4.1176 7.9789 121.3242 54.7794 18.3664 179.6593 23 G 3.7351 8.2245 105.6517 47.7516 0.0000 175.7424 24 H 4.1579 8.2012 118.8928 58.3628 28.7075 177.9582 25 G 3.7226 8.4623 107.9790 48.0560 0.0000 175.4817 26 Q 3.8661 8.2235 120.5349 58.7223 28.7637 178.3209 27 D 4.3589 7.9963 119.6511 57.7359 40.8816 179.4665 28 I 3.6433 7.7815 119.6984 64.5233 37.0910 178.6436 29 L 3.4654 7.6900 119.6738 57.5261 41.3108 179.7189 30 I 3.7560 7.6956 119.9685 64.1590 37.0220 178.3717 31 R 3.8494 8.0193 119.7573 59.0764 29.8426 178.4200 32 L 3.8862 7.8777 120.2661 58.3082 41.9419 179.0224 33 F 4.6096 7.9380 118.0945 60.4450 38.5426 177.9681 34 K 4.0274 8.3884 117.7689 59.6333 31.9947 179.3024 35 S 4.2887 7.8912 113.9464 60.4652 63.9895 174.6354 36 H 4.6889 8.3883 119.8057 52.2500 29.2034 172.1033 37 P 4.6451 0.0000 0.0000 64.3416 31.5458 177.5399 38 E 4.1133 8.2611 116.5953 59.4097 29.4159 178.9865 39 T 3.8973 8.3564 110.9813 64.0924 68.7936 176.1478 40 L 3.8980 8.0752 123.3481 57.6124 41.7618 178.5005 41 E 4.0441 7.9572 117.5370 59.1898 29.3965 178.9755 42 K 4.3533 8.1708 117.8966 57.8552 32.7731 177.2209 43 F 4.2366 8.2105 118.8548 55.7704 37.5467 175.9820 44 D 4.4439 8.2407 126.0002 56.7208 41.0861 178.3806 45 R 4.0342 7.7042 118.9603 58.9810 30.8201 177.1837 46 F 5.0182 7.7029 113.5126 55.2594 38.0081 175.8033 47 K 3.9941 8.1218 123.2493 60.4586 32.6539 177.2624 48 H 4.3543 8.2252 112.8558 57.3153 28.8405 175.3445 49 L 3.9018 7.4044 121.1309 55.2036 41.5579 176.9742 50 K 4.1665 9.5547 124.6307 57.9293 32.7846 177.2892 51 T 4.6565 7.5088 107.6323 59.2273 72.8778 174.3978 52 E 3.8701 8.5277 120.1923 59.2548 29.3642 178.3424 53 A 4.0104 7.8595 119.7523 54.9095 18.9020 179.0047 54 E 4.0354 7.9699 116.9645 59.7840 29.4377 179.3406 55 M 3.9459 8.2406 118.9846 58.3506 31.8143 178.9755 56 K 3.9535 8.3604 117.4122 58.2142 32.2345 178.1473 57 A 4.6456 7.2776 118.5050 50.7461 19.5401 176.7350 58 S 4.2932 7.6760 114.7622 57.6643 63.4259 174.4898 59 E 3.9610 8.7353 130.1055 59.0774 29.5038 178.3605 60 D 4.3979 8.0069 118.8131 57.3633 40.9920 178.1094 61 L 3.5557 7.5461 120.7645 57.9616 41.8903 178.9865 62 K 3.9217 7.7994 119.6444 59.1358 32.1089 179.0792 63 K 4.0162 8.0743 118.9819 59.4253 31.9907 179.4279 64 V 3.8360 8.0478 118.7263 65.9806 31.4924 178.1989 65 G 3.6784 8.4042 105.6813 47.9536 0.0000 175.7917 66 V 3.6803 7.9669 120.6871 66.0803 31.5368 178.3178 67 T 4.0082 8.0275 115.5964 66.3227 68.2317 177.0415 68 V 3.6860 7.9887 120.4592 65.9705 31.5608 178.2192 69 L 4.2142 8.1237 118.7626 58.1711 41.5310 179.4641 70 T 3.9656 8.4601 115.9452 66.7859 68.2636 176.5138 71 A 4.0626 8.1285 122.5854 54.6714 18.2761 179.5706 72 L 3.6968 8.0665 119.2157 58.2365 42.2408 179.1458 73 G 3.4333 8.3711 105.7362 47.9928 0.0000 175.3514 74 A 4.0722 7.7880 121.5506 54.4560 18.6005 179.4004 75 I 3.8930 7.1990 118.8727 64.2377 37.3534 178.4195 76 L 4.0245 7.8420 120.0208 57.5484 41.1559 179.5987 77 K 3.9777 7.7219 117.4010 58.7430 32.1962 179.1151 78 K 3.9322 7.8807 118.7418 56.6670 31.8480 177.2080 79 K 2.0000 7.9025 117.3641 56.7562 29.5717 176.1689 80 G 4.0735 8.2137 107.8210 46.1377 0.0000 175.0798 81 H 4.6777 7.6804 117.9647 53.8925 27.1984 174.5803 82 H 5.0370 7.0990 113.4412 55.3196 29.9799 177.2574 83 E 3.8361 8.0489 120.9570 59.6684 29.2490 179.1843 84 A 4.0700 7.9093 118.8315 54.8313 17.8910 178.8466 85 E 4.1696 8.0650 116.4764 58.7582 29.7587 178.9915 86 L 4.2282 7.9525 119.5154 58.0380 41.7225 178.3940 87 K 3.7665 7.9607 117.6494 59.7060 31.9471 176.8298 88 P 4.2430 0.0000 0.0000 66.3079 31.1868 178.3531 89 L 4.0069 7.4600 116.5266 57.9878 42.0352 178.7797 90 A 4.2917 8.6834 121.0941 54.8331 18.2849 179.5537 91 Q 3.8747 8.3605 118.8388 59.5001 29.2013 178.5511 92 S 4.0856 8.1170 115.3031 61.6315 63.0233 176.0619 93 H 4.1342 8.5345 119.4856 58.2516 28.2801 177.3191 94 A 2.8252 7.9807 121.8116 53.6478 18.4471 178.6848 95 T 4.0324 7.3195 112.6360 64.2732 70.0548 175.8733 96 K 4.0093 7.5303 120.2888 58.9007 32.6992 177.1993 97 H 4.3933 7.8603 113.8991 55.6471 29.4076 175.4224 98 K 3.2983 7.4757 117.0075 56.7845 28.4980 173.0412 99 I 4.3100 8.2200 118.7553 58.3281 38.3923 174.4698 100 P 4.4177 0.0000 0.0000 62.4890 31.9355 177.5262 101 I 3.6351 8.0969 119.8538 64.3608 36.9127 178.4696 102 K 3.6768 7.8927 120.0235 59.7319 31.9000 178.2552 103 Y 4.1902 8.0140 117.0087 60.9472 37.8285 178.3461 104 L 4.1831 7.9865 119.6041 57.6971 41.8412 179.1418 105 E 4.0092 8.1055 118.5763 59.4432 29.5020 179.2538 106 F 4.6088 7.8806 117.7224 60.9772 38.9436 177.7276 107 I 3.8932 8.1656 117.6912 63.8981 37.7455 178.0742 108 S 4.2166 8.0548 116.0307 61.4331 62.6163 176.0295 109 E 4.1029 8.4134 121.7323 58.8857 29.3865 178.6554 110 A 4.0834 8.0081 121.0497 54.8795 18.3863 179.6367 111 I 3.7036 8.1426 118.6859 64.7963 37.2639 178.8231 112 I 3.8658 8.0211 120.4472 64.3816 36.8214 178.1333 113 H 4.1665 8.2293 119.5298 59.1442 29.6717 177.5433 114 V 3.5850 7.9030 120.0921 65.9395 31.3157 177.9538 115 L 3.7861 7.9355 118.9241 57.9071 41.0769 178.9680 116 H 4.3141 7.8616 117.0071 59.4297 29.8914 177.2744 117 S 4.1898 7.8160 115.7615 61.7387 62.7815 176.6243 118 R 3.9551 8.0560 119.8312 58.0611 31.3283 177.1574 119 H 5.0020 8.0020 115.2320 53.9961 28.8460 173.4696 120 P 4.3419 0.0000 0.0000 65.7327 31.8736 178.7158 121 G 3.7042 8.1522 107.0476 47.9092 0.0000 173.7168 122 N 4.8449 8.1694 114.2571 53.0773 39.5279 174.8461 123 F 4.9772 7.8443 119.1276 56.2358 39.4425 174.5244 124 G 3.9346 7.5204 109.7424 43.9074 0.0000 171.0901 125 A 3.8596 8.3611 120.7325 55.3560 18.4619 179.7528 126 D 4.1860 7.9815 116.6865 57.5055 40.8811 178.7497 127 A 3.9256 7.8119 120.7081 55.0802 18.2934 179.3388 128 Q 3.1238 7.8822 118.4835 58.9231 29.0614 178.5714 129 G 3.5240 8.1405 106.7771 47.7196 0.0000 175.5125 130 A 3.8576 8.0615 123.1583 55.0057 18.3660 179.3911 131 M 3.9637 8.2646 117.0138 58.7337 32.3331 177.8650 132 N 4.2939 8.4350 117.5119 56.5786 39.0445 176.5029 133 K 3.7775 8.0938 120.7283 59.6944 32.2143 178.5865 134 A 3.8269 8.0550 120.8866 54.9028 18.1130 179.5390 135 L 4.1569 8.0783 117.6771 57.6830 41.7651 179.2641 136 E 3.9561 8.6501 119.1251 59.1558 29.3692 179.0095 137 L 3.9328 8.1791 120.5440 58.2120 42.1561 178.5822 138 F 4.1370 8.3938 120.4872 61.6453 39.1604 177.3696 139 R 3.3404 8.1962 117.5809 58.9027 29.8354 178.9249 140 K 3.8092 8.2449 119.7891 59.6050 32.1633 178.6338 141 D 4.3259 7.9996 119.1735 57.2723 40.6870 178.8259 142 I 3.4795 7.5373 120.2428 64.0415 36.9833 178.2372 143 A 3.5704 7.9139 121.7660 55.0822 18.0578 179.5818 144 A 3.9585 7.9278 119.1833 55.1908 18.4006 180.0783 145 K 4.0170 8.0981 117.1460 59.5361 32.0018 178.9938 146 Y 4.3908 8.2892 117.4030 61.3127 37.8855 178.5929 147 K 3.8679 8.2076 120.2028 59.9300 31.9632 178.5530 148 E 4.0573 7.8001 117.4849 59.1592 29.5160 178.6006 149 L 4.3149 7.8784 116.6624 55.3610 41.8369 177.8514 150 G 3.9568 8.0894 107.5423 45.5877 0.0000 173.0657 151 Y 4.2990 8.1216 120.2398 59.2042 40.0863 176.8320 152 Q 3.0062 7.9629 115.1606 57.2864 26.5041 174.0696 153 G 3.0037 7.7792 114.6329 45.2418 0.0000 170.4594 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 M 8.30 4.42 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 1 V 7.79 4.14 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 0.80 0.00 0.00 0.96 0.00 0.00 2 L 8.30 4.23 0.00 1.15 0.68 0.60 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.66 4.54 0.00 4.06 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 4 E 8.76 4.32 0.00 2.20 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 2.43 2.52 0.00 5 G 8.10 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.13 3.92 0.00 1.95 1.70 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 2.21 2.26 0.00 7 W 8.09 4.37 0.00 3.55 3.19 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 8 Q 8.31 4.11 0.00 2.39 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.46 2.77 0.00 9 L 7.89 4.10 0.00 1.91 1.76 0.90 0.72 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 10 V 7.87 3.81 2.42 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 1.20 0.00 0.00 0.92 0.00 0.00 11 L 8.52 4.46 0.00 1.84 1.81 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.16 4.35 0.00 3.36 3.57 0.00 5.95 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.85 3.72 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 1.07 0.00 0.00 0.95 0.00 0.00 14 W 8.48 3.89 0.00 3.67 3.17 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 15 A 7.86 4.04 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.77 3.94 0.00 1.50 1.64 0.00 1.62 0.00 0.00 1.46 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.45 7.81 17 V 7.15 2.81 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 0.00 0.00 0.02 0.00 0.00 0.41 0.00 0.00 18 E 7.52 3.88 0.00 2.00 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 2.23 2.12 0.00 19 A 7.43 4.25 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 20 D 7.84 4.67 0.00 2.71 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 21 V 7.86 3.59 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 0.91 0.00 0.00 0.92 0.00 0.00 22 A 7.98 4.12 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 23 G 8.22 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 24 H 8.20 4.16 0.00 3.16 3.25 0.00 5.83 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 25 G 8.46 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 26 Q 8.22 3.87 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.65 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 27 D 8.00 4.36 0.00 2.84 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 28 I 7.78 3.64 1.90 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 1.53 0.67 0.91 0.00 0.00 29 L 7.69 3.47 0.00 1.47 1.13 0.87 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.70 3.76 1.89 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.52 0.88 0.00 0.00 31 R 8.02 3.85 0.00 1.91 2.12 0.00 3.02 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 32 L 7.88 3.89 0.00 1.72 1.38 1.05 1.14 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 33 F 7.94 4.61 0.00 3.04 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 34 K 8.39 4.03 0.00 1.63 1.84 0.00 1.68 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.77 7.81 35 S 7.89 4.29 0.00 3.84 3.51 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 36 H 8.39 4.69 0.00 2.94 2.93 0.00 5.62 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.65 0.00 2.16 2.10 0.00 3.83 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.98 0.00 38 E 8.26 4.11 0.00 2.29 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 2.32 2.54 0.00 39 T 8.36 3.90 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 0.76 0.00 0.00 40 L 8.08 3.90 0.00 1.38 1.76 0.23 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.96 4.04 0.00 2.36 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 0.00 2.38 2.39 0.00 42 K 8.17 4.35 0.00 1.91 1.70 0.00 1.86 0.00 0.00 1.73 0.00 0.00 3.14 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.72 1.95 7.81 43 F 8.21 4.24 0.00 2.93 2.14 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 44 D 8.24 4.44 0.00 2.58 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 45 R 7.70 4.03 0.00 1.58 1.31 0.00 3.33 0.00 0.00 3.30 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.77 0.00 46 F 7.70 5.02 0.00 3.03 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 47 K 8.12 3.99 0.00 1.87 1.92 0.00 1.79 0.00 0.00 1.95 0.00 0.00 2.84 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.60 7.81 48 H 8.23 4.35 0.00 3.36 3.47 0.00 5.59 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.40 3.90 0.00 1.54 1.57 0.66 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.55 4.17 0.00 1.80 1.85 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.52 7.81 51 T 7.51 4.66 4.22 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 1.20 0.00 0.00 52 E 8.53 3.87 0.00 2.04 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 0.00 2.35 2.35 0.00 53 A 7.86 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 7.97 4.04 0.00 2.27 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 0.00 2.31 2.33 0.00 55 M 8.24 3.95 0.00 2.00 2.25 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.49 0.00 56 K 8.36 3.95 0.00 1.79 1.83 0.00 1.64 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.57 7.81 57 A 7.28 4.65 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 58 S 7.68 4.29 0.00 3.76 3.64 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 59 E 8.74 3.96 0.00 2.11 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 2.38 2.46 0.00 60 D 8.01 4.40 0.00 2.85 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 61 L 7.55 3.56 0.00 0.80 1.49 0.62 0.65 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 62 K 7.80 3.92 0.00 1.76 1.86 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.46 7.81 63 K 8.07 4.02 0.00 1.94 1.89 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.72 1.49 7.81 64 V 8.05 3.84 2.47 0.00 0.00 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 1.28 0.00 0.00 65 G 8.40 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 0.00 0.00 0.00 66 V 7.97 3.68 2.25 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 1.12 0.00 0.00 0.94 0.00 0.00 67 T 8.03 4.01 4.51 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 1.30 0.00 0.00 68 V 7.99 3.69 2.31 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 1.13 0.00 0.00 1.18 0.00 0.00 69 L 8.12 4.21 0.00 1.84 1.90 0.95 0.71 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 70 T 8.46 3.97 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 1.26 0.00 0.00 71 A 8.13 4.06 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 72 L 8.07 3.70 0.00 1.73 1.75 0.27 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.37 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 74 A 7.79 4.07 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 75 I 7.20 3.89 1.81 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 1.51 0.76 0.84 0.00 0.00 76 L 7.84 4.02 0.00 1.39 1.59 -0.01 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.72 3.98 0.00 1.78 1.80 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.49 7.81 78 K 7.88 3.93 0.00 1.79 1.82 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.60 1.60 7.81 79 K 7.90 2.00 0.00 1.36 0.74 0.00 1.45 0.00 0.00 1.42 0.00 0.00 2.73 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.30 0.65 7.81 80 G 8.21 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 0.00 0.00 0.00 81 H 7.68 4.68 0.00 3.19 3.25 0.00 5.76 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.10 5.04 0.00 3.32 3.47 0.00 5.51 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 83 E 8.05 3.84 0.00 2.11 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 2.42 2.51 0.00 84 A 7.91 4.07 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 85 E 8.06 4.17 0.00 2.23 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 0.00 2.39 2.47 0.00 86 L 7.95 4.23 0.00 2.11 1.74 0.97 0.85 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 87 K 7.96 3.77 0.00 1.77 1.82 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.68 7.81 88 P 0.00 4.24 0.00 2.29 2.36 0.00 3.81 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 2.11 2.07 0.00 89 L 7.46 4.01 0.00 1.84 1.93 0.94 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.68 4.29 1.50 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 91 Q 8.36 3.87 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 92 S 8.12 4.09 0.00 4.00 4.10 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 0.00 0.00 0.00 93 H 8.53 4.13 0.00 3.65 3.66 0.00 5.80 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 94 A 7.98 2.83 0.80 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 95 T 7.32 4.03 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 1.10 0.00 0.00 96 K 7.53 4.01 0.00 1.49 1.42 0.00 1.70 0.00 0.00 1.49 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.26 1.27 7.81 97 H 7.86 4.39 0.00 2.99 3.13 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.48 3.30 0.00 1.72 1.72 0.00 1.46 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.20 1.15 7.81 99 I 8.22 4.31 2.12 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.93 1.13 0.00 0.00 100 P 0.00 4.42 0.00 1.91 1.97 0.00 3.10 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 1.41 0.00 101 I 8.10 3.64 1.77 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.97 0.78 0.00 0.00 102 K 7.89 3.68 0.00 1.69 1.60 0.00 1.51 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.24 0.49 7.81 103 Y 8.01 4.19 0.00 3.17 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 0.00 104 L 7.99 4.18 0.00 1.80 1.79 0.71 1.16 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 0.00 105 E 8.11 4.01 0.00 2.08 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 2.33 2.32 0.00 106 F 7.88 4.61 0.00 3.18 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 0.00 107 I 8.17 3.89 2.02 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 1.09 0.00 0.00 108 S 8.05 4.22 0.00 4.23 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 0.00 109 E 8.41 4.10 0.00 2.19 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 0.00 2.39 2.41 0.00 110 A 8.01 4.08 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 0.00 111 I 8.14 3.70 2.14 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.73 1.04 0.00 0.00 112 I 8.02 3.87 2.08 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 1.72 0.90 1.12 0.00 0.00 113 H 8.23 4.17 0.00 3.38 3.48 0.00 5.78 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 0.00 114 V 7.90 3.58 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 1.00 0.00 0.00 1.01 0.00 0.00 115 L 7.94 3.79 0.00 1.13 0.13 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.86 4.31 0.00 3.51 3.62 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.82 4.19 0.00 3.81 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 0.00 118 R 8.06 3.96 0.00 1.55 1.54 0.00 2.84 0.00 0.00 3.03 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 119 H 8.00 5.00 0.00 3.19 3.23 0.00 5.62 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 0.00 120 P 0.00 4.34 0.00 2.17 2.13 0.00 3.74 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 121 G 8.15 3.70 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 0.00 0.00 0.00 122 N 8.17 4.84 0.00 2.81 2.97 0.00 0.00 6.58 7.45 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 0.00 123 F 7.84 4.98 0.00 2.99 2.98 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 0.00 124 G 7.52 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 0.00 0.00 0.00 125 A 8.36 3.86 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 0.00 126 D 7.98 4.19 0.00 2.65 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 0.00 127 A 7.81 3.93 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 0.00 128 Q 7.88 3.12 0.00 1.18 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 129 G 8.14 3.52 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 0.00 0.00 0.00 130 A 8.06 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 M 8.26 3.96 0.00 2.36 2.37 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.91 0.00 132 N 8.44 4.29 0.00 2.87 2.97 0.00 0.00 6.87 7.27 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 0.00 133 K 8.09 3.78 0.00 1.99 1.59 0.00 1.60 0.00 0.00 1.56 0.00 0.00 3.11 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.39 7.81 134 A 8.05 3.83 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 0.00 135 L 8.08 4.16 0.00 1.77 1.83 1.01 0.72 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 0.00 136 E 8.65 3.96 0.00 2.09 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 2.65 0.00 137 L 8.18 3.93 0.00 1.86 1.98 1.03 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.39 4.14 0.00 3.10 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 0.00 139 R 8.20 3.34 0.00 1.91 1.79 0.00 3.14 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.90 0.00 140 K 8.24 3.81 0.00 1.74 1.88 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.43 7.81 141 D 8.00 4.33 0.00 2.86 2.69 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 0.00 142 I 7.54 3.48 1.25 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 -0.01 0.18 0.00 0.00 143 A 7.91 3.57 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 0.00 144 A 7.93 3.96 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 0.00 145 K 8.10 4.02 0.00 2.05 1.94 0.00 1.59 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.55 7.81 146 Y 8.29 4.39 0.00 3.38 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 0.00 147 K 8.21 3.87 0.00 2.01 1.94 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.50 7.81 148 E 7.80 4.06 0.00 2.13 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 0.00 2.36 2.50 0.00 149 L 7.88 4.31 0.00 1.80 1.71 0.98 0.89 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 0.00 150 G 8.09 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 0.00 151 Y 8.12 4.30 0.00 2.47 2.69 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 0.00 152 Q 7.96 3.01 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.61 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 153 G 7.78 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 0.00 0.00 0.00