NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5322 8.3044 120.2867 55.2906 33.9091 174.0956 3 V 4.1139 8.0714 121.4507 59.6564 33.0329 173.2101 4 W 4.5614 9.0721 135.0000 57.2510 31.8853 174.8226 5 T 4.0008 7.9535 122.1998 61.3803 67.1637 172.4445 6 P 4.4823 0.0000 0.0000 63.5160 32.2118 175.7672 7 V 3.9768 7.3398 120.2057 62.6243 32.6406 175.4815 8 N 4.1890 8.7103 125.8431 54.8606 35.8827 173.3972 9 N 5.0478 7.4675 108.1932 52.9077 40.2463 174.2293 10 K 4.0758 8.2562 116.0087 56.5600 32.7414 176.6061 11 M 4.9727 8.3279 121.0455 53.9459 35.2749 175.3724 12 F 4.5919 8.3915 116.3101 57.3744 41.1063 176.1725 13 E 3.4590 8.3045 122.8092 57.1966 28.0612 175.6025 14 T 3.8305 8.3479 122.0412 66.4388 68.9557 174.3044 15 F 4.5291 9.0004 124.1363 57.6566 36.7731 176.3146 16 S 4.5126 8.1092 114.3351 60.1566 63.0864 174.4208 17 Y 4.4007 8.2628 117.5650 58.1673 38.1205 175.0719 18 L 4.6855 7.5977 120.2646 52.1945 43.5961 174.5335 19 P 4.4228 0.0000 0.0000 61.8423 31.7737 174.9711 20 P 4.2620 0.0000 0.0000 62.9850 31.7691 176.2777 21 L 4.0443 8.3149 122.5321 54.6327 42.2595 177.9431 22 T 4.2038 8.1938 113.9181 61.2291 71.0621 175.1554 23 D 4.3639 8.6507 121.5196 57.8679 40.8343 178.9662 24 E 3.9276 8.1032 119.0560 59.2027 29.6200 178.6286 25 Q 3.9943 7.8702 117.7830 58.4329 28.8643 178.4457 26 I 3.7089 8.1034 121.1724 64.3519 37.2127 178.2254 27 A 4.0579 8.2662 121.4999 55.1942 18.2276 179.5854 28 A 4.0062 7.9383 118.8200 55.3190 18.4061 179.9171 29 Q 4.0853 7.9717 116.4025 59.1114 28.8172 179.0791 30 V 3.7469 8.1238 119.3172 66.1944 31.5907 177.7392 31 D 4.4306 8.3464 118.6502 57.6069 40.5159 178.2300 32 Y 4.1817 8.0844 119.8560 60.5889 38.7976 178.0050 33 I 3.9568 8.0221 120.8436 64.5204 37.3315 178.5960 34 V 3.5014 7.8967 118.5939 66.0334 31.2116 177.8713 35 A 3.9244 8.2373 119.3504 54.5870 18.2169 178.3103 36 N 4.1073 7.0277 112.4014 52.0341 38.7388 175.6730 37 G 3.7732 7.3514 108.2598 46.0682 0.0000 174.0797 38 W 4.9547 7.5500 118.7799 55.9943 30.7126 176.3930 39 I 4.3452 8.9837 123.4840 59.6887 37.6704 174.0889 40 P 4.8792 0.0000 0.0000 62.9811 32.7674 175.1645 41 C 4.9747 8.6638 120.3357 58.6129 35.7251 172.3966 42 L 5.2949 8.6651 123.9657 53.1542 44.3724 175.2060 43 E 5.6036 9.0904 121.4954 54.9242 33.8847 174.7286 44 F 5.6123 9.1942 115.7340 56.0985 41.9387 172.9610 45 A 4.5334 8.3322 120.5696 50.1807 22.7669 176.2318 46 E 4.3307 8.6463 118.7911 55.6844 30.7502 177.7312 47 A 4.3288 8.8368 122.3177 55.8051 18.3637 179.9067 48 D 4.4874 8.1747 113.3386 56.5275 41.0449 177.3055 49 K 4.5843 7.8675 116.7866 56.0414 32.4460 176.9100 50 A 3.8468 7.6321 124.6964 53.8594 18.8276 178.2950 51 Y 4.6551 7.4128 111.5580 55.5418 40.1691 175.6963 52 V 3.7758 8.3114 122.5018 63.9307 31.9423 175.1902 53 S 4.7202 8.8745 119.5086 56.8639 66.1195 173.7059 54 N 5.1206 8.6087 114.6185 52.5768 39.0142 175.9603 55 E 3.9025 8.3253 120.5061 59.9943 29.3279 179.2062 56 S 4.0485 8.6254 114.9218 60.4935 62.8805 176.0074 57 A 2.5800 7.7580 123.5340 53.5733 17.7450 179.0632 58 I 3.5540 6.9191 116.1331 63.5089 38.0371 177.0731 59 R 4.3169 7.4407 116.4147 55.5664 30.6004 176.2672 60 F 5.0451 7.1921 118.1184 56.0869 41.2253 177.4344 61 G 4.0834 8.2386 117.8466 46.3483 0.0000 175.7849 62 S 4.6410 8.4498 114.4581 58.7467 62.3438 174.4584 63 V 4.4395 7.3214 107.3116 61.2149 33.0588 177.4489 64 S 4.5279 8.1955 114.0585 59.0631 63.5868 173.3376 65 C 4.0239 8.0293 119.4260 61.5288 27.9296 173.1588 66 L 3.6092 8.4484 123.4291 55.6479 38.8925 173.2089 67 Y 4.4568 7.6733 119.4581 55.9143 40.1273 174.6088 68 Y 4.9015 7.2420 123.2643 56.3623 42.3385 174.6996 69 D 4.4992 8.9447 123.6304 55.3562 41.7594 176.8351 70 N 4.4276 8.9008 116.9349 54.2898 35.8558 176.1131 71 R 3.9563 8.0145 118.6059 59.3178 30.4025 177.1356 72 Y 4.3489 7.6993 114.6294 58.0037 38.2502 175.3352 73 W 5.0161 8.6799 124.1534 55.2502 32.7503 174.6798 74 T 4.2315 8.2069 117.5340 62.6808 69.1854 174.7584 75 M 4.6135 8.5899 126.9361 55.4697 33.1397 175.1438 76 W 4.8465 9.6347 135.0000 56.0271 31.3863 176.8347 77 K 3.4171 8.4965 128.6868 57.5744 30.6722 177.9693 78 L 4.9280 8.2585 124.7756 52.6600 45.1267 174.0222 79 P 4.3102 0.0000 0.0000 63.4809 31.9714 177.7627 80 M 4.3265 8.6739 123.9484 53.8030 30.3323 175.3672 81 F 4.3813 7.4959 118.8734 58.7691 40.0087 176.1562 82 G 3.9561 9.1275 112.2895 45.9059 0.0000 172.8183 83 C 4.3262 7.8629 120.4408 59.3297 31.7883 173.3912 84 R 4.5410 8.6321 123.9709 55.5570 31.1785 174.3072 85 D 4.8446 7.8615 118.7303 51.7418 42.4089 174.8186 86 P 4.3070 0.0000 0.0000 65.9956 31.2590 178.5104 87 M 4.1140 8.3218 117.6007 58.2833 31.8957 178.4889 88 Q 3.9667 7.8777 119.8987 59.1083 29.2285 178.6289 89 V 3.6089 7.7374 118.6391 66.1246 31.8560 177.7542 90 L 4.0311 7.9600 118.6972 58.0312 41.3763 179.8566 91 R 3.9962 8.3243 118.0776 59.2221 29.8645 178.9848 92 E 4.0936 8.1273 118.0977 59.1948 29.4039 179.3281 93 I 3.5198 7.7844 120.0641 64.2337 37.1627 178.5372 94 V 3.4662 7.6204 118.4013 65.9663 31.3760 177.8878 95 A 3.9491 8.0824 120.5930 55.2207 18.2471 179.2141 96 C 2.0000 7.6596 117.5752 62.0855 30.9679 175.9844 97 T 3.7734 7.6260 111.1928 64.1749 68.0410 176.6013 98 K 3.8260 7.6103 121.9899 59.3894 32.3495 178.4393 99 A 4.0049 7.5918 119.8311 53.5268 19.7239 177.6401 100 F 4.6975 7.7656 115.6785 55.0447 39.0148 174.0427 101 P 4.4153 0.0000 0.0000 64.1666 31.8900 177.8907 102 D 4.6868 8.0803 116.8316 53.8822 41.2319 175.3982 103 A 4.8075 7.3084 121.3158 50.3700 21.3869 177.0708 104 Y 4.2063 8.5811 118.0107 57.8710 39.3794 175.2495 105 V 5.2335 8.9487 123.4896 61.1101 35.1809 174.3268 106 R 4.9873 9.3171 123.4372 54.2738 33.1106 173.7279 107 L 4.6456 8.1609 123.7456 54.0397 43.7688 175.7360 108 V 4.8442 8.6334 118.3512 59.4914 36.3330 174.2032 109 A 4.9811 8.1338 121.9678 50.4546 22.8572 175.1554 110 F 5.2820 9.0683 119.9177 55.7620 42.4374 174.0711 111 D 5.3961 8.7666 122.5850 52.8655 42.4328 176.6759 112 N 4.7725 9.1067 122.4082 54.0154 38.5280 176.4285 113 Q 4.1651 8.8516 118.8892 59.0003 28.9176 177.6116 114 K 4.0495 8.2567 114.6252 56.8421 32.9974 176.5183 115 Q 3.4599 7.9386 118.3171 55.8131 27.0104 172.5883 116 V 4.4754 7.7828 116.9811 59.9919 34.9785 174.0403 117 Q 4.3745 8.8028 123.4355 56.7062 29.1851 175.6428 118 I 4.1854 7.9108 125.1462 61.0993 39.4371 174.3739 119 M 4.4609 6.6398 117.1192 54.8827 34.1446 173.7053 120 G 4.8372 8.3639 106.3872 47.1908 0.0000 172.4025 121 F 5.0853 7.1453 115.7538 55.2063 41.1171 172.9079 122 L 4.4962 8.8675 123.1562 55.6474 42.0419 176.8031 123 V 4.5284 8.9308 118.2020 61.4726 34.0193 175.6868 124 Q 4.6152 7.8015 121.3533 54.5602 32.3378 173.1376 125 R 4.2975 8.1270 121.7805 53.0944 32.6288 173.7473 126 P 4.1779 0.0000 0.0000 62.4404 31.8244 177.8176 127 K 4.1611 8.4802 121.1132 59.2484 32.6896 177.7475 128 T 4.1605 7.7443 108.1019 62.0482 69.4049 174.6771 129 A 4.2583 7.9169 127.0070 52.8061 18.6242 177.4987 130 R 4.5062 8.8180 120.4627 56.0275 31.5638 175.7310 131 D 4.9121 8.3385 117.6511 52.7348 39.7593 175.5739 132 F 5.3254 7.6619 112.9198 55.5595 41.0307 173.6855 133 Q 4.5135 8.3758 120.2699 53.0496 31.1928 174.1637 134 P 4.4515 0.0000 0.0000 62.3480 31.9164 176.9262 135 A 3.9604 8.9214 123.7086 55.6789 18.1625 179.2062 136 N 4.6284 8.0737 109.4282 53.9714 37.8753 175.5509 137 K 4.4624 7.9118 117.9485 56.3663 32.7873 177.3834 138 R 3.6095 7.5399 120.4725 57.6992 30.1485 176.6697 139 S 5.0457 7.4999 110.4110 56.2916 65.9711 174.2610 140 V 3.9917 8.6467 114.7929 61.7364 32.1153 175.6259 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 M 8.30 4.53 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.07 4.11 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 1.05 0.00 0.00 0.97 0.00 0.00 4 W 9.07 4.56 0.00 3.43 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 5 T 7.95 4.00 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 1.01 0.00 0.00 6 P 0.00 4.48 0.00 2.23 2.19 0.00 3.78 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 7 V 7.34 3.98 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 0.76 0.00 0.00 0.91 0.00 0.00 8 N 8.71 4.19 0.00 2.78 2.88 0.00 0.00 6.83 8.00 0.00 0.00 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 N 7.47 5.05 0.00 2.49 2.67 0.00 0.00 7.31 6.68 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 10 K 8.26 4.08 0.00 1.97 1.55 0.00 0.61 0.00 0.00 1.26 0.00 0.00 2.31 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.32 1.41 7.81 11 M 8.33 4.97 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.65 0.00 12 F 8.39 4.59 0.00 3.12 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 13 E 8.30 3.46 0.00 2.12 1.72 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 2.19 2.13 0.00 14 T 8.35 3.83 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 0.12 0.00 0.00 15 F 9.00 4.53 0.00 3.31 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 16 S 8.11 4.51 0.00 4.17 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 0.00 17 Y 8.26 4.40 0.00 3.02 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 18 L 7.60 4.69 0.00 1.89 1.62 0.87 0.98 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 19 P 0.00 4.42 0.00 2.03 2.00 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 20 P 0.00 4.26 0.00 2.04 2.03 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.18 0.00 21 L 8.31 4.04 0.00 1.59 1.48 0.41 0.52 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 22 T 8.19 4.20 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 1.18 0.00 0.00 23 D 8.65 4.36 0.00 2.70 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 24 E 8.10 3.93 0.00 2.01 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 0.00 2.35 2.38 0.00 25 Q 7.87 3.99 0.00 2.29 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.59 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 26 I 8.10 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 1.67 1.05 1.08 0.00 0.00 27 A 8.27 4.06 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 28 A 7.94 4.01 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 29 Q 7.97 4.09 0.00 2.43 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.33 1.84 0.00 30 V 8.12 3.75 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 1.10 0.00 0.00 1.08 0.00 0.00 31 D 8.35 4.43 0.00 3.00 2.76 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 32 Y 8.08 4.18 0.00 3.23 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 33 I 8.02 3.96 2.17 0.00 0.00 1.00 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 0.91 1.11 0.00 0.00 34 V 7.90 3.50 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 1.00 0.00 0.00 0.96 0.00 0.00 35 A 8.24 3.92 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 36 N 7.03 4.11 0.00 1.44 1.42 0.00 0.00 7.02 7.50 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 37 G 7.35 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 38 W 7.55 4.95 0.00 3.36 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 39 I 8.98 4.35 2.12 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.84 0.73 0.00 0.00 40 P 0.00 4.88 0.00 2.09 1.99 0.00 3.82 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 41 C 8.66 4.97 0.00 3.09 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 42 L 8.67 5.29 0.00 1.85 1.63 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.09 5.60 0.00 2.04 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 0.00 2.35 2.30 0.00 44 F 9.19 5.61 0.00 3.05 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 45 A 8.33 4.53 -0.16 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 0.00 0.00 0.00 46 E 8.65 4.33 0.00 2.18 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 0.00 2.30 2.28 0.00 47 A 8.84 4.33 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 48 D 8.17 4.49 0.00 2.70 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 49 K 7.87 4.58 0.00 1.52 1.69 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.42 7.81 50 A 7.63 3.85 0.52 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 51 Y 7.41 4.66 0.00 2.93 2.76 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 52 V 8.31 3.78 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 0.57 0.00 0.00 0.72 0.00 0.00 53 S 8.87 4.72 0.00 4.06 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 54 N 8.61 5.12 0.00 2.75 2.85 0.00 0.00 6.56 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 55 E 8.33 3.90 0.00 2.15 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 0.00 2.40 2.39 0.00 56 S 8.63 4.05 0.00 4.02 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 57 A 7.76 2.58 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 58 I 6.92 3.55 1.78 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 1.48 0.81 0.84 0.00 0.00 59 R 7.44 4.32 0.00 1.90 2.00 0.00 3.19 0.00 0.00 3.21 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 60 F 7.19 5.05 0.00 3.00 2.79 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 61 G 8.24 4.08 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 0.00 0.00 0.00 62 S 8.45 4.64 0.00 3.86 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 63 V 7.32 4.44 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 0.67 0.00 0.00 0.50 0.00 0.00 64 S 8.20 4.53 0.00 4.12 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 0.00 65 C 8.03 4.02 0.00 2.96 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 66 L 8.45 3.61 0.00 1.79 1.76 0.94 0.97 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 67 Y 7.67 4.46 0.00 2.92 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 68 Y 7.24 4.90 0.00 2.80 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 69 D 8.94 4.50 0.00 2.79 2.66 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 70 N 8.90 4.43 0.00 3.05 3.25 0.00 0.00 7.00 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 71 R 8.01 3.96 0.00 1.52 1.68 0.00 3.08 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 72 Y 7.70 4.35 0.00 3.05 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 73 W 8.68 5.02 0.00 3.07 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 74 T 8.21 4.23 2.86 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 0.95 0.00 0.00 75 M 8.59 4.61 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.78 0.00 76 W 9.63 4.85 0.00 3.69 3.31 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 77 K 8.50 3.42 0.00 1.70 0.82 0.00 1.77 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.89 0.21 7.81 78 L 8.26 4.93 0.00 1.60 1.58 1.01 1.03 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 79 P 0.00 4.31 0.00 0.66 1.82 0.00 3.66 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 1.96 2.16 0.00 80 M 8.67 4.33 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 81 F 7.50 4.38 0.00 3.10 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 82 G 9.13 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 83 C 7.86 4.33 0.00 2.97 3.01 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 0.00 0.00 0.00 84 R 8.63 4.54 0.00 1.80 1.86 0.00 3.22 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 85 D 7.86 4.84 0.00 2.66 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.31 0.00 2.22 2.12 0.00 3.67 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 87 M 8.32 4.11 0.00 2.06 2.25 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.71 0.00 88 Q 7.88 3.97 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 89 V 7.74 3.61 2.26 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 1.05 0.00 0.00 0.97 0.00 0.00 90 L 7.96 4.03 0.00 1.91 1.72 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.32 4.00 0.00 2.02 2.01 0.00 3.15 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 92 E 8.13 4.09 0.00 2.25 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 2.60 2.65 0.00 93 I 7.78 3.52 2.00 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 1.34 0.76 0.85 0.00 0.00 94 V 7.62 3.47 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 0.98 0.00 0.00 0.93 0.00 0.00 95 A 8.08 3.95 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 96 C 7.66 2.00 0.00 1.23 2.39 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 97 T 7.63 3.77 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 1.13 0.00 0.00 98 K 7.61 3.83 0.00 1.86 1.94 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.40 7.81 99 A 7.59 4.00 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 0.00 100 F 7.77 4.70 0.00 2.90 2.79 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 0.00 101 P 0.00 4.42 0.00 2.12 2.11 0.00 3.24 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.08 4.69 0.00 2.68 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 0.00 103 A 7.31 4.81 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 0.00 104 Y 8.58 4.21 0.00 2.54 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 0.00 105 V 8.95 5.23 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 0.93 0.00 0.00 0.87 0.00 0.00 106 R 9.32 4.99 0.00 1.87 1.94 0.00 2.37 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.35 0.00 107 L 8.16 4.65 0.00 1.50 0.72 0.91 0.67 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 0.00 108 V 8.63 4.84 1.63 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 0.52 0.00 0.00 0.53 0.00 0.00 109 A 8.13 4.98 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 0.00 110 F 9.07 5.28 0.00 2.98 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 0.00 111 D 8.77 5.40 0.00 2.43 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 0.00 0.00 0.00 0.00 112 N 9.11 4.77 0.00 2.93 3.05 0.00 0.00 6.26 7.39 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 0.00 113 Q 8.85 4.17 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.02 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 114 K 8.26 4.05 0.00 1.76 1.87 0.00 2.05 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.46 7.81 115 Q 7.94 3.46 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.69 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 116 V 7.78 4.48 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 0.56 0.00 0.00 0.91 0.00 0.00 117 Q 8.80 4.37 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.86 0.00 0.00 0.00 0.00 0.00 2.19 1.94 0.00 118 I 7.91 4.19 1.24 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.60 -0.78 0.00 0.00 119 M 6.64 4.46 0.00 2.11 2.23 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.70 0.00 120 G 8.36 4.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 F 7.15 5.09 0.00 3.24 3.34 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 0.00 122 L 8.87 4.50 0.00 1.65 1.65 0.54 0.50 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 0.00 123 V 8.93 4.53 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 0.69 0.00 0.00 0.91 0.00 0.00 124 Q 7.80 4.62 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 125 R 8.13 4.30 0.00 1.21 1.51 0.00 2.21 0.00 0.00 2.53 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.29 0.00 126 P 0.00 4.18 0.00 2.06 1.98 0.00 2.20 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.86 0.00 127 K 8.48 4.16 0.00 1.86 1.94 0.00 1.55 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.40 7.81 128 T 7.74 4.16 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 1.21 0.00 0.00 129 A 7.92 4.26 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.82 4.51 0.00 1.81 1.91 0.00 3.21 0.00 0.00 3.27 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.76 0.00 131 D 8.34 4.91 0.00 2.91 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 0.00 132 F 7.66 5.33 0.00 3.20 3.15 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 0.00 133 Q 8.38 4.51 0.00 1.89 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.03 0.00 0.00 0.00 0.00 0.00 2.29 2.04 0.00 134 P 0.00 4.45 0.00 2.35 2.18 0.00 3.58 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 1.89 0.00 135 A 8.92 3.96 1.38 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 0.00 0.00 136 N 8.07 4.63 0.00 2.84 2.95 0.00 0.00 5.85 7.13 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 0.00 137 K 7.91 4.46 0.00 1.62 1.71 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.30 1.30 7.81 138 R 7.54 3.61 0.00 1.54 0.66 0.00 3.03 0.00 0.00 2.97 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.53 0.00 139 S 7.50 5.05 0.00 4.02 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 0.00 140 V 8.65 3.99 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 0.61 0.00 0.00 0.96 0.00 0.00