NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.3657 8.3049 120.3421 55.3793 34.2853 175.7670 3 L 4.0726 7.3850 118.4690 52.4248 42.4050 175.9607 4 T 4.2953 8.4270 114.0685 60.8740 72.1805 175.2742 5 A 4.0237 8.3060 121.9894 55.2596 18.1126 178.9932 6 E 4.0331 8.0915 117.4385 59.0194 29.6504 177.9148 7 E 3.9565 7.5978 114.9714 57.4287 29.5230 178.1275 8 K 4.1303 7.6828 117.8256 58.3009 32.4287 178.9756 9 A 3.9675 7.5091 120.7498 55.2779 18.4171 179.6214 10 A 4.1401 7.9391 118.7928 54.8075 18.4604 179.9684 11 V 3.5689 7.6991 117.5779 64.7752 31.4529 178.4387 12 T 4.2911 7.6788 115.0374 65.9503 68.4541 176.9072 13 A 4.1005 8.0288 121.8700 55.1402 18.7197 179.1871 14 F 4.3060 8.4224 118.9572 61.1540 39.5252 177.2735 15 W 4.4519 8.3882 126.8598 60.3938 30.2455 178.1715 16 G 3.6446 7.8599 105.1348 47.1932 0.0000 174.6984 17 K 4.1052 7.5387 118.7528 57.5648 32.5555 177.3239 18 V 3.7351 6.6756 119.5898 61.9161 31.8602 175.2181 19 K 4.0272 8.3834 128.7412 55.7091 31.9718 177.4445 20 V 3.6061 8.1706 126.6821 65.1092 32.3852 177.5761 21 D 4.3059 8.0076 119.4553 57.0942 40.6479 178.1801 22 E 3.8871 7.9260 118.4290 59.5122 29.4506 179.6089 23 V 3.8211 7.6033 117.9422 65.6973 31.2445 178.1636 24 G 3.7600 7.6255 105.3837 47.8725 0.0000 175.4499 25 G 3.7598 8.0737 106.5586 45.7147 0.0000 174.7819 26 E 4.0149 7.4344 121.7126 58.1622 30.4037 177.6084 27 A 3.9397 8.1665 121.1776 55.2087 18.2551 179.4439 28 L 4.0629 7.5284 117.4040 57.8182 42.5255 178.8799 29 G 3.8376 7.5677 105.6100 48.2330 0.0000 175.9238 30 R 3.9493 8.2774 121.3834 58.3667 29.5546 178.9211 31 L 4.2870 7.8914 119.8638 57.8335 41.6299 178.4510 32 L 4.5016 7.8345 118.7843 55.0861 41.6598 178.8206 33 V 3.7144 7.3576 117.5512 65.4654 31.9724 177.5282 34 V 3.5821 7.9512 117.1241 64.5132 32.6212 175.6871 35 Y 3.8748 6.8401 117.3598 54.7312 37.5160 174.2558 36 P 4.5406 0.0000 0.0000 64.1871 31.2794 177.4422 37 W 4.3999 8.0692 114.7596 58.6730 27.9505 177.7497 38 T 4.4441 7.5725 111.0068 64.3652 68.4466 176.4749 39 Q 4.2707 8.2679 121.2997 58.5473 28.3994 178.3517 40 R 3.8180 7.3415 118.2787 59.0452 30.0877 177.8691 41 F 4.1927 7.4172 115.3380 58.1817 39.8368 175.3604 42 F 4.9086 7.5588 116.9200 56.3770 38.8508 176.0608 43 E 4.1321 8.0412 123.2918 59.3781 30.1331 180.2604 44 S 4.0335 7.9675 112.2499 60.7809 63.2176 175.4772 45 F 4.2256 7.9769 118.5143 58.4603 39.7110 175.4443 46 G 4.0104 7.2774 105.0150 44.2198 0.0000 174.9011 47 D 4.6048 8.7218 126.5550 53.8401 41.2148 176.2905 48 L 4.9554 8.1911 129.8165 54.4402 42.9483 178.3871 49 S 4.2968 8.5066 115.1957 60.6585 63.8609 174.6376 50 T 4.6609 7.4294 109.7964 58.6973 72.4694 174.4351 51 A 4.0383 8.3871 122.0808 55.1199 18.1230 179.7329 52 D 4.3028 8.0132 117.0762 57.4915 41.1755 178.5602 53 A 3.9852 7.5849 119.9626 55.1645 18.1704 179.8275 54 V 3.5674 7.5829 115.7266 66.4599 31.6721 177.8708 55 M 4.2575 7.6627 115.9129 57.0712 31.9505 177.3444 56 N 4.9147 7.5085 113.7592 51.5977 39.6937 174.7963 57 N 4.3723 7.7137 120.8245 53.3609 40.1266 173.7836 58 P 4.2581 0.0000 0.0000 65.5023 31.6197 178.9368 59 K 3.8209 8.0066 117.0642 59.0150 31.9146 179.2407 60 V 3.7391 8.0668 118.6667 66.2142 30.9679 178.3472 61 K 3.9898 7.8436 117.9381 59.4280 31.6324 179.3549 62 A 4.0581 8.0120 121.1325 55.3284 17.9082 179.0848 63 H 4.3808 8.6621 116.7621 58.8139 29.6702 177.6894 64 G 3.6944 8.1112 108.0613 47.6140 0.0000 175.6595 65 K 4.1478 7.8290 120.8724 59.2004 31.9157 178.9793 66 K 3.9166 7.6206 118.8447 59.4091 31.8113 179.5221 67 V 3.7311 7.4962 117.1570 66.1971 31.6324 178.2826 68 L 4.2964 7.7727 118.1364 57.5661 41.2874 179.3082 69 D 4.5738 8.6499 120.1543 57.3074 40.8010 178.7542 70 S 4.1750 8.0757 114.4470 61.0541 62.8664 176.3913 71 F 4.0547 8.5055 124.1714 61.3869 38.9825 177.1258 72 S 4.7706 8.9968 115.3495 61.5842 62.4913 176.2156 73 N 4.5132 8.6615 120.5107 56.5651 38.5547 176.9839 74 G 3.8307 7.9792 105.2401 47.0941 0.0000 175.1243 75 M 4.0620 7.4035 119.4544 57.5760 31.9420 178.3888 76 K 4.1043 7.5856 118.2888 58.6162 33.5097 177.8916 77 H 4.7261 7.7345 117.1133 54.8631 27.9026 176.5020 78 L 3.8378 7.5536 120.3293 57.7864 42.3755 179.2165 79 D 4.4047 8.1101 117.5248 56.4562 41.6609 177.2421 80 D 4.8190 7.3655 119.0179 53.4211 38.0864 177.0006 81 L 4.2618 7.4631 123.5466 57.8407 42.1313 179.3733 82 K 4.0515 8.1024 118.2471 59.4410 31.7806 179.4491 83 G 3.7594 7.6168 105.4096 47.3842 0.0000 175.7625 84 T 3.9377 7.6844 116.6945 65.1541 68.6901 176.0137 85 F 4.6255 7.8771 117.7101 57.1472 38.9312 177.3137 86 A 4.2349 7.5619 123.6605 54.9341 17.9253 180.4076 87 A 3.9815 7.8498 119.1604 55.3043 18.2204 179.4958 88 L 4.1670 7.8373 116.5398 57.2096 42.2831 179.2883 89 S 4.2082 8.6642 114.0625 61.0864 62.2921 175.7581 90 E 3.8772 7.9667 121.1804 59.0428 29.3907 178.4438 91 L 3.9820 7.7401 120.5941 58.5763 42.2300 178.5694 92 H 4.3924 8.2998 115.0681 57.5563 28.4718 176.6207 93 C 4.5211 7.4717 114.6757 59.8574 30.7361 175.6730 94 D 4.4527 8.1525 119.7717 55.7806 41.2785 176.3721 95 K 4.3403 8.0403 115.6496 57.8237 33.7355 177.1176 96 L 4.3417 7.5907 114.6436 54.5706 42.0107 176.3312 97 H 4.2364 7.4296 113.4147 56.4389 26.9962 174.9437 98 V 3.6886 8.0282 118.5154 62.2081 32.0922 174.9336 99 D 4.3142 8.4807 127.0541 53.0076 41.3259 174.9880 100 P 3.8665 0.0000 0.0000 65.5582 31.2644 178.1128 101 E 3.7254 8.2610 119.0718 59.2242 29.1202 178.7229 102 N 4.3979 8.2192 116.9168 55.9067 38.3262 177.3545 103 F 4.4863 7.1028 119.2596 60.6814 38.8755 177.6714 104 K 4.0343 7.8507 116.6192 59.4972 31.7540 179.4078 105 L 3.9291 7.6074 119.2614 57.5440 41.4886 179.2226 106 L 4.1859 7.9495 120.1029 58.0026 41.6211 179.0529 107 G 3.7775 8.0833 105.9083 47.6338 0.0000 175.5831 108 N 4.4221 7.9734 118.6179 56.3928 38.6774 177.6203 109 V 3.6734 8.2821 120.0419 65.8156 31.4632 177.6664 110 L 3.8599 7.9859 120.1075 58.1330 41.8970 179.1317 111 V 3.4425 7.4401 117.1836 66.0041 31.4910 178.0128 112 V 3.6120 7.6196 117.4385 66.1697 31.3661 178.2072 113 V 3.5927 7.9245 117.8918 65.8908 31.2134 178.0270 114 L 4.0136 8.1911 119.0397 57.6734 41.2821 179.3633 115 A 4.1027 8.2595 121.2258 55.0043 18.0804 179.7051 116 R 3.8406 7.7873 116.7482 59.4411 30.2561 177.9912 117 N 4.4121 8.1649 114.7550 54.4656 39.0922 175.7542 118 F 4.7733 8.0205 117.5434 55.8000 42.6507 177.7034 119 G 4.0477 8.4058 109.5048 46.7411 0.0000 177.7232 120 K 4.2043 9.1951 124.9670 58.4159 32.3139 177.6107 121 E 4.0775 8.1538 118.8438 58.2771 29.6206 176.4729 122 F 4.3638 7.6713 120.2828 56.7521 38.3063 175.6467 123 T 4.2333 7.4375 117.6572 59.7493 71.3486 173.3822 124 P 4.1032 0.0000 0.0000 65.9390 30.7338 179.1714 125 V 3.5075 7.5046 116.3003 65.8746 31.4602 177.7665 126 L 3.9038 7.3838 119.7169 57.8434 41.7368 178.6979 127 Q 3.5541 7.8598 119.8934 58.9234 28.7611 177.9321 128 A 3.9994 7.6662 121.4379 55.4642 17.9545 179.4137 129 D 4.1767 7.7822 116.2325 57.5085 40.7956 179.0188 130 F 4.1315 8.0438 118.4499 60.4499 38.6892 177.8186 131 Q 4.1155 8.7207 118.2003 58.6883 28.3965 178.9213 132 K 4.0251 7.7113 119.4923 58.9904 32.1026 179.4395 133 V 3.4425 7.3529 118.1005 66.2685 31.4289 178.6210 134 V 3.7570 8.2313 112.0273 64.2657 31.4415 178.0636 135 A 4.2218 7.9887 119.4856 53.7246 18.3322 179.4345 136 G 3.5532 7.7952 104.5694 47.0281 0.0000 176.4872 137 V 2.9864 7.7043 120.4878 65.2627 31.3539 178.0328 138 A 3.8169 8.0722 120.8520 55.3127 18.0541 179.4654 139 N 4.4522 7.5261 112.8513 56.1961 38.6293 177.2829 140 A 4.1047 7.7267 121.6910 54.6584 18.5417 179.0537 141 L 3.9770 7.4257 115.6830 55.9599 41.8376 178.0400 142 A 4.8312 7.2657 120.1451 52.2018 19.2201 178.1168 143 H 4.0086 8.0879 122.1912 60.2689 30.2391 177.1012 144 R 3.9987 7.5908 116.9741 58.9488 29.4341 176.6658 145 Y 4.2792 7.3688 119.3154 59.7540 39.5631 174.7287 146 H 4.1999 8.2265 121.3884 55.6952 28.7952 175.2967 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 4.37 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 3 L 7.39 4.07 0.00 1.69 1.51 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.43 4.30 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 1.19 0.00 0.00 5 A 8.31 4.02 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 6 E 8.09 4.03 0.00 2.13 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 2.37 1.96 0.00 7 E 7.60 3.96 0.00 2.17 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 2.29 2.30 0.00 8 K 7.68 4.13 0.00 1.97 1.80 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.60 7.81 9 A 7.51 3.97 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 10 A 7.94 4.14 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 11 V 7.70 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 0.77 0.00 0.00 -0.33 0.00 0.00 12 T 7.68 4.29 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 13 A 8.03 4.10 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 14 F 8.42 4.31 0.00 3.36 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 15 W 8.39 4.45 0.00 3.93 3.37 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 16 G 7.86 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.54 4.11 0.00 1.60 1.92 0.00 1.76 0.00 0.00 1.60 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.33 7.81 18 V 6.68 3.74 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.30 0.00 0.00 19 K 8.38 4.03 0.00 1.67 1.56 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.27 7.81 20 V 8.17 3.61 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 1.00 0.00 0.00 0.80 0.00 0.00 21 D 8.01 4.31 0.00 2.68 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 7.93 3.89 0.00 1.91 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 2.33 2.30 0.00 23 V 7.60 3.82 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 1.03 0.00 0.00 0.91 0.00 0.00 24 G 7.63 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 0.00 0.00 0.00 25 G 8.07 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 0.00 0.00 0.00 26 E 7.43 4.01 0.00 2.30 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 2.20 2.27 0.00 27 A 8.17 3.94 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 28 L 7.53 4.06 0.00 1.65 1.79 0.81 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.57 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 0.00 0.00 0.00 30 R 8.28 3.95 0.00 1.85 1.96 0.00 3.12 0.00 0.00 3.07 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 31 L 7.89 4.29 0.00 2.01 1.89 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.83 4.50 0.00 1.87 1.69 0.78 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.36 3.71 2.00 0.00 0.00 0.00 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 0.94 0.00 0.00 34 V 7.95 3.58 1.52 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 -0.01 0.00 0.00 0.77 0.00 0.00 35 Y 6.84 3.87 0.00 2.68 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 4.54 0.00 2.25 2.11 0.00 3.92 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.13 0.00 37 W 8.07 4.40 0.00 3.53 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 38 T 7.57 4.44 4.42 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 1.06 0.00 0.00 39 Q 8.27 4.27 0.00 2.23 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.83 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 40 R 7.34 3.82 0.00 1.72 1.32 0.00 3.09 0.00 0.00 2.87 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.52 0.00 41 F 7.42 4.19 0.00 1.98 2.35 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 42 F 7.56 4.91 0.00 2.84 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 0.00 0.00 0.00 0.00 43 E 8.04 4.13 0.00 2.12 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 2.38 2.51 0.00 44 S 7.97 4.03 0.00 4.06 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 45 F 7.98 4.23 0.00 3.32 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.28 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 0.00 0.00 0.00 47 D 8.72 4.60 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 8.19 4.96 0.00 1.67 1.63 1.06 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.51 4.30 0.00 4.03 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 50 T 7.43 4.66 4.24 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 1.21 0.00 0.00 51 A 8.39 4.04 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.01 4.30 0.00 2.69 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 7.58 3.99 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 0.00 0.00 54 V 7.58 3.57 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 0.88 0.00 0.00 1.03 0.00 0.00 55 M 7.66 4.26 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.88 0.00 56 N 7.51 4.91 0.00 2.62 2.80 0.00 0.00 6.93 9.28 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 57 N 7.71 4.37 0.00 2.99 2.74 0.00 0.00 7.19 7.43 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 58 P 0.00 4.26 0.00 2.15 2.04 0.00 3.62 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 59 K 8.01 3.82 0.00 1.55 0.75 0.00 1.14 0.00 0.00 1.03 0.00 0.00 2.71 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.23 1.26 7.81 60 V 8.07 3.74 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 1.07 0.00 0.00 0.99 0.00 0.00 61 K 7.84 3.99 0.00 1.78 1.83 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.44 7.81 62 A 8.01 4.06 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.66 4.38 0.00 3.56 3.52 0.00 5.79 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 8.11 3.69 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 0.00 0.00 0.00 65 K 7.83 4.15 0.00 1.88 1.82 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.26 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.51 1.69 7.81 66 K 7.62 3.92 0.00 1.90 1.86 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.63 7.81 67 V 7.50 3.73 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 1.27 0.00 0.00 1.01 0.00 0.00 68 L 7.77 4.30 0.00 1.88 1.82 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.65 4.57 0.00 2.89 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 70 S 8.08 4.18 0.00 4.07 4.20 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 71 F 8.51 4.05 0.00 3.47 3.49 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 72 S 9.00 4.77 0.00 4.34 4.31 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 73 N 8.66 4.51 0.00 3.02 2.87 0.00 0.00 7.00 8.87 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 74 G 7.98 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 M 7.40 4.06 0.00 1.83 2.23 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.40 0.00 76 K 7.59 4.10 0.00 1.68 1.64 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.09 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.48 7.81 77 H 7.73 4.73 0.00 3.14 3.23 0.00 5.62 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.55 3.84 0.00 1.58 1.67 0.81 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.11 4.40 0.00 2.65 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 80 D 7.37 4.82 0.00 2.58 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 81 L 7.46 4.26 0.00 1.71 1.70 0.81 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.10 4.05 0.00 1.70 1.71 0.00 1.46 0.00 0.00 1.74 0.00 0.00 3.22 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.40 7.81 83 G 7.62 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 0.00 0.00 0.00 84 T 7.68 3.94 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 0.73 0.00 0.00 85 F 7.88 4.63 0.00 3.08 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 7.56 4.23 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 87 A 7.85 3.98 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 88 L 7.84 4.17 0.00 1.84 1.81 0.98 0.92 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 89 S 8.66 4.21 0.00 4.02 3.90 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 90 E 7.97 3.88 0.00 2.26 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 2.33 2.34 0.00 91 L 7.74 3.98 0.00 1.89 1.71 0.93 1.06 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 8.30 4.39 0.00 3.50 3.61 0.00 5.82 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 93 C 7.47 4.52 0.00 3.23 3.25 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 94 D 8.15 4.45 0.00 2.72 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 K 8.04 4.34 0.00 1.89 1.79 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.42 7.81 96 L 7.59 4.34 0.00 1.75 1.67 0.73 1.55 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 97 H 7.43 4.24 0.00 3.41 3.39 0.00 5.65 0.00 0.00 0.00 0.00 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.03 3.69 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 0.13 0.00 0.00 0.38 0.00 0.00 99 D 8.48 4.31 0.00 2.66 2.42 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 0.00 100 P 0.00 3.87 0.00 2.17 2.34 0.00 3.48 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.46 0.00 101 E 8.26 3.73 0.00 2.14 1.98 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 2.27 2.44 0.00 102 N 8.22 4.40 0.00 2.51 2.73 0.00 0.00 6.91 8.70 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 0.00 103 F 7.10 4.49 0.00 3.04 2.92 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 0.00 104 K 7.85 4.03 0.00 2.12 1.89 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.58 7.81 105 L 7.61 3.93 0.00 1.45 1.03 0.49 0.68 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 0.00 106 L 7.95 4.19 0.00 1.81 1.90 0.96 1.16 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 0.00 107 G 8.08 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 7.97 4.42 0.00 2.96 2.97 0.00 0.00 6.57 8.78 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 0.00 109 V 8.28 3.67 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 1.09 0.00 0.00 1.19 0.00 0.00 110 L 7.99 3.86 0.00 1.90 1.68 0.23 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.44 3.44 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 1.25 0.00 0.00 1.18 0.00 0.00 112 V 7.62 3.61 2.23 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 0.95 0.00 0.00 1.04 0.00 0.00 113 V 7.92 3.59 2.15 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 1.01 0.00 0.00 1.00 0.00 0.00 114 L 8.19 4.01 0.00 1.37 0.86 0.64 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.26 4.10 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 0.00 116 R 7.79 3.84 0.00 2.00 2.09 0.00 3.23 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 117 N 8.16 4.41 0.00 2.72 2.35 0.00 0.00 6.84 6.75 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 0.00 118 F 8.02 4.77 0.00 3.36 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 0.00 119 G 8.41 4.05 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 0.00 120 K 9.20 4.20 0.00 1.82 1.93 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.47 7.81 121 E 8.15 4.08 0.00 2.29 2.43 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 2.63 2.44 0.00 122 F 7.67 4.36 0.00 2.95 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.44 4.23 4.15 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 1.25 0.00 0.00 124 P 0.00 4.10 0.00 2.11 2.11 0.00 3.52 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 125 V 7.50 3.51 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 0.98 0.00 0.00 0.88 0.00 0.00 126 L 7.38 3.90 0.00 1.60 1.35 1.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.86 3.55 0.00 1.54 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 128 A 7.67 4.00 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 0.00 129 D 7.78 4.18 0.00 2.75 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 F 8.04 4.13 0.00 3.34 3.26 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 0.00 131 Q 8.72 4.12 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.83 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 132 K 7.71 4.03 0.00 2.04 1.81 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.57 7.81 133 V 7.35 3.44 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 0.99 0.00 0.00 0.68 0.00 0.00 134 V 8.23 3.76 2.27 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 1.14 0.00 0.00 1.15 0.00 0.00 135 A 7.99 4.22 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 7.80 3.55 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 0.00 137 V 7.70 2.99 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 -0.17 0.00 0.00 0.34 0.00 0.00 138 A 8.07 3.82 1.44 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 0.00 0.00 139 N 7.53 4.45 0.00 2.89 2.93 0.00 0.00 7.06 7.23 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 0.00 140 A 7.73 4.10 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 0.00 141 L 7.43 3.98 0.00 1.11 0.50 0.39 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.27 4.83 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 0.00 143 H 8.09 4.01 0.00 3.16 3.39 0.00 5.93 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 7.59 4.00 0.00 1.95 2.03 0.00 3.41 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 145 Y 7.37 4.28 0.00 2.88 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 0.00 146 H 8.23 4.20 0.00 3.19 3.29 0.00 5.64 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