NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2954 8.3044 120.3446 55.5950 33.2655 174.2002 2 H 4.4584 8.7905 126.3353 54.2146 30.5914 172.3846 3 L 4.9422 7.7663 126.5737 52.4633 45.7451 176.6015 4 T 4.1095 9.4464 113.0290 60.9543 70.8451 173.6814 5 P 4.1655 0.0000 0.0000 66.1074 31.2648 178.8386 6 E 3.9821 8.0459 116.6663 59.3068 29.4874 179.0662 7 E 3.8944 8.1898 118.6790 59.3129 29.5700 179.3656 8 K 3.8683 8.2336 119.9217 59.3386 32.2282 178.8339 9 S 4.0588 8.0312 113.1744 61.3247 62.4159 176.0371 10 A 4.0341 7.9742 123.5242 54.9683 18.0727 179.8845 11 V 3.4297 7.7048 117.0508 66.3680 31.5587 178.4890 12 T 3.9836 7.9843 109.4255 64.6255 68.4045 176.3923 13 A 4.0017 7.9626 122.7926 54.9020 18.7895 179.0323 14 L 3.9179 7.9204 118.4078 58.0835 42.1052 179.0273 15 W 4.4037 8.6530 128.3950 60.2122 30.4086 178.0906 16 G 3.6975 8.0168 104.7649 47.0556 0.0000 174.8242 17 K 4.3911 7.7721 118.3718 55.7895 32.8261 176.8818 18 V 3.6053 7.1277 120.7315 62.1138 31.9782 175.5562 19 N 4.4886 8.3159 125.6058 52.4620 39.1303 175.4250 20 V 3.4528 8.1266 128.7560 65.8866 31.7648 177.1967 21 D 4.3266 7.9771 118.5878 57.3814 40.8078 178.4316 22 E 3.8305 8.0928 118.8773 59.4476 29.7327 178.9404 23 V 3.6189 7.9501 118.6203 65.6782 31.5037 178.2725 24 G 3.6611 8.3270 105.9609 47.7247 0.0000 176.0309 25 G 3.6008 7.9777 108.0739 47.3282 0.0000 175.4979 26 E 3.8916 8.0631 120.9648 58.8880 29.6549 178.8388 27 A 3.9168 8.2266 121.1459 55.1823 18.6569 179.4287 28 L 4.0043 7.9330 119.0738 58.0759 42.1915 179.4071 29 G 3.5571 8.1206 105.7985 47.9224 0.0000 176.0021 30 R 3.8949 8.0482 120.7116 58.4664 30.0163 178.6525 31 L 4.0095 7.8610 120.3865 58.5299 42.0203 179.3037 32 L 4.0314 7.7808 117.9209 57.1759 41.2352 179.5745 33 V 3.5998 7.2239 117.5382 65.5782 31.7345 177.8664 34 V 3.5608 8.1300 117.2929 64.1613 32.8457 175.6365 35 Y 3.9546 7.2712 115.4114 54.5430 37.8927 174.2607 36 P 4.6899 0.0000 0.0000 64.0338 32.0440 177.9199 37 W 4.2939 8.0293 115.5687 59.1386 27.6652 177.7242 38 T 4.2496 7.7484 110.5476 63.7890 68.2611 176.0282 39 Q 4.3399 8.3502 121.8762 57.9950 28.4866 177.9930 40 R 3.8242 7.5701 116.5607 58.2216 29.3596 177.6865 41 F 4.4464 7.0800 116.1977 57.2294 39.7141 175.5246 42 F 4.6190 7.8398 118.5644 56.8151 39.8224 177.1429 43 E 4.0571 8.4693 122.2496 59.2057 29.4938 178.3271 44 S 4.6388 8.0790 110.8235 58.6257 63.4288 174.4653 45 F 4.5644 8.4413 119.3506 58.0939 39.7932 176.9925 46 G 3.9459 8.1140 107.0980 45.0832 0.0000 174.3154 47 D 4.5501 8.5876 125.6558 54.0024 41.0971 175.7497 48 L 4.8351 8.3538 125.4762 54.3747 42.8679 177.7890 49 S 4.2919 8.0488 115.4925 60.8124 63.1880 175.0111 50 T 4.7358 7.4086 109.3850 58.0726 73.0186 172.7213 51 P 4.1930 0.0000 0.0000 66.1076 31.2729 178.6141 52 D 4.3579 8.1288 116.7401 57.3049 40.4971 178.7266 53 A 3.9797 7.5287 119.8725 55.0177 18.7210 179.4978 54 V 3.6852 8.1316 117.1680 66.6540 31.4585 178.3025 55 M 4.2570 8.4023 117.0467 57.2633 31.8340 177.8943 56 G 4.0866 7.4057 103.6578 43.3268 0.0000 173.6220 57 N 4.4242 7.6476 121.3419 52.8594 39.7624 173.6613 58 P 4.2593 0.0000 0.0000 65.7856 31.5379 178.6334 59 K 3.7191 8.3599 118.6000 58.8776 31.8242 179.5001 60 V 3.7130 7.8580 118.3300 65.8263 31.6999 177.8249 61 K 3.9064 8.1904 119.2200 59.3586 32.1533 178.6266 62 A 3.9722 8.1348 121.1745 55.5299 18.2590 179.1571 63 H 4.3451 8.4579 116.9412 59.2209 29.8527 177.5641 64 G 3.6681 8.2600 107.7180 47.7502 0.0000 175.5000 65 K 3.9532 7.9657 121.6587 59.0810 32.2551 178.8449 66 K 3.9694 7.9074 119.6077 59.4094 32.1447 179.0630 67 V 3.5987 8.0832 118.8752 66.0845 31.5565 177.8336 68 L 4.3730 8.4477 120.1204 57.4657 41.8806 179.0272 69 G 3.7422 8.4752 106.1521 47.9053 0.0000 175.5817 70 A 4.1492 7.9255 122.2758 54.7449 18.8352 179.0489 71 F 4.3423 8.6333 119.2950 61.5226 39.5281 177.2199 72 S 4.1481 8.8584 113.1678 61.7635 62.2879 176.0457 73 D 4.5471 8.3848 121.3935 57.0163 40.4461 178.9765 74 G 3.5025 7.8762 106.2186 47.4418 0.0000 175.6631 75 L 3.7801 7.1913 119.2648 56.6116 41.6141 178.3344 76 A 4.2616 7.3050 118.5962 52.7189 19.4341 176.6420 77 H 4.8843 8.0553 115.3114 54.8006 29.8669 175.6523 78 L 3.8876 8.0443 120.3189 57.6277 41.7659 178.3174 79 D 4.7002 7.8796 115.7635 54.7461 41.8945 176.3438 80 N 5.0044 8.2027 118.1047 51.2787 39.7797 174.6395 81 L 4.0256 7.9180 123.1626 57.8492 42.4483 179.3514 82 K 4.0425 8.1183 117.9970 59.6472 31.8279 179.4982 83 G 3.6453 7.9626 104.1014 47.9180 0.0000 175.6499 84 T 3.8004 7.8380 117.3383 65.5763 68.5644 175.8085 85 F 4.7787 7.8858 116.9643 57.0312 39.3099 177.3799 86 A 4.0599 7.5334 122.3441 55.6776 18.1517 180.3714 87 T 3.8352 7.8964 113.5872 67.0022 68.5928 176.7831 88 L 4.1117 7.9866 120.1756 57.4710 41.6557 179.4140 89 S 4.2977 8.4566 113.8018 61.5655 62.3812 175.9894 90 E 3.8930 8.3321 121.3060 59.2841 29.1973 179.0725 91 L 3.9284 8.1535 120.4059 58.6762 42.1774 178.8894 92 H 4.2354 8.5236 116.0650 58.5518 28.7721 177.3914 93 C 3.5347 7.6777 120.7105 62.4057 31.1772 175.3886 94 D 4.4288 8.1775 119.6489 56.2924 40.5328 178.0109 95 K 4.2461 7.7226 116.7712 57.8001 33.5370 177.9175 96 L 4.1999 7.6231 116.9043 54.2531 42.6195 176.2170 97 H 4.1300 7.3515 113.5430 56.6809 26.5026 175.4123 98 V 3.6787 7.7997 118.8222 60.9218 32.1953 174.7456 99 D 4.2897 8.8161 127.2305 54.1610 41.4323 175.2367 100 P 3.0973 0.0000 0.0000 64.4371 31.2897 177.9299 101 E 3.9135 8.0854 118.3999 59.0904 29.3442 178.3776 102 N 4.3261 8.0175 116.7688 56.1313 38.4638 177.2570 103 F 4.4466 7.4081 119.3858 60.5764 38.9214 177.9408 104 R 3.9861 7.9353 117.3799 59.1060 29.9958 178.7967 105 L 3.8172 7.7709 118.6717 57.7134 41.5293 179.3389 106 L 4.1031 8.2946 120.5591 57.9800 41.9872 179.1149 107 G 3.7202 8.1367 105.7548 47.8575 0.0000 175.7607 108 K 4.0543 8.1223 121.0098 59.2254 32.0114 179.7014 109 V 3.6479 8.0077 118.5379 65.7768 31.4108 177.7626 110 L 3.8706 8.3097 120.6081 58.1763 41.9349 179.1329 111 V 3.5827 7.8886 118.1450 66.2009 31.3748 177.7359 112 C 4.1238 8.0444 116.3506 62.8753 27.8782 176.3424 113 V 3.5374 8.0179 120.0232 65.8362 31.0078 178.1032 114 L 3.8603 7.8951 118.6700 57.5462 41.3537 179.3206 115 A 3.7426 7.3743 120.6276 55.2571 18.0991 179.1308 116 H 4.0864 8.1427 115.9388 59.7150 30.0121 176.7219 117 H 3.9861 8.1773 119.0670 58.5527 29.8937 176.3853 118 F 4.5935 8.4616 117.7947 56.4587 39.8140 177.2005 119 G 3.8633 8.7725 108.9072 46.1802 0.0000 177.3512 120 K 4.0575 8.8246 121.9989 59.1476 32.5698 177.9871 121 E 4.0638 7.9497 120.2051 58.4940 29.9371 177.0635 122 F 4.6040 8.1320 123.4409 57.0136 37.8183 175.4334 123 T 4.1833 7.3827 115.5836 60.1819 71.3511 173.4739 124 P 4.1454 0.0000 0.0000 65.6632 31.4727 177.2698 125 P 4.2570 0.0000 0.0000 65.2697 31.1528 178.9273 126 V 3.5690 7.3066 116.1276 65.7487 31.4270 177.7902 127 Q 3.5436 7.7487 119.3131 59.0598 28.8940 178.1040 128 A 4.0422 8.0346 121.4582 55.1670 18.4132 179.5418 129 A 3.8951 7.9166 118.7889 55.6296 18.4438 179.5433 130 Y 3.8915 8.3779 115.4003 61.1969 37.8682 178.9120 131 Q 4.1444 8.8941 119.5848 58.8167 28.8174 178.7556 132 K 3.9601 7.9555 119.1503 59.4066 32.0637 179.6114 133 V 3.5079 7.6964 118.2397 66.1882 31.5324 178.6111 134 V 3.8373 8.3740 112.3564 64.3160 31.2399 178.4939 135 A 4.1435 8.2399 120.9625 54.9678 18.1189 179.8913 136 G 3.5128 8.1883 104.3347 47.9162 0.0000 176.1785 137 V 3.3648 7.9613 120.5911 65.4405 31.6686 177.8727 138 A 3.8785 8.0231 120.5149 55.3382 18.0209 179.2957 139 N 4.2876 8.1967 113.6153 56.4815 38.7050 177.1758 140 A 4.1573 8.2180 122.3313 55.2088 18.2871 179.6550 141 L 3.8337 7.8692 116.2073 56.8665 41.9846 178.5482 142 A 4.4387 7.7374 119.1588 53.2096 18.8229 178.5817 143 H 4.2854 7.9662 116.6989 58.4965 30.0090 175.8128 144 K 4.4407 8.0187 117.6353 56.2805 32.2115 176.4765 145 Y 4.1901 7.9907 117.6358 58.5291 38.4087 175.7917 146 H 4.4553 8.3956 117.2518 56.2055 28.2634 173.3244 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 M 8.30 4.30 0.00 2.21 2.02 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 2 H 8.79 4.46 0.00 3.21 3.17 0.00 5.72 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.77 4.94 0.00 1.53 1.51 0.79 0.90 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 4 T 9.45 4.11 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 1.26 0.00 0.00 5 P 0.00 4.17 0.00 2.15 2.14 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 6 E 8.05 3.98 0.00 2.03 1.97 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 2.39 2.44 0.00 7 E 8.19 3.89 0.00 2.17 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 2.29 2.28 0.00 8 K 8.23 3.87 0.00 1.73 1.74 0.00 1.56 0.00 0.00 1.51 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.34 7.81 9 S 8.03 4.06 0.00 4.01 4.01 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 10 A 7.97 4.03 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 11 V 7.70 3.43 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 0.65 0.00 0.00 0.47 0.00 0.00 12 T 7.98 3.98 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 13 A 7.96 4.00 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 14 L 7.92 3.92 0.00 1.97 1.98 -0.08 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.65 4.40 0.00 3.81 3.20 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 16 G 8.02 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 17 K 7.77 4.39 0.00 2.03 2.11 0.00 1.71 0.00 0.00 1.56 0.00 0.00 3.28 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.47 7.81 18 V 7.13 3.61 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 0.00 0.00 -0.00 0.00 0.00 0.74 0.00 0.00 19 N 8.32 4.49 0.00 2.70 2.58 0.00 0.00 6.84 7.71 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 20 V 8.13 3.45 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 1.17 0.00 0.00 0.96 0.00 0.00 21 D 7.98 4.33 0.00 2.87 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 22 E 8.09 3.83 0.00 1.95 1.95 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 2.26 2.28 0.00 23 V 7.95 3.62 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 0.95 0.00 0.00 0.66 0.00 0.00 24 G 8.33 3.66 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 0.00 0.00 0.00 25 G 7.98 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.06 3.89 0.00 2.13 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 2.25 2.32 0.00 27 A 8.23 3.92 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 28 L 7.93 4.00 0.00 1.77 1.63 0.88 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.12 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.05 3.89 0.00 1.83 1.92 0.00 3.09 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 31 L 7.86 4.01 0.00 1.88 1.90 0.99 0.79 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 32 L 7.78 4.03 0.00 1.84 1.67 0.71 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.22 3.60 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.94 0.00 0.00 34 V 8.13 3.56 1.53 0.00 0.00 0.00 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 0.73 0.00 0.00 35 Y 7.27 3.95 0.00 2.62 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 36 P 0.00 4.69 0.00 2.23 2.10 0.00 3.85 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.99 0.00 37 W 8.03 4.29 0.00 3.52 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.75 4.25 4.43 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 1.15 0.00 0.00 39 Q 8.35 4.34 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 40 R 7.57 3.82 0.00 1.68 1.94 0.00 2.98 0.00 0.00 2.59 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 7.08 4.45 0.00 1.88 2.38 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 42 F 7.84 4.62 0.00 2.78 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 0.00 0.00 0.00 43 E 8.47 4.06 0.00 1.96 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 2.26 2.21 0.00 44 S 8.08 4.64 0.00 4.10 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 45 F 8.44 4.56 0.00 3.19 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 46 G 8.11 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 0.00 0.00 0.00 0.00 47 D 8.59 4.55 0.00 2.65 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 48 L 8.35 4.84 0.00 1.66 1.62 1.04 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.05 4.29 0.00 4.04 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.41 4.74 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.11 0.00 3.59 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 2.09 2.15 0.00 52 D 8.13 4.36 0.00 2.75 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 53 A 7.53 3.98 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.13 3.69 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 1.01 0.00 0.00 0.99 0.00 0.00 55 M 8.40 4.26 0.00 1.96 2.09 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 2.60 2.90 0.00 56 G 7.41 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.65 4.42 0.00 3.00 2.82 0.00 0.00 6.90 7.75 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 58 P 0.00 4.26 0.00 2.24 2.26 0.00 3.72 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 59 K 8.36 3.72 0.00 1.66 0.74 0.00 1.33 0.00 0.00 1.25 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.15 1.25 7.81 60 V 7.86 3.71 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 1.00 0.00 0.00 1.02 0.00 0.00 61 K 8.19 3.91 0.00 1.99 1.76 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.43 7.81 62 A 8.13 3.97 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 63 H 8.46 4.35 0.00 3.62 3.50 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 64 G 8.26 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 65 K 7.97 3.95 0.00 1.88 2.03 0.00 2.12 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.56 7.81 66 K 7.91 3.97 0.00 1.94 1.95 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.49 1.50 7.81 67 V 8.08 3.60 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 0.99 0.00 0.00 0.94 0.00 0.00 68 L 8.45 4.37 0.00 2.00 1.80 0.78 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.48 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 70 A 7.93 4.15 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 71 F 8.63 4.34 0.00 3.19 3.35 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 72 S 8.86 4.15 0.00 4.56 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.38 4.55 0.00 2.71 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 74 G 7.88 3.50 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 0.00 75 L 7.19 3.78 0.00 1.45 1.40 -0.49 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.30 4.26 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.06 4.88 0.00 3.05 3.12 0.00 5.83 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 78 L 8.04 3.89 0.00 1.53 1.64 0.80 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.88 4.70 0.00 2.60 2.67 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 80 N 8.20 5.00 0.00 2.71 2.58 0.00 0.00 7.15 6.19 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 81 L 7.92 4.03 0.00 1.75 1.82 0.86 0.84 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 82 K 8.12 4.04 0.00 1.73 1.77 0.00 1.54 0.00 0.00 1.38 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.44 7.81 83 G 7.96 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 T 7.84 3.80 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 0.45 0.00 0.00 85 F 7.89 4.78 0.00 3.14 2.90 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 0.00 0.00 0.00 86 A 7.53 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 87 T 7.90 3.84 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 1.23 0.00 0.00 88 L 7.99 4.11 0.00 2.01 1.86 1.12 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.46 4.30 0.00 4.03 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 90 E 8.33 3.89 0.00 2.19 1.97 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 2.34 2.56 0.00 91 L 8.15 3.93 0.00 1.84 1.90 0.91 0.96 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 92 H 8.52 4.24 0.00 3.60 3.74 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.68 3.53 0.00 1.23 2.32 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 94 D 8.18 4.43 0.00 2.74 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 95 K 7.72 4.25 0.00 1.81 1.78 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.42 7.81 96 L 7.62 4.20 0.00 1.70 1.61 0.69 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.35 4.13 0.00 3.50 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.80 3.68 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 0.09 0.00 0.00 0.41 0.00 0.00 99 D 8.82 4.29 0.00 2.86 2.61 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 0.00 100 P 0.00 3.10 0.00 1.89 1.78 0.00 3.36 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.44 0.00 101 E 8.09 3.91 0.00 2.05 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 2.40 0.00 102 N 8.02 4.33 0.00 2.48 2.73 0.00 0.00 6.87 7.65 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 0.00 103 F 7.41 4.45 0.00 3.09 2.90 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 0.00 0.00 0.00 104 R 7.94 3.99 0.00 2.01 1.97 0.00 3.27 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 105 L 7.77 3.82 0.00 1.74 1.38 0.75 -0.09 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 0.00 106 L 8.29 4.10 0.00 1.88 1.88 0.94 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.14 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 0.00 108 K 8.12 4.05 0.00 2.06 1.97 0.00 1.70 0.00 0.00 1.54 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.48 7.81 109 V 8.01 3.65 2.24 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 1.14 0.00 0.00 1.15 0.00 0.00 110 L 8.31 3.87 0.00 1.77 1.78 0.89 0.24 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 0.00 111 V 7.89 3.58 2.32 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 1.28 0.00 0.00 1.16 0.00 0.00 112 C 8.04 4.12 0.00 3.21 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.02 3.54 2.13 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 1.03 0.00 0.00 0.93 0.00 0.00 114 L 7.90 3.86 0.00 0.89 1.05 0.59 0.65 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 0.00 115 A 7.37 3.74 1.39 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 0.00 116 H 8.14 4.09 0.00 3.16 3.43 0.00 5.78 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.18 3.99 0.00 2.90 2.92 0.00 5.98 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 0.00 118 F 8.46 4.59 0.00 3.24 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 0.00 119 G 8.77 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 0.00 0.00 0.00 120 K 8.82 4.06 0.00 1.92 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.48 7.81 121 E 7.95 4.06 0.00 2.01 2.29 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 2.34 2.29 0.00 122 F 8.13 4.60 0.00 3.00 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 0.00 123 T 7.38 4.18 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 1.30 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.14 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.26 0.00 2.12 2.07 0.00 3.48 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 2.08 2.11 0.00 126 V 7.31 3.57 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 1.07 0.00 0.00 0.90 0.00 0.00 127 Q 7.75 3.54 0.00 1.63 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 128 A 8.03 4.04 1.39 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 0.00 129 A 7.92 3.90 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 0.00 130 Y 8.38 3.89 0.00 3.41 3.30 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 0.00 131 Q 8.89 4.14 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.73 2.62 0.00 132 K 7.96 3.96 0.00 1.94 1.84 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.65 7.81 133 V 7.70 3.51 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 0.85 0.00 0.00 0.73 0.00 0.00 134 V 8.37 3.84 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 1.01 0.00 0.00 1.13 0.00 0.00 135 A 8.24 4.14 1.39 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 0.00 136 G 8.19 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 0.00 0.00 0.00 137 V 7.96 3.36 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.74 0.00 0.00 138 A 8.02 3.88 1.45 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 0.00 139 N 8.20 4.29 0.00 2.90 2.91 0.00 0.00 7.06 8.18 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 0.00 140 A 8.22 4.16 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 0.00 141 L 7.87 3.83 0.00 0.90 0.49 -0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.74 4.44 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 0.00 143 H 7.97 4.29 0.00 3.36 3.52 0.00 5.75 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.02 4.44 0.00 1.87 1.85 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.76 7.81 145 Y 7.99 4.19 0.00 3.11 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 0.00 146 H 8.40 4.46 0.00 3.22 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00