NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5209 8.3044 120.2867 55.2756 33.8879 174.2164 3 V 4.1127 8.0581 121.5007 59.5562 32.8482 173.3620 4 W 4.4476 9.0937 135.0000 57.5558 31.9954 174.6757 5 T 4.0678 8.1003 122.0162 61.2656 67.2130 172.4180 6 P 4.5788 0.0000 0.0000 63.0479 32.1597 175.5375 7 V 4.1251 7.3650 119.5086 62.7476 33.0144 175.2886 8 N 4.1756 8.5896 124.9274 54.9519 36.2087 173.5106 9 N 5.0592 7.5739 109.1840 52.9077 39.9863 174.1984 10 K 4.1685 8.3640 116.7454 56.5539 32.9286 176.6578 11 M 5.0508 8.3433 120.5321 53.8839 35.2808 175.1165 12 F 4.5766 8.2613 116.5297 57.4051 41.4313 177.1671 13 E 3.6128 8.4163 121.1398 57.2295 27.1719 175.8072 14 T 3.8349 8.3554 123.8784 66.3569 68.8558 174.2305 15 F 4.5528 9.0337 124.4082 57.5261 36.5648 176.3974 16 S 4.4660 8.1175 114.8789 60.4827 63.0693 174.5170 17 Y 4.4228 8.3392 117.3164 58.1209 38.0504 174.9338 18 L 4.7479 7.5831 120.0820 51.9900 43.8469 174.4884 19 P 4.3936 0.0000 0.0000 62.1232 31.7560 175.0235 20 P 4.3515 0.0000 0.0000 62.6681 31.8321 176.3730 21 L 3.9976 8.2863 122.3855 54.6853 42.1634 178.0169 22 T 4.2504 8.1749 114.1705 61.1649 71.1376 175.3702 23 D 4.3195 8.4519 120.3420 57.4150 40.8005 178.5525 24 E 3.9150 8.1294 119.4209 59.3518 29.6486 178.8057 25 Q 3.9417 7.9586 118.1382 58.7082 28.7486 178.5023 26 I 3.6983 8.0226 120.8947 64.3098 37.1186 178.1175 27 A 4.0125 8.3315 121.6679 55.2729 18.2928 179.4242 28 A 3.9721 8.0470 119.0377 55.5710 18.4281 179.9090 29 Q 4.1065 8.0896 116.4553 59.0712 28.8069 179.1784 30 V 3.7198 8.2056 119.3828 66.2436 31.5249 177.6481 31 D 4.4476 8.5759 119.0277 57.6632 40.5072 178.3820 32 Y 4.1627 8.0574 119.5934 60.7022 38.9099 177.9543 33 I 3.9683 8.0031 120.7967 64.5484 37.2579 178.6236 34 V 3.5019 7.9021 118.5614 66.0454 31.2252 177.9042 35 A 3.8899 7.9756 119.2937 54.6980 18.2265 178.3758 36 N 4.0506 7.1251 112.6144 52.3429 38.6948 175.8597 37 G 3.7430 7.4516 108.3892 45.9396 0.0000 173.9649 38 W 4.9533 7.4312 118.6640 56.0337 30.6508 176.2875 39 I 4.3700 8.9343 123.3736 59.5735 37.8453 174.0509 40 P 4.8926 0.0000 0.0000 62.9308 32.8346 175.1815 41 C 4.9628 8.6307 120.9429 58.4978 35.6824 172.4508 42 L 5.2630 8.7436 124.6625 53.2545 44.2450 175.1711 43 E 5.5725 9.1467 121.2808 54.8464 34.0124 174.6394 44 F 5.7075 9.0399 116.4358 55.8512 42.1607 173.0273 45 A 4.5454 8.3472 120.0270 50.2128 22.6433 176.1860 46 E 4.2523 8.6828 118.6048 55.7149 31.0914 177.6512 47 A 4.2652 8.9628 123.9178 55.9413 18.3447 179.9386 48 D 4.5418 8.1924 112.8660 56.4869 40.9810 177.3218 49 K 4.5684 8.0438 116.9884 56.0075 32.7111 176.9850 50 A 3.7326 7.8058 123.5346 54.4380 18.5595 178.1151 51 Y 4.5990 7.4583 111.6293 55.7820 39.7172 175.6979 52 V 3.8143 8.3805 122.5153 63.9137 32.0887 175.3592 53 S 4.7330 8.8102 119.5341 57.5897 65.9982 173.7605 54 N 5.2613 8.6004 114.9300 52.2517 40.1398 175.9745 55 E 3.9829 8.3545 118.9460 59.8030 29.3419 179.1675 56 S 4.0473 8.9277 115.6500 60.6449 62.8729 176.0857 57 A 2.5800 7.6100 123.4538 53.8748 17.7095 179.0728 58 I 3.5490 6.8807 116.0844 63.9703 38.0075 177.2912 59 R 4.2067 7.5540 116.5176 56.1103 30.4961 176.5403 60 F 4.9946 7.0593 117.9173 56.2268 40.9814 177.6117 61 G 4.0406 8.2880 116.8073 46.3114 0.0000 176.4767 62 S 4.6361 8.4133 114.5112 57.5876 61.4728 174.2644 63 V 4.4880 7.1779 108.6900 61.0805 33.6364 177.5110 64 S 4.4793 8.2611 115.5105 59.8120 63.5246 173.4119 65 C 4.0510 8.1268 118.9620 61.5029 27.9114 173.1505 66 L 3.6415 8.4246 123.6423 55.6535 39.0132 173.2610 67 Y 4.4355 7.7883 119.3026 55.9526 40.0753 174.5123 68 Y 4.8403 7.1695 123.1878 56.2816 42.3348 174.6990 69 D 4.5050 8.8219 123.0204 55.1608 41.7999 176.8541 70 N 4.3204 8.8837 116.5890 54.3456 36.0613 176.0122 71 R 3.9623 7.9804 119.0951 59.3233 30.3451 177.2336 72 Y 4.3913 7.6623 114.7358 57.8967 38.4176 175.2249 73 W 5.0542 8.6441 124.3287 55.5750 32.5050 174.5681 74 T 4.3155 8.0992 117.2443 62.4614 69.4829 174.6424 75 M 4.5766 8.5490 126.8889 55.4125 33.1210 175.2471 76 W 4.7807 9.6731 135.0000 56.5705 31.3302 177.1310 77 K 3.4776 8.6046 129.0760 57.4163 30.7570 178.4850 78 L 4.9303 8.3840 123.6045 52.6781 45.3524 174.0198 79 P 4.3728 0.0000 0.0000 63.3703 32.3198 177.4811 80 M 4.2926 8.6596 122.9033 53.6592 30.4294 175.6584 81 F 4.4618 7.3411 118.5139 58.8491 40.0007 176.3096 82 G 3.9393 9.1019 112.4888 45.8226 0.0000 172.6177 83 C 4.3680 7.8825 120.2221 58.9923 31.7646 173.3093 84 R 4.4980 8.6050 123.7416 55.6040 31.3198 174.4175 85 D 4.7846 7.8258 119.0976 51.9800 41.8845 175.0302 86 P 4.3374 0.0000 0.0000 65.9064 31.3610 178.5590 87 M 4.1412 8.2331 117.1449 58.2317 31.8470 178.3840 88 Q 4.0097 7.9606 120.0367 58.9628 29.2247 178.3494 89 V 3.6223 7.7393 118.8751 66.0779 31.7617 177.8557 90 L 4.0378 7.9471 118.7250 57.9293 41.4280 179.7935 91 R 3.9965 8.1985 118.0235 59.1638 29.8947 178.8992 92 E 4.1654 8.1067 118.1140 59.0234 29.5153 179.1655 93 I 3.5214 7.8227 120.0935 64.2612 37.1939 178.4309 94 V 3.4662 7.6275 118.5106 66.0130 31.4594 177.8657 95 A 3.9354 7.9535 120.3555 55.2312 18.2531 179.1791 96 C 2.0000 7.6520 117.6778 62.0103 31.3112 175.9743 97 T 3.7576 7.5480 111.3285 64.3598 68.0510 176.5042 98 K 3.8006 7.7340 121.6452 59.3319 32.3193 178.4296 99 A 3.9752 7.4879 119.6726 53.4042 19.6815 177.6316 100 F 4.7516 7.6303 115.9441 55.0226 38.9427 174.0656 101 P 4.4501 0.0000 0.0000 64.2624 31.9036 177.9465 102 D 4.6627 8.0794 116.7063 53.8775 41.1200 175.4668 103 A 4.7977 7.2473 121.2660 50.4206 21.3301 177.0879 104 Y 4.2121 8.6114 117.9892 57.8420 39.4474 175.2524 105 V 5.1835 8.9353 123.4178 61.1405 35.0199 174.2803 106 R 4.9927 9.4356 124.1354 54.2666 32.8210 174.0300 107 L 4.8488 8.1115 123.2487 53.7803 44.0832 175.6777 108 V 4.8260 8.4375 118.0160 59.7357 36.6032 174.0015 109 A 4.8311 7.7795 120.9274 50.8261 22.8632 175.3638 110 F 5.2345 8.9823 119.9243 55.6940 42.6325 174.0033 111 D 5.4145 8.8841 122.7511 52.8818 42.3013 176.5857 112 N 4.7830 9.1429 122.7719 53.9049 38.5155 176.4310 113 Q 4.1704 8.6426 118.7193 59.1078 28.9446 177.7232 114 K 4.0197 8.3177 114.6632 57.0564 32.9997 176.5720 115 Q 3.4782 7.9850 118.8152 56.0764 27.0139 172.5818 116 V 4.5385 7.8366 117.6951 60.0363 35.0926 174.3256 117 Q 4.3458 8.7104 123.0566 56.4345 29.3442 175.4827 118 I 4.2104 8.0880 124.8613 61.2816 39.5748 174.2581 119 M 4.5434 6.6034 117.5506 54.0597 34.4863 173.5991 120 G 4.9207 8.2037 110.8730 47.3991 0.0000 172.0038 121 F 5.0090 7.0061 116.5395 55.4289 41.1532 172.6769 122 L 4.4915 8.8383 122.7404 55.4544 41.9342 176.7105 123 V 4.4692 9.0253 118.8267 61.7035 34.0426 175.8553 124 Q 4.6265 7.8652 120.8042 54.1935 32.5761 173.6121 125 R 4.3887 8.1589 121.1638 52.9347 32.5345 173.4473 126 P 4.1912 0.0000 0.0000 62.8973 31.6576 177.5506 127 K 4.1021 8.4293 119.3837 59.1379 32.1786 178.1159 128 T 4.1767 7.7600 106.6986 61.7880 69.3909 174.7062 129 A 4.2225 7.7313 126.7256 52.9609 18.5303 177.4872 130 R 4.5785 8.8067 120.6252 56.0932 31.5380 175.6781 131 D 4.9245 8.3254 117.8634 52.8168 39.7501 175.5905 132 F 5.3231 7.8565 112.8934 55.6126 40.9972 173.7071 133 Q 4.4399 8.3698 120.5221 53.0392 31.0540 174.1389 134 P 4.4074 0.0000 0.0000 62.4112 32.3210 176.8988 135 A 3.9718 8.9398 123.9957 55.7215 18.1186 179.5289 136 N 4.5875 8.1078 109.3072 54.3278 37.6570 175.5231 137 K 4.4185 7.8855 118.1696 56.4039 32.6386 177.4184 138 R 3.6101 7.6425 121.6356 57.5832 30.2037 176.7138 139 S 5.0703 7.4940 110.0060 56.2661 65.9404 174.2433 140 V 3.9792 8.4772 114.4434 61.6906 31.9062 175.7121 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 4.52 0.00 1.98 2.15 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 8.06 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 1.11 0.00 0.00 0.97 0.00 0.00 4 W 9.09 4.45 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 8.10 4.07 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 1.00 0.00 0.00 6 P 0.00 4.58 0.00 2.24 2.19 0.00 3.78 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 1.96 1.96 0.00 7 V 7.37 4.13 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 0.78 0.00 0.00 0.91 0.00 0.00 8 N 8.59 4.18 0.00 2.90 2.91 0.00 0.00 6.79 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 7.57 5.06 0.00 2.66 2.69 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 8.36 4.17 0.00 1.97 1.56 0.00 0.61 0.00 0.00 1.10 0.00 0.00 2.57 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.33 1.39 7.81 11 M 8.34 5.05 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.66 0.00 12 F 8.26 4.58 0.00 3.14 3.09 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 13 E 8.42 3.61 0.00 2.16 1.68 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 2.20 2.15 0.00 14 T 8.36 3.83 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 0.20 0.00 0.00 15 F 9.03 4.55 0.00 3.28 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 16 S 8.12 4.47 0.00 4.16 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 8.34 4.42 0.00 3.02 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.58 4.75 0.00 1.89 1.61 0.92 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 4.39 0.00 2.03 2.01 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 2.03 2.14 0.00 20 P 0.00 4.35 0.00 2.05 2.02 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 2.08 2.19 0.00 21 L 8.29 4.00 0.00 1.59 1.50 0.26 0.53 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 22 T 8.17 4.25 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 8.45 4.32 0.00 2.70 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 24 E 8.13 3.92 0.00 2.02 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 2.36 2.39 0.00 25 Q 7.96 3.94 0.00 2.31 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 26 I 8.02 3.70 2.05 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.69 1.07 0.00 0.00 27 A 8.33 4.01 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 A 8.05 3.97 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 29 Q 8.09 4.11 0.00 2.48 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.35 1.89 0.00 30 V 8.21 3.72 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 1.14 0.00 0.00 1.12 0.00 0.00 31 D 8.58 4.45 0.00 2.96 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 32 Y 8.06 4.16 0.00 3.24 3.36 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 33 I 8.00 3.97 2.16 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 1.68 1.29 1.07 0.00 0.00 34 V 7.90 3.50 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 1.04 0.00 0.00 1.01 0.00 0.00 35 A 7.98 3.89 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 36 N 7.13 4.05 0.00 1.44 1.42 0.00 0.00 7.04 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 7.45 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 38 W 7.43 4.95 0.00 3.39 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 8.93 4.37 2.12 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.99 0.71 0.00 0.00 40 P 0.00 4.89 0.00 2.09 1.98 0.00 3.80 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 41 C 8.63 4.96 0.00 3.11 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 42 L 8.74 5.26 0.00 1.88 1.65 0.91 0.81 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 43 E 9.15 5.57 0.00 2.01 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 2.34 2.33 0.00 44 F 9.04 5.71 0.00 3.06 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 45 A 8.35 4.55 -0.14 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 46 E 8.68 4.25 0.00 2.18 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 0.00 2.30 2.27 0.00 47 A 8.96 4.27 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.19 4.54 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 8.04 4.57 0.00 1.58 1.69 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.43 7.81 50 A 7.81 3.73 0.61 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 51 Y 7.46 4.60 0.00 2.94 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 52 V 8.38 3.81 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 0.64 0.00 0.00 0.77 0.00 0.00 53 S 8.81 4.73 0.00 4.08 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 8.60 5.26 0.00 2.75 2.82 0.00 0.00 6.59 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 8.35 3.98 0.00 2.15 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 0.00 2.39 2.38 0.00 56 S 8.93 4.05 0.00 3.94 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 57 A 7.61 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 6.88 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 1.47 0.80 0.89 0.00 0.00 59 R 7.55 4.21 0.00 1.86 1.99 0.00 3.19 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 60 F 7.06 4.99 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 8.29 4.04 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 0.00 0.00 0.00 62 S 8.41 4.64 0.00 3.86 3.84 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 63 V 7.18 4.49 1.84 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 0.66 0.00 0.00 0.48 0.00 0.00 64 S 8.26 4.48 0.00 4.11 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 65 C 8.13 4.05 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 8.42 3.64 0.00 1.78 1.77 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.79 4.44 0.00 2.89 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 68 Y 7.17 4.84 0.00 2.79 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 8.82 4.51 0.00 2.79 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 70 N 8.88 4.32 0.00 3.05 3.22 0.00 0.00 6.99 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 7.98 3.96 0.00 1.51 1.68 0.00 3.07 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 72 Y 7.66 4.39 0.00 3.05 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 0.00 73 W 8.64 5.05 0.00 3.05 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 74 T 8.10 4.32 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 0.95 0.00 0.00 75 M 8.55 4.58 0.00 2.07 2.03 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 2.70 2.77 0.00 76 W 9.67 4.78 0.00 3.72 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 77 K 8.60 3.48 0.00 1.68 0.74 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.76 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.85 0.21 7.81 78 L 8.38 4.93 0.00 1.60 1.58 1.01 1.04 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 4.37 0.00 0.75 1.87 0.00 3.67 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 1.97 2.14 0.00 80 M 8.66 4.29 0.00 2.04 2.01 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 2.60 2.54 0.00 81 F 7.34 4.46 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 9.10 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 C 7.88 4.37 0.00 3.04 2.99 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 84 R 8.61 4.50 0.00 1.80 1.87 0.00 3.24 0.00 0.00 3.16 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 85 D 7.83 4.78 0.00 2.75 2.57 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 86 P 0.00 4.34 0.00 2.22 2.18 0.00 3.67 0.00 0.00 4.00 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 8.23 4.14 0.00 2.04 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 2.70 2.56 0.00 88 Q 7.96 4.01 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 89 V 7.74 3.62 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.97 0.00 0.00 90 L 7.95 4.04 0.00 1.90 1.72 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.20 4.00 0.00 2.05 2.01 0.00 3.14 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 1.89 0.00 92 E 8.11 4.17 0.00 2.19 2.18 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 2.60 2.65 0.00 93 I 7.82 3.52 1.98 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 1.35 1.08 0.85 0.00 0.00 94 V 7.63 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 0.97 0.00 0.00 0.96 0.00 0.00 95 A 7.95 3.94 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 7.65 2.00 0.00 1.23 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 0.00 0.00 0.00 0.00 97 T 7.55 3.76 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 1.14 0.00 0.00 98 K 7.73 3.80 0.00 1.80 1.94 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.39 7.81 99 A 7.49 3.98 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 0.00 100 F 7.63 4.75 0.00 2.92 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 0.00 101 P 0.00 4.45 0.00 2.12 2.11 0.00 3.27 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 102 D 8.08 4.66 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 7.25 4.80 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 0.00 104 Y 8.61 4.21 0.00 2.47 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 0.00 105 V 8.94 5.18 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 0.89 0.00 0.00 0.96 0.00 0.00 106 R 9.44 4.99 0.00 1.81 1.85 0.00 2.29 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.31 0.00 107 L 8.11 4.85 0.00 1.47 0.69 0.85 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.44 4.83 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 0.47 0.00 0.00 0.54 0.00 0.00 109 A 7.78 4.83 1.16 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 0.00 110 F 8.98 5.23 0.00 3.02 2.91 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 0.00 111 D 8.88 5.41 0.00 2.44 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 9.14 4.78 0.00 2.94 3.06 0.00 0.00 6.32 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 8.64 4.17 0.00 2.35 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.32 4.02 0.00 1.77 1.88 0.00 2.15 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.47 7.81 115 Q 7.98 3.48 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 116 V 7.84 4.54 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 0.51 0.00 0.00 0.92 0.00 0.00 117 Q 8.71 4.35 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.88 0.00 0.00 0.00 0.00 0.00 2.20 1.91 0.00 118 I 8.09 4.21 1.19 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.29 -0.49 0.00 0.00 119 M 6.60 4.54 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.73 0.00 120 G 8.20 4.92 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 0.00 121 F 7.01 5.01 0.00 3.22 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 0.00 122 L 8.84 4.49 0.00 1.65 1.64 0.85 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.03 4.47 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 0.73 0.00 0.00 0.92 0.00 0.00 124 Q 7.87 4.63 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.23 0.00 125 R 8.16 4.39 0.00 1.24 1.51 0.00 2.22 0.00 0.00 2.88 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.27 0.00 126 P 0.00 4.19 0.00 2.11 2.16 0.00 2.20 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 127 K 8.43 4.10 0.00 1.75 1.92 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.39 7.81 128 T 7.76 4.18 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 1.22 0.00 0.00 129 A 7.73 4.22 1.55 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 0.00 0.00 130 R 8.81 4.58 0.00 1.81 1.92 0.00 3.22 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.82 0.00 131 D 8.33 4.92 0.00 2.91 2.96 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 0.00 132 F 7.86 5.32 0.00 3.21 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 0.00 133 Q 8.37 4.44 0.00 1.89 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.03 0.00 0.00 0.00 0.00 0.00 2.33 2.05 0.00 134 P 0.00 4.41 0.00 2.18 2.14 0.00 3.55 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.86 0.00 135 A 8.94 3.97 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 0.00 136 N 8.11 4.59 0.00 2.83 2.95 0.00 0.00 5.90 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 7.89 4.42 0.00 1.61 1.71 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.29 7.81 138 R 7.64 3.61 0.00 1.69 0.66 0.00 3.10 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.18 0.00 139 S 7.49 5.07 0.00 4.02 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 0.00 140 V 8.48 3.98 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 0.91 0.00 0.00