NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.3407 8.1801 120.6350 54.9884 42.8512 176.3402 23 A 4.4743 8.4823 122.6994 49.1625 21.4108 173.3941 24 D 4.9173 8.2665 118.3739 51.4208 44.7176 174.4348 25 S 4.2030 9.2740 115.4024 61.5900 62.6429 177.1083 26 K 3.9519 8.0652 120.5708 59.3843 31.8988 178.9546 27 A 4.0328 8.4334 121.2385 55.2858 18.2653 180.1365 28 V 3.7488 8.0788 117.6114 64.6482 31.5326 178.6351 29 L 4.1383 8.4082 120.1237 57.8491 41.5369 178.9421 30 N 4.2337 8.2923 116.9463 56.5859 38.7121 176.5731 31 Q 4.2517 8.4302 120.8713 59.2858 29.1782 178.2355 32 A 4.2218 8.5707 122.0122 55.1017 18.4759 179.5565 33 V 3.5437 8.0739 116.5960 66.2117 31.6263 178.0032 34 A 4.2215 8.4308 120.1628 55.5265 18.2070 179.3905 35 D 4.3683 8.5059 117.4072 57.6306 40.9113 179.0354 36 L 3.8549 8.6475 119.8045 57.9070 41.6531 179.8594 37 S 3.8637 7.9667 115.1507 61.4283 62.6263 176.9536 38 V 3.5878 7.8658 120.7112 65.8547 31.3081 177.6568 39 A 4.0271 8.9117 121.8288 55.7029 18.1748 179.1222 40 H 4.0624 8.4925 116.5976 59.3547 29.9310 177.3894 41 S 4.1222 7.9890 114.4583 61.4995 62.1504 176.2384 42 I 3.6834 7.8800 122.3991 64.4485 36.7913 178.4128 43 L 3.9294 8.0081 119.8114 58.0669 41.3718 179.1560 44 H 3.6908 8.0905 118.2155 58.8018 29.5671 177.0859 45 Q 4.2358 8.0780 121.5581 59.3073 28.7110 178.5071 46 V 3.6396 8.0685 119.5179 66.1711 31.3173 177.4262 47 H 4.1819 8.1631 117.1617 59.1930 29.7824 177.0567 48 W 4.7003 8.2159 119.4585 59.7213 29.0234 177.4693 49 Y 4.3571 8.6077 114.7513 57.1863 37.7378 175.2686 50 M 4.4561 7.6170 121.1655 55.8481 32.9142 175.5705 51 R 4.7067 9.1078 123.6190 54.8570 34.5277 173.7852 52 G 4.3657 8.8846 105.5367 42.6644 0.0000 173.2964 53 R 4.1764 8.2282 120.0580 57.6182 30.3914 177.3592 54 G 4.2764 9.5154 110.6402 45.5928 0.0000 175.0732 55 F 4.0947 8.7737 122.2290 62.0434 39.0134 176.9115 56 M 4.2063 8.2923 115.3484 58.4558 32.1577 177.8524 57 I 3.6713 7.5580 119.5725 63.9564 37.5964 177.9718 58 W 4.1735 8.2419 119.4940 58.9268 28.7773 178.4318 59 H 3.8976 8.0356 118.5995 58.6675 29.4881 175.3811 60 P 4.2585 0.0000 0.0000 65.3316 31.2840 178.0815 61 K 3.5703 7.5343 119.8316 59.4729 31.8265 178.4419 62 M 4.0129 7.8488 118.9742 58.4503 31.8500 178.2898 63 D 4.1623 7.6013 118.5274 57.4378 41.1100 178.8234 64 E 3.9176 7.7555 118.3915 59.5798 29.4366 178.8766 65 Y 4.4789 7.7837 116.7597 61.5402 37.9752 178.5546 66 M 4.0709 8.4499 120.0055 58.1908 31.9065 178.4249 67 E 3.8893 8.2739 119.6498 59.1097 29.8028 178.5854 68 E 3.6274 8.0499 118.9465 59.1818 29.6760 178.7195 69 I 3.7729 7.8758 120.0112 64.7010 37.1761 178.2072 70 D 4.4164 8.3011 119.7255 57.0632 40.5847 178.9470 71 G 3.5320 8.1196 106.5675 48.1413 0.0000 175.3399 72 Y 4.4965 7.4824 119.3075 60.5434 37.7704 178.3523 73 L 4.0760 8.2121 121.4654 58.1957 42.1734 178.6003 74 D 4.2899 8.2405 118.2372 57.3898 41.1605 178.0472 75 E 4.1213 8.2718 118.0901 59.5401 29.6315 178.9901 76 M 3.8711 8.3771 120.2566 57.9743 31.9018 178.5562 77 S 4.0607 8.3302 113.6098 61.3495 62.5626 175.8326 78 E 3.9166 8.2942 121.4385 59.5935 29.1831 179.2859 79 R 3.7955 8.1158 118.6588 59.3933 29.9977 178.1023 80 L 3.8968 7.8538 119.9127 58.2456 42.0419 178.9506 81 I 3.6692 7.9057 119.8576 64.8705 36.8584 178.4899 82 T 3.8740 8.2886 115.4110 66.5402 68.3818 175.9313 83 L 4.3048 7.8947 118.4416 55.1814 41.8502 177.6938 84 G 3.9732 8.0923 108.0096 45.2021 0.0000 173.9384 85 G 3.8640 7.9676 109.3818 43.8198 0.0000 173.8718 86 A 4.4399 7.9445 121.2528 49.2737 19.7898 174.0778 87 P 4.4462 0.0000 0.0000 62.7902 32.2758 176.9724 88 F 4.6776 8.1672 119.9380 59.0287 39.2847 176.6510 89 S 4.7790 8.4857 117.6563 57.2036 63.7501 174.7815 90 T 4.4784 6.7577 109.9641 59.6865 72.9137 173.8468 91 L 4.0162 8.1677 122.1957 57.7612 41.7563 179.3746 92 K 3.7647 7.9961 119.1274 59.8176 32.0023 178.3626 93 E 3.6761 7.6594 118.0453 59.1806 29.3292 179.2391 94 F 4.4255 7.6620 117.7370 60.7675 38.8260 177.6170 95 S 4.1198 8.2150 111.4208 61.6985 62.3344 175.8554 96 E 4.0857 8.0620 119.6967 59.0056 29.2751 178.4473 97 N 4.4540 7.8582 115.4450 54.1477 39.2109 175.8806 98 S 4.4582 7.5566 114.7858 58.4132 62.9330 173.7770 99 Q 4.2866 8.6553 124.5856 56.0350 28.9769 176.1407 100 L 4.0519 7.3974 119.0263 53.8536 42.5063 176.2644 101 K 4.5469 8.2366 121.4021 54.6585 34.1166 175.5466 102 E 4.6695 8.5132 121.8201 54.6164 31.6812 175.8051 103 V 4.4779 7.8355 114.9357 58.7801 34.9042 175.5707 104 L 3.9485 8.3618 121.3967 54.8021 41.9733 177.9154 105 G 2.3875 8.0692 111.0597 45.4157 0.0000 172.7668 106 D 4.3883 7.3668 121.3189 52.5416 43.3216 175.6248 107 Y 4.8732 8.6543 124.4220 60.2229 38.1344 176.9535 108 N 4.6242 8.6198 116.1699 54.3331 39.0838 175.8413 109 V 3.7756 7.1775 117.8702 63.0121 32.1498 176.4371 110 T 4.2620 8.9712 117.9123 61.1917 70.7839 175.7692 111 I 3.6849 8.3054 122.6215 64.9094 37.0710 178.5318 112 E 3.8296 8.0788 118.6375 59.3739 29.3301 179.1524 113 E 3.9064 8.2433 118.7107 59.3028 29.5003 179.3201 114 Q 3.9486 8.3907 118.5363 58.9437 28.7288 178.9431 115 L 3.6472 7.9920 119.9374 57.6615 41.6263 179.3754 116 A 3.8544 8.0536 120.8901 55.0978 18.1521 179.6941 117 R 3.7450 7.8724 117.1970 59.4237 30.1178 178.8565 118 V 3.2117 7.5625 118.0477 65.8389 31.3613 177.9853 119 V 3.4408 7.6295 117.9815 66.0857 31.2810 177.8287 120 E 3.9372 8.1301 118.0860 59.3532 29.2670 179.4310 121 V 3.6360 7.8760 118.3290 66.2630 31.6262 178.1372 122 F 4.4269 8.6130 117.8701 60.6299 38.6935 177.9184 123 R 3.9666 8.5167 118.2477 59.2698 29.8418 178.4007 124 Y 3.9241 8.0436 119.2933 60.7612 38.7812 178.2388 125 L 3.4268 8.1572 119.7156 57.2905 41.5188 179.2888 126 A 3.7791 8.1965 120.8837 55.0383 18.3459 179.5429 127 A 3.7411 7.7298 119.1341 55.0510 18.3439 179.3769 128 L 3.6131 7.5196 119.1983 58.5118 42.0458 179.4085 129 F 4.4225 8.0634 117.8743 60.4853 38.6949 177.5000 130 Q 3.9564 8.3196 119.6662 58.9728 28.7353 178.2256 131 K 3.9550 8.1089 120.8687 59.2516 32.2177 179.0959 132 G 2.1304 7.7307 106.3032 47.1124 0.0000 175.1817 133 F 4.0513 8.3247 123.8227 61.1933 39.3479 177.0192 134 D 4.3841 8.4551 118.4927 57.4401 40.6933 179.0020 135 V 3.5735 7.9668 119.2635 65.9990 31.5064 178.2516 136 S 4.4783 8.0550 115.4194 60.7020 62.9529 175.8733 137 D 4.0777 8.0439 121.8892 57.1138 40.7208 177.8822 138 E 3.9264 7.8621 118.4167 59.2525 30.0259 178.0484 139 E 4.2272 8.4051 117.0808 56.3483 29.3896 177.7014 140 G 3.7483 7.6886 106.9635 47.0348 0.0000 175.0979 141 D 4.6302 8.0575 121.8645 52.6104 38.9400 176.1321 142 S 4.0754 7.9628 119.4443 60.4404 63.5444 176.7356 143 V 3.4742 7.6290 121.7009 66.2705 31.4432 177.8415 144 T 3.7180 7.8302 115.0753 66.5650 68.3044 175.7606 145 N 4.5058 8.1606 120.3166 56.1542 38.7419 176.2171 146 D 4.3503 8.0268 118.9890 57.3906 41.4481 178.1705 147 I 3.5410 7.4378 119.7375 64.5807 37.1107 178.5458 148 F 3.9761 7.9992 118.4083 60.2096 38.5700 177.4291 149 N 4.3890 8.2409 117.0022 56.5532 38.7106 177.1124 150 V 3.5372 8.0406 119.7002 65.9668 31.6370 177.8357 151 A 3.4676 7.4354 121.3055 54.1510 17.9247 179.4249 152 K 3.9720 8.1092 117.8993 59.6150 32.3846 178.4023 153 A 3.9723 8.1014 121.2609 55.6544 18.1751 179.6850 154 S 4.0652 7.9103 110.9797 61.4705 62.4224 176.2405 155 I 3.4985 7.8171 122.5705 64.4608 36.8181 178.2709 156 E 4.0108 8.4564 119.5207 59.1046 29.2529 179.1984 157 K 4.2430 8.0725 119.5200 60.1353 32.2997 178.4343 158 H 4.4038 8.4306 116.4988 59.0885 28.6266 177.8023 159 I 3.8332 8.2555 121.8714 64.0625 36.9262 178.1067 160 W 4.4025 8.4770 129.1647 61.0073 30.4744 177.9897 161 M 3.3284 7.8010 118.3807 58.0138 31.3263 178.7428 162 L 3.9793 8.4056 119.5610 57.9110 41.8178 179.6470 163 Q 3.9371 8.2296 117.6568 58.8186 28.6122 178.4360 164 A 4.0259 8.3280 122.2431 55.4195 18.1643 179.1368 165 E 3.9611 8.1777 116.4164 59.4071 29.7545 178.2125 166 L 4.3814 7.6003 115.8160 54.2920 41.7598 177.2375 167 G 3.9234 8.1104 107.0060 46.2772 0.0000 173.5830 168 Q 4.6693 8.1959 116.9205 53.0357 32.1694 175.4893 169 A 4.3481 8.3216 122.2562 51.5636 19.1090 176.3666 170 P 4.3888 0.0000 0.0000 63.8615 31.9567 177.2567 171 K 3.8329 8.1100 115.5065 57.2097 29.5012 174.9247 172 L 4.1790 7.8562 121.4639 55.2341 41.4867 177.7779 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 22 L 8.18 4.34 0.00 1.67 1.72 0.97 0.55 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 23 A 8.48 4.47 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.27 4.92 0.00 3.18 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 S 9.27 4.20 0.00 3.89 4.02 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 26 K 8.07 3.95 0.00 1.94 1.84 0.00 1.65 0.00 0.00 1.96 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.51 7.81 27 A 8.43 4.03 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.08 3.75 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 0.92 0.00 0.00 0.79 0.00 0.00 29 L 8.41 4.14 0.00 1.89 1.77 0.95 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.29 4.23 0.00 2.72 2.56 0.00 0.00 6.90 6.47 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 31 Q 8.43 4.25 0.00 2.38 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.49 2.77 0.00 32 A 8.57 4.22 1.73 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 33 V 8.07 3.54 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 1.28 0.00 0.00 1.00 0.00 0.00 34 A 8.43 4.22 1.64 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 35 D 8.51 4.37 0.00 2.97 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 36 L 8.65 3.85 0.00 1.80 1.82 1.23 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.97 3.86 0.00 3.52 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.87 3.59 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 0.99 0.00 0.00 0.97 0.00 0.00 39 A 8.91 4.03 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.49 4.06 0.00 3.25 3.49 0.00 5.79 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.99 4.12 0.00 4.02 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 42 I 7.88 3.68 1.97 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.59 0.86 0.00 0.00 43 L 8.01 3.93 0.00 1.77 1.67 1.09 0.94 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 44 H 8.09 3.69 0.00 3.00 2.62 0.00 5.59 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.08 4.24 0.00 2.22 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 46 V 8.07 3.64 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 0.95 0.00 0.00 0.97 0.00 0.00 47 H 8.16 4.18 0.00 3.05 3.24 0.00 6.00 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 48 W 8.22 4.70 0.00 3.65 2.88 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 49 Y 8.61 4.36 0.00 3.21 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 50 M 7.62 4.46 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.91 0.00 51 R 9.11 4.71 0.00 1.87 1.78 0.00 3.31 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.80 0.00 52 G 8.88 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 0.00 0.00 0.00 0.00 53 R 8.23 4.18 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 54 G 9.52 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 0.00 0.00 0.00 0.00 55 F 8.77 4.09 0.00 3.38 3.14 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 56 M 8.29 4.21 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.74 0.00 57 I 7.56 3.67 1.66 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.39 -0.06 0.00 0.00 58 W 8.24 4.17 0.00 3.46 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 59 H 8.04 3.90 0.00 1.65 2.52 0.00 5.95 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.26 0.00 2.17 2.22 0.00 3.59 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.96 0.00 61 K 7.53 3.57 0.00 1.43 1.76 0.00 1.09 0.00 0.00 1.06 0.00 0.00 2.61 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.01 0.59 7.81 62 M 7.85 4.01 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.98 0.00 63 D 7.60 4.16 0.00 2.78 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 64 E 7.76 3.92 0.00 1.89 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 2.30 2.23 0.00 65 Y 7.78 4.48 0.00 3.23 3.16 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 66 M 8.45 4.07 0.00 1.86 2.01 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.36 0.00 67 E 8.27 3.89 0.00 2.00 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 2.24 2.27 0.00 68 E 8.05 3.63 0.00 2.08 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 1.75 2.00 0.00 69 I 7.88 3.77 2.09 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 1.68 0.47 1.00 0.00 0.00 70 D 8.30 4.42 0.00 2.89 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 71 G 8.12 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 7.48 4.50 0.00 3.22 2.84 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 73 L 8.21 4.08 0.00 1.78 1.95 0.89 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.24 4.29 0.00 2.87 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 75 E 8.27 4.12 0.00 2.20 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 2.58 2.26 0.00 76 M 8.38 3.87 0.00 1.95 2.19 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.00 0.00 77 S 8.33 4.06 0.00 4.00 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 78 E 8.29 3.92 0.00 2.22 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 2.32 2.53 0.00 79 R 8.12 3.80 0.00 1.91 1.98 0.00 3.10 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 80 L 7.85 3.90 0.00 1.88 1.88 0.94 0.95 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 81 I 7.91 3.67 2.03 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 1.51 0.60 0.90 0.00 0.00 82 T 8.29 3.87 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 83 L 7.89 4.30 0.00 1.73 1.69 0.96 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.09 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.97 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 86 A 7.94 4.44 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 87 P 0.00 4.45 0.00 2.26 2.06 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 88 F 8.17 4.68 0.00 3.38 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 89 S 8.49 4.78 0.00 4.03 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 T 6.76 4.48 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 1.14 0.00 0.00 91 L 8.17 4.02 0.00 1.71 1.83 1.00 1.04 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 92 K 8.00 3.76 0.00 1.76 1.73 0.00 1.68 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.51 7.81 93 E 7.66 3.68 0.00 1.84 1.56 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 2.24 2.24 0.00 94 F 7.66 4.43 0.00 3.25 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 95 S 8.22 4.12 0.00 3.94 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 E 8.06 4.09 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 2.30 2.30 0.00 97 N 7.86 4.45 0.00 2.36 2.76 0.00 0.00 6.97 6.85 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 98 S 7.56 4.46 0.00 4.10 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 99 Q 8.66 4.29 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.60 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 100 L 7.40 4.05 0.00 1.52 1.44 0.95 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.24 4.55 0.00 1.66 1.66 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.35 7.81 102 E 8.51 4.67 0.00 1.91 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 2.20 2.28 0.00 103 V 7.84 4.48 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.36 3.95 0.00 1.55 1.52 0.90 0.87 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 0.00 105 G 8.07 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 0.00 0.00 0.00 106 D 7.37 4.39 0.00 2.48 2.37 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 0.00 107 Y 8.65 4.87 0.00 3.12 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.62 4.62 0.00 2.89 2.91 0.00 0.00 6.91 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.18 3.78 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 0.81 0.00 0.00 0.96 0.00 0.00 110 T 8.97 4.26 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 111 I 8.31 3.68 1.88 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.10 0.85 0.00 0.00 112 E 8.08 3.83 0.00 1.97 1.93 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 2.32 2.35 0.00 113 E 8.24 3.91 0.00 2.16 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 2.30 2.32 0.00 114 Q 8.39 3.95 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 115 L 7.99 3.65 0.00 1.63 1.34 0.21 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.05 3.85 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 0.00 117 R 7.87 3.75 0.00 1.87 2.05 0.00 3.08 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 118 V 7.56 3.21 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 119 V 7.63 3.44 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 1.05 0.00 0.00 0.85 0.00 0.00 120 E 8.13 3.94 0.00 2.20 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 2.47 0.00 121 V 7.88 3.64 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 1.26 0.00 0.00 0.95 0.00 0.00 122 F 8.61 4.43 0.00 3.09 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 0.00 123 R 8.52 3.97 0.00 2.03 1.99 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.91 0.00 124 Y 8.04 3.92 0.00 3.13 3.16 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 0.00 125 L 8.16 3.43 0.00 1.56 0.82 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.20 3.78 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 0.00 127 A 7.73 3.74 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 0.00 128 L 7.52 3.61 0.00 1.06 1.31 0.91 1.15 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 0.00 129 F 8.06 4.42 0.00 3.11 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 0.00 130 Q 8.32 3.96 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 131 K 8.11 3.95 0.00 1.93 1.70 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.53 7.81 132 G 7.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 F 8.32 4.05 0.00 3.20 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 0.00 134 D 8.46 4.38 0.00 2.91 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 0.00 135 V 7.97 3.57 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 1.08 0.00 0.00 0.91 0.00 0.00 136 S 8.05 4.48 0.00 4.29 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 D 8.04 4.08 0.00 2.45 2.54 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 0.00 138 E 7.86 3.93 0.00 2.16 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 2.30 2.34 0.00 139 E 8.41 4.23 0.00 2.05 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 2.29 2.53 0.00 140 G 7.69 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.06 4.63 0.00 2.74 2.54 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 0.00 142 S 7.96 4.08 0.00 4.04 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 V 7.63 3.47 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.83 3.72 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 0.00 145 N 8.16 4.51 0.00 2.69 2.91 0.00 0.00 6.39 8.02 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 0.00 146 D 8.03 4.35 0.00 2.99 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 7.44 3.54 1.69 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.98 0.48 0.00 0.00 148 F 8.00 3.98 0.00 3.31 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 0.00 149 N 8.24 4.39 0.00 3.32 3.01 0.00 0.00 6.75 7.73 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 0.00 150 V 8.04 3.54 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 1.00 0.00 0.00 1.04 0.00 0.00 151 A 7.44 3.47 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 K 8.11 3.97 0.00 2.12 1.98 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.70 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.50 7.81 153 A 8.10 3.97 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 0.00 154 S 7.91 4.07 0.00 3.93 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 0.00 155 I 7.82 3.50 1.84 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.70 0.72 0.00 0.00 156 E 8.46 4.01 0.00 2.15 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 2.33 2.55 0.00 157 K 8.07 4.24 0.00 2.08 2.06 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.22 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.69 1.94 7.81 158 H 8.43 4.40 0.00 3.43 3.45 0.00 5.68 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 0.00 159 I 8.26 3.83 2.18 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 1.56 1.23 1.00 0.00 0.00 160 W 8.48 4.40 0.00 3.44 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 0.00 161 M 7.80 3.33 0.00 1.91 2.03 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 0.97 0.00 162 L 8.41 3.98 0.00 1.68 1.58 0.73 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.23 3.94 0.00 2.39 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.51 2.75 0.00 164 A 8.33 4.03 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 0.00 165 E 8.18 3.96 0.00 2.19 2.22 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 2.28 2.42 0.00 166 L 7.60 4.38 0.00 1.76 1.63 0.79 0.92 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 0.00 167 G 8.11 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 Q 8.20 4.67 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 169 A 8.32 4.35 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 0.00 170 P 0.00 4.39 0.00 2.14 2.31 0.00 3.90 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.42 0.00 171 K 8.11 3.83 0.00 1.89 1.86 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.20 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.57 7.81 172 L 7.86 4.18 0.00 1.63 1.58 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00