NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 D 4.6717 8.4645 119.5565 52.9494 42.1901 176.8881 7 K 4.4922 7.6341 121.3387 51.8429 33.2100 169.5815 8 V 4.3713 8.0502 123.3010 60.5089 34.8326 174.1529 9 L 4.5253 8.4612 130.3456 53.6955 42.3397 175.2961 10 K 4.3526 8.5464 126.6321 55.8353 33.4514 176.1447 11 I 5.0283 8.3685 125.4368 59.5622 39.6815 174.5531 12 Q 4.5107 8.9613 128.5002 54.5053 30.8870 174.0230 13 L 4.7757 8.5008 126.8562 53.7810 42.1264 176.6272 14 R 4.4386 9.2621 124.4045 57.3420 31.1086 176.5719 15 S 4.6300 7.7852 111.8672 56.1631 66.2220 174.4849 16 A 4.1135 8.4562 122.6634 54.5979 18.1333 178.9615 17 S 4.2465 8.2097 111.3727 60.2857 63.2473 174.8694 18 A 4.4148 7.4770 123.1878 52.0534 18.7783 176.7638 19 T 4.4984 8.0030 116.4243 61.0714 71.4668 174.5983 20 V 3.6978 8.2239 125.5138 62.1966 32.1161 173.8829 21 P 5.4717 0.0000 0.0000 62.8688 31.7847 175.6019 22 T 4.9452 8.7347 112.2897 59.8445 72.5210 172.8782 23 K 4.3828 8.7039 122.0107 55.8384 32.7659 177.4520 24 G 3.7336 8.6784 112.3650 47.1565 0.0000 173.1989 25 S 4.6566 7.4810 111.8272 56.1434 66.3031 173.6417 26 A 4.0641 8.5250 122.3478 54.5128 18.1980 178.2111 27 T 4.4136 7.5918 107.1012 61.3993 68.0905 173.6070 28 A 4.0139 7.2886 122.4647 52.1177 18.9114 178.3602 29 A 3.9654 8.6855 124.8978 54.3173 18.6632 177.4862 30 G 4.1731 7.5967 100.2373 44.6147 0.0000 171.8777 31 Y 4.8939 8.6766 117.4585 55.8103 40.2634 175.8203 32 D 4.7215 9.7888 125.7599 54.7705 42.3554 175.3314 33 I 4.7927 8.8797 123.8662 59.8104 39.7068 174.0935 34 Y 5.2704 8.6808 123.6526 55.7271 40.2025 175.5573 35 A 4.4920 9.1246 126.1678 52.8597 19.3781 177.9452 36 S 4.8859 9.0837 114.6218 58.3481 64.3023 174.1003 37 Q 4.6720 7.8180 118.2643 54.2133 32.6656 174.4210 38 D 4.7293 8.7008 122.1591 55.1211 41.8423 175.5193 39 I 4.3914 8.7005 120.0005 60.5200 42.0616 172.9388 40 T 4.9485 8.4865 123.8674 61.8925 71.0885 173.9132 41 I 4.4299 8.8978 127.8239 59.0385 38.3287 173.6222 42 P 4.8807 0.0000 0.0000 62.3231 31.9327 176.2272 43 A 4.0548 9.1441 124.3612 53.4456 19.1145 177.0777 44 M 3.5423 8.0297 118.1641 54.8856 30.8699 176.9051 45 G 4.3198 7.6508 105.6402 45.7727 0.0000 171.9566 46 Q 5.2348 8.7505 116.6265 55.4525 31.9836 173.6652 47 G 4.2682 8.7907 106.4415 45.6257 0.0000 171.3180 48 M 5.2379 8.4481 118.9368 53.3566 34.6329 175.7015 49 V 4.1803 8.9270 124.9558 61.6052 33.2961 175.4735 50 S 4.8436 8.7498 124.3152 58.9205 63.4994 174.9618 51 T 4.4851 8.7069 111.3382 60.5046 70.7769 173.6907 52 D 4.4761 9.2883 121.4514 55.1500 39.3552 172.6920 53 I 5.1724 7.4979 110.1843 59.3102 41.1612 174.3048 54 S 5.0650 8.9458 118.7641 56.9522 66.7866 173.0505 55 F 5.9431 7.8076 115.2409 55.9845 41.1681 173.6007 56 T 4.6636 8.5321 116.9993 61.9906 70.1649 174.7109 57 V 4.1341 8.6521 120.0253 60.3482 32.8783 174.6159 58 P 4.4683 0.0000 0.0000 62.2960 32.5849 176.2453 59 V 3.6901 8.3174 121.4036 64.8984 31.9088 176.6367 60 G 3.9974 9.2103 113.9709 45.3681 0.0000 172.2806 61 T 5.3842 7.5141 108.3590 59.8377 71.9734 172.4259 62 Y 4.9526 8.4630 119.0699 55.0859 42.1502 174.7607 63 G 4.1218 9.1051 107.8066 45.0168 0.0000 172.9801 64 R 4.9773 8.6010 128.7280 55.4516 31.3871 175.5118 65 I 4.6346 8.9417 128.8369 60.9537 37.4375 175.2435 66 A 5.0086 8.9631 129.5480 49.0730 22.4147 173.4389 67 P 4.7526 0.0000 0.0000 62.3485 32.8340 176.3497 68 R 4.1967 8.3790 120.5923 56.0132 31.2507 178.0414 69 S 4.1952 8.8090 118.8136 61.6093 62.8761 177.1096 70 G 3.6394 8.0268 107.9310 47.9516 0.0000 175.5437 71 L 3.8467 7.8474 120.8165 57.0622 41.4989 179.0542 72 A 4.1734 7.6360 121.8027 54.7936 18.1372 179.9979 73 V 3.5293 7.7678 115.0774 65.4360 31.6743 177.5474 74 K 4.3751 8.2089 116.9670 56.8915 32.8799 176.8418 75 N 4.7983 7.8395 112.9267 51.8848 40.3640 174.8274 76 G 3.8305 7.9224 106.9854 46.2132 0.0000 172.8625 77 I 4.4831 7.3535 120.7302 60.3647 38.5479 174.7274 78 Q 4.7944 9.0660 128.3667 54.2434 32.3517 174.4239 79 T 4.5002 8.6942 115.9306 61.6259 70.0987 174.2258 80 G 3.8783 8.3950 111.9333 43.5755 0.0000 175.7355 81 A 3.5491 9.9859 124.4459 52.5781 17.8567 180.4282 82 G 3.9440 9.0891 109.7689 47.4589 0.0000 172.5206 83 V 4.4581 7.4192 119.0142 62.0645 31.6941 175.3665 84 V 4.1051 9.0493 130.1900 61.3515 32.7328 175.1308 85 D 4.7972 8.6128 128.2281 54.2700 41.5544 177.8702 86 R 4.0461 8.8177 122.0039 59.4250 30.3680 177.7276 87 D 4.4819 8.0673 115.9234 55.4054 39.7284 175.8311 88 Y 4.1993 7.6679 122.1882 58.0071 38.9762 174.9854 89 T 4.1393 7.7257 119.2880 61.3160 68.4950 173.5095 90 G 3.6109 5.6128 109.0885 44.0354 0.0000 172.9375 91 E 3.9698 8.4083 120.0210 56.4094 29.7798 176.4988 92 V 4.0722 8.7866 127.3404 62.4288 31.4057 175.4325 93 K 4.6864 8.5573 127.2319 55.0520 34.6740 176.2029 94 V 4.3091 8.5383 121.9447 61.0882 33.8937 174.6912 95 V 4.1335 8.2946 128.6057 62.5215 32.8594 174.3983 96 L 5.0471 8.4932 127.5761 52.9299 44.8974 175.3817 97 F 5.2693 9.1540 122.4737 56.0977 41.4212 174.3831 98 N 5.0664 9.2062 122.2370 52.3655 40.5480 173.9471 99 H 5.1123 9.1893 123.6153 55.7679 29.8038 175.3480 100 S 4.7198 8.4206 115.3246 56.9968 65.3380 174.8874 101 Q 4.3099 8.7102 117.2028 56.8309 28.8392 176.2211 102 R 4.7614 7.4986 117.1592 53.9115 32.6185 175.6647 103 D 4.7339 8.9493 123.3405 54.6965 42.1460 175.7551 104 F 4.9120 9.4377 124.7065 56.4515 41.0644 174.3304 105 A 4.3907 8.1990 128.9229 51.5054 19.2699 176.2537 106 I 4.2774 8.8749 123.5067 59.2489 40.6030 174.8905 107 K 4.9794 8.8799 125.5675 53.8494 34.9963 175.7195 108 K 4.0430 9.1395 124.0833 58.4969 32.3662 176.5768 109 G 4.1280 9.1664 115.2144 45.2785 0.0000 173.5001 110 D 4.6905 8.1123 120.0089 54.1011 42.2230 176.0312 111 R 4.2542 8.5283 121.7159 56.3473 30.0569 176.6325 112 V 4.4701 8.6619 116.8396 61.6479 34.3650 174.9724 113 A 4.5851 7.3902 120.5879 51.3124 22.7259 174.5506 114 Q 4.9820 8.7615 116.0786 54.4778 32.1714 174.3907 115 L 4.8925 9.2401 124.5275 54.1473 43.8327 175.0031 116 I 4.6206 8.4170 127.1407 59.6581 39.8797 175.2511 117 L 4.4076 8.5071 127.6287 53.5667 40.7900 174.5439 118 E 4.0737 8.1575 122.9647 55.6919 30.6022 176.1764 119 K 4.7299 8.6451 124.9311 56.2730 32.9769 176.2890 120 I 4.7870 8.5661 117.0240 59.2217 41.4175 174.8974 121 V 4.0527 8.4221 122.8700 62.0830 31.3974 174.9652 122 D 5.0115 8.7660 125.8416 53.0376 39.6374 175.7068 123 D 4.8799 7.8128 117.3686 52.9966 40.0196 175.5600 124 A 3.9946 8.1400 122.0076 53.2206 18.8791 177.7862 125 Q 4.2218 8.4680 123.2415 54.8650 29.5125 175.7968 126 I 3.7299 8.3600 127.0388 61.4639 37.5852 175.5926 127 V 4.2556 8.1704 124.3119 60.8293 33.3602 174.7350 128 V 4.0099 8.3403 127.5425 62.2214 32.2460 175.4468 129 V 4.5551 7.9357 119.1197 59.2385 35.4478 175.0711 130 D 4.4961 8.9455 122.8878 56.9277 41.1887 176.4541 131 S 4.6917 7.6119 109.7139 56.7095 66.1295 172.5149 132 L 4.6731 8.0551 120.3917 52.7070 44.0503 176.5063 133 E 4.1180 8.5238 119.4034 56.6529 29.6153 176.2772 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 6 D 8.46 4.67 0.00 2.71 2.65 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 7 K 7.63 4.49 0.00 1.79 1.58 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.26 1.06 7.81 8 V 8.05 4.37 2.08 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 0.93 0.00 0.00 0.93 0.00 0.00 9 L 8.46 4.53 0.00 1.48 1.38 0.68 -0.19 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 10 K 8.55 4.35 0.00 1.79 1.73 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.42 7.81 11 I 8.37 5.03 1.88 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 1.18 0.82 0.96 0.00 0.00 12 Q 8.96 4.51 0.00 2.10 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 13 L 8.50 4.78 0.00 1.56 1.60 0.91 0.98 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 14 R 9.26 4.44 0.00 1.68 1.97 0.00 3.07 0.00 0.00 3.17 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 15 S 7.79 4.63 0.00 3.93 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 16 A 8.46 4.11 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 17 S 8.21 4.25 0.00 3.86 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 18 A 7.48 4.41 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 19 T 8.00 4.50 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 0.40 0.00 0.00 20 V 8.22 3.70 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 0.80 0.00 0.00 0.92 0.00 0.00 21 P 0.00 5.47 0.00 1.94 2.15 0.00 3.72 0.00 0.00 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 22 T 8.73 4.95 4.35 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 1.40 0.00 0.00 23 K 8.70 4.38 0.00 1.59 1.84 0.00 1.54 0.00 0.00 1.46 0.00 0.00 2.13 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.93 1.16 7.81 24 G 8.68 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 25 S 7.48 4.66 0.00 3.89 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 26 A 8.52 4.06 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 27 T 7.59 4.41 4.21 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 1.18 0.00 0.00 28 A 7.29 4.01 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 29 A 8.69 3.97 1.23 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 0.00 0.00 30 G 7.60 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 0.00 0.00 0.00 31 Y 8.68 4.89 0.00 2.86 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 32 D 9.79 4.72 0.00 2.27 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 0.00 0.00 0.00 0.00 33 I 8.88 4.79 1.88 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 0.81 1.00 0.00 0.00 34 Y 8.68 5.27 0.00 2.83 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 35 A 9.12 4.49 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 36 S 9.08 4.89 0.00 3.86 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 37 Q 7.82 4.67 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.00 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 38 D 8.70 4.73 0.00 2.54 2.58 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 0.00 39 I 8.70 4.39 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.09 0.91 0.00 0.00 40 T 8.49 4.95 4.23 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 1.27 0.00 0.00 41 I 8.90 4.43 2.07 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.11 1.00 0.00 0.00 42 P 0.00 4.88 0.00 2.10 2.08 0.00 3.92 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 43 A 9.14 4.05 1.37 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 0.00 0.00 44 M 8.03 3.54 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.71 0.00 45 G 7.65 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 0.00 0.00 0.00 0.00 46 Q 8.75 5.23 0.00 2.27 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 47 G 8.79 4.27 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 0.00 48 M 8.45 5.24 0.00 1.85 1.95 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 2.45 2.43 0.00 49 V 8.93 4.18 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 1.07 0.00 0.00 0.96 0.00 0.00 50 S 8.75 4.84 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 51 T 8.71 4.49 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 1.33 0.00 0.00 52 D 9.29 4.48 0.00 2.84 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 53 I 7.50 5.17 1.98 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.13 1.06 0.00 0.00 54 S 8.95 5.06 0.00 3.77 3.62 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 55 F 7.81 5.94 0.00 2.98 2.95 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 56 T 8.53 4.66 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 1.26 0.00 0.00 57 V 8.65 4.13 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 0.87 0.00 0.00 1.08 0.00 0.00 58 P 0.00 4.47 0.00 2.08 1.98 0.00 3.61 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 2.11 2.11 0.00 59 V 8.32 3.69 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 0.79 0.00 0.00 0.95 0.00 0.00 60 G 9.21 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 61 T 7.51 5.38 4.30 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 1.21 0.00 0.00 62 Y 8.46 4.95 0.00 3.25 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 63 G 9.11 4.12 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 0.00 0.00 0.00 64 R 8.60 4.98 0.00 1.67 1.73 0.00 3.21 0.00 0.00 3.34 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 65 I 8.94 4.63 1.92 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.01 0.95 0.00 0.00 66 A 8.96 5.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 P 0.00 4.75 0.00 2.08 2.05 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.24 0.00 68 R 8.38 4.20 0.00 1.86 1.85 0.00 2.99 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 69 S 8.81 4.20 0.00 3.84 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 70 G 8.03 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 0.00 0.00 0.00 71 L 7.85 3.85 0.00 1.57 1.40 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.64 4.17 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 73 V 7.77 3.53 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 0.86 0.00 0.00 0.91 0.00 0.00 74 K 8.21 4.38 0.00 1.90 1.84 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.45 7.81 75 N 7.84 4.80 0.00 2.29 2.36 0.00 0.00 7.04 6.96 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 76 G 7.92 3.83 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 0.00 77 I 7.35 4.48 1.67 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 -0.11 0.78 0.00 0.00 78 Q 9.07 4.79 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.01 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 79 T 8.69 4.50 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 80 G 8.39 3.88 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 0.00 0.00 0.00 81 A 9.99 3.55 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 82 G 9.09 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 0.00 0.00 0.00 83 V 7.42 4.46 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 0.42 0.00 0.00 0.84 0.00 0.00 84 V 9.05 4.11 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 0.90 0.00 0.00 1.07 0.00 0.00 85 D 8.61 4.80 0.00 2.82 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 86 R 8.82 4.05 0.00 2.02 2.03 0.00 3.56 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 87 D 8.07 4.48 0.00 2.85 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 88 Y 7.67 4.20 0.00 2.90 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 89 T 7.73 4.14 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 1.05 0.00 0.00 90 G 5.61 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 91 E 8.41 3.97 0.00 1.93 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 0.00 2.32 2.32 0.00 92 V 8.79 4.07 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 0.89 0.00 0.00 0.45 0.00 0.00 93 K 8.56 4.69 0.00 1.68 1.82 0.00 1.75 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.45 7.81 94 V 8.54 4.31 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 0.93 0.00 0.00 0.97 0.00 0.00 95 V 8.29 4.13 1.91 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 0.39 0.00 0.00 0.82 0.00 0.00 96 L 8.49 5.05 0.00 1.60 1.48 1.02 0.85 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 97 F 9.15 5.27 0.00 2.84 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 98 N 9.21 5.07 0.00 2.77 2.87 0.00 0.00 6.95 7.92 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 99 H 9.19 5.11 0.00 3.15 3.30 0.00 5.71 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.42 4.72 0.00 3.91 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 0.00 101 Q 8.71 4.31 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.71 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 102 R 7.50 4.76 0.00 1.72 1.85 0.00 3.19 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 103 D 8.95 4.73 0.00 2.59 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 0.00 104 F 9.44 4.91 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 0.00 105 A 8.20 4.39 1.09 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 0.00 106 I 8.87 4.28 1.91 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 1.03 0.44 0.90 0.00 0.00 107 K 8.88 4.98 0.00 1.64 1.67 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.46 7.81 108 K 9.14 4.04 0.00 1.66 1.78 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.17 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.48 7.81 109 G 9.17 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 0.00 110 D 8.11 4.69 0.00 2.72 2.63 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 0.00 0.00 0.00 0.00 111 R 8.53 4.25 0.00 1.56 1.68 0.00 3.17 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.59 0.00 112 V 8.66 4.47 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 0.80 0.00 0.00 1.02 0.00 0.00 113 A 7.39 4.59 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 0.00 114 Q 8.76 4.98 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.24 0.00 115 L 9.24 4.89 0.00 1.69 1.55 0.74 -0.07 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 0.00 116 I 8.42 4.62 1.79 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 1.18 0.55 0.84 0.00 0.00 117 L 8.51 4.41 0.00 1.53 1.60 0.96 0.82 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 0.00 118 E 8.16 4.07 0.00 1.16 1.76 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 2.15 2.02 0.00 119 K 8.65 4.73 0.00 1.66 1.76 0.00 1.70 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.43 7.81 120 I 8.57 4.79 1.96 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.74 1.20 0.00 0.00 121 V 8.42 4.05 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 0.89 0.00 0.00 0.95 0.00 0.00 122 D 8.77 5.01 0.00 2.81 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 0.00 123 D 7.81 4.88 0.00 2.76 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 0.00 124 A 8.14 3.99 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 0.00 125 Q 8.47 4.22 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 126 I 8.36 3.73 1.87 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 1.30 0.65 0.91 0.00 0.00 127 V 8.17 4.26 2.08 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 0.80 0.00 0.00 0.99 0.00 0.00 128 V 8.34 4.01 2.08 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 0.86 0.00 0.00 0.93 0.00 0.00 129 V 7.94 4.56 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 0.77 0.00 0.00 0.97 0.00 0.00 130 D 8.95 4.50 0.00 2.61 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 0.00 131 S 7.61 4.69 0.00 3.95 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 0.00 132 L 8.06 4.67 0.00 1.63 1.62 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 133 E 8.52 4.12 0.00 1.93 1.82 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 2.29 2.30 0.00