NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3407 8.2493 123.5831 52.5522 19.9675 176.3379 2 T 4.3809 8.2567 108.9622 61.4464 70.8133 172.5490 3 K 5.3517 8.3444 123.0383 54.8582 37.2105 176.1056 4 A 5.4156 9.1470 123.8498 50.9258 23.4272 175.1693 5 V 5.0018 8.7592 117.3458 60.8235 35.3851 173.3461 6 C 4.9870 9.2278 122.1431 57.9262 35.4975 172.5917 7 V 4.5906 8.4354 125.7320 61.4342 33.1399 174.0876 8 L 4.9050 8.9045 129.2806 53.7776 43.1772 176.1526 9 K 4.8802 9.0990 122.1571 55.4845 37.0183 176.2618 10 G 4.3358 7.9655 108.6418 45.8411 0.0000 172.3321 11 D 4.5760 8.8321 118.4451 55.4349 41.9738 176.7013 12 G 4.3894 7.6064 108.9189 44.1551 0.0000 171.4427 13 P 4.4240 0.0000 0.0000 63.5193 32.1229 175.6606 14 V 4.2318 7.5491 120.7120 62.7671 32.0497 174.9682 15 Q 4.8142 8.5945 124.9318 55.3183 32.5697 173.8652 16 G 4.1554 8.2766 106.6768 46.2934 0.0000 171.7729 17 I 5.1524 8.0509 119.4456 59.4617 40.9050 175.0568 18 I 4.5839 8.7945 127.7035 59.4730 40.1658 174.4925 19 N 4.9949 8.3794 124.0337 51.4175 41.3218 173.9145 20 F 5.3636 8.7197 119.1945 55.9073 43.5260 173.6913 21 E 5.2007 9.6568 122.9960 54.9189 33.4382 173.5838 22 Q 4.8579 9.2792 128.1462 54.3373 30.5469 175.0537 23 K 4.2305 8.9686 127.2857 58.5227 32.7341 177.7585 24 E 4.6982 7.9313 119.3401 54.4631 33.0648 175.7464 25 S 4.2836 8.8257 118.5033 60.2394 62.5836 172.4518 26 N 4.2102 8.9378 119.5080 53.2484 36.2182 174.5039 27 G 4.0195 7.9541 108.3798 43.3569 0.0000 172.0005 28 P 4.5974 0.0000 0.0000 62.9055 32.2504 175.9630 29 V 4.5747 8.8812 122.2848 61.3441 33.4705 174.5482 30 K 4.8001 9.2097 130.4230 55.9631 33.8002 175.4913 31 V 4.9051 9.1079 127.2665 60.8932 34.4280 174.1179 32 W 6.0738 7.6454 123.7610 55.4807 31.9224 175.5384 33 G 3.6794 7.6442 106.5652 46.1362 0.0000 170.5307 34 S 5.1282 7.6447 113.2611 56.6997 66.4238 174.3325 35 I 5.1001 8.7389 126.6164 59.3323 40.8105 174.7742 36 K 4.8184 9.3183 125.6032 55.6978 35.9581 177.0828 37 G 3.9418 8.8426 106.5162 46.5470 0.0000 173.5645 38 L 4.3952 7.6419 120.0461 53.3112 42.8943 176.5786 39 T 4.3454 8.1211 111.0555 61.0854 69.5467 174.0699 40 E 4.1588 8.5070 124.4812 57.5175 30.5448 175.2437 41 G 3.7802 8.4915 110.4120 43.9626 0.0000 172.2485 42 L 4.9320 8.1790 118.5718 54.5718 43.0054 176.4676 43 H 4.9922 9.1846 119.2668 53.7167 32.9453 173.5182 44 G 4.0582 9.1163 110.8310 46.6560 0.0000 172.5591 45 F 5.5323 8.8690 124.1435 57.2063 42.5403 172.9621 46 H 5.1011 8.9694 122.6075 54.2347 33.8540 172.5985 47 V 4.4694 8.5425 121.5233 62.3344 32.7108 175.0249 48 H 5.0621 9.2723 125.3686 54.3013 30.8373 175.8714 49 E 3.7341 8.8377 122.0889 58.8395 29.5154 177.0679 50 F 5.0146 8.0737 117.9089 54.9324 41.8700 176.5635 51 G 4.0779 8.4365 110.4354 44.8366 0.0000 173.7564 52 D 4.8111 8.0962 118.7570 52.4572 42.8677 174.5630 53 N 5.1969 8.4683 125.7383 53.3888 39.6131 176.2540 54 T 3.8772 8.5990 109.8357 63.3988 68.7917 174.5713 55 A 4.6430 8.1435 124.9999 51.4322 20.1765 177.4041 56 G 3.8588 7.9504 110.9359 47.0557 0.0000 174.8598 57 C 4.1993 8.5087 114.8815 62.8322 27.9841 175.6146 58 T 3.9088 7.9404 114.5771 65.1158 66.7172 175.6873 59 S 4.3378 7.8603 115.0785 60.3700 63.0736 175.5846 60 A 4.5080 7.6032 125.0175 53.8917 18.4139 178.5275 61 G 4.1610 8.1862 105.3232 44.4016 0.0000 170.6574 62 P 4.7323 0.0000 0.0000 61.9474 33.9395 175.2590 63 H 4.2817 8.4941 116.4623 55.7863 29.5258 175.5928 64 F 4.2921 9.0781 125.4807 58.0008 40.2436 175.0549 65 N 5.0938 7.8684 126.3077 51.5718 38.8062 173.0954 66 P 4.1613 0.0000 0.0000 65.1270 32.1169 177.8912 67 L 4.3035 7.6172 116.6218 53.7807 42.0328 176.1642 68 S 3.6168 7.5539 113.6281 59.7392 60.6165 171.9456 69 R 4.5007 8.0802 117.7423 54.4484 31.9684 176.6878 70 K 4.3858 8.7241 118.6036 56.0065 33.5917 176.5150 71 H 3.9648 8.6642 123.0019 56.8782 30.4233 174.9706 72 G 4.1270 7.5015 110.0868 46.0307 0.0000 172.0067 73 G 4.1790 8.9623 109.7801 43.0573 0.0000 173.2525 74 P 4.3653 0.0000 0.0000 65.0749 31.3608 177.3896 75 K 4.3539 7.9766 116.2262 56.3774 32.3512 175.8550 76 D 4.8585 7.6453 119.5089 52.5897 42.3614 176.4730 77 E 3.8860 8.7296 123.5108 58.9110 29.8449 176.4946 78 E 4.2703 7.9820 121.6558 55.3613 28.8276 174.7264 79 R 4.6579 7.6126 120.0431 55.7614 32.2706 174.6940 80 H 4.4615 8.9919 116.8892 55.3187 29.4930 176.9428 81 V 3.4346 8.3382 122.3193 66.4765 31.3150 177.2438 82 G 3.8974 8.2880 104.3109 47.0796 0.0000 173.3564 83 D 4.9831 8.1398 121.6389 53.2901 40.0724 175.7406 84 L 4.5391 8.4725 121.5479 52.9771 42.6967 177.8649 85 G 4.1298 8.5788 110.1088 46.2610 0.0000 174.8400 86 N 5.6400 8.6600 120.0899 51.3267 42.1711 173.0735 87 V 4.3405 8.6525 114.8796 60.0338 34.8648 174.8875 88 T 4.9894 8.2638 118.9063 61.8855 71.2302 172.9968 89 A 4.9031 9.0341 129.1267 50.4958 21.6804 176.8050 90 D 5.0987 8.4516 120.6350 51.8363 41.6152 177.4073 91 K 3.9280 8.5202 117.7220 59.5838 31.9521 177.9484 92 D 4.4211 8.1106 115.9246 53.9693 39.8641 177.0485 93 G 4.3411 8.7171 109.6606 44.5316 0.0000 172.4352 94 V 4.7867 8.1672 120.3132 60.9773 33.6475 174.2679 95 A 5.2553 8.8787 130.3597 49.7592 20.8467 175.1205 96 D 4.9942 8.6529 123.2247 53.4876 42.2624 176.1700 97 V 4.2243 8.7074 124.5296 61.3125 33.8083 174.9544 98 S 4.7179 8.4319 122.5954 57.8590 64.0796 172.9489 99 I 4.8475 9.2246 128.3732 59.4438 41.4056 174.4187 100 E 5.2459 8.8535 123.7543 54.7041 32.3411 174.9675 101 D 4.8741 9.3449 123.1875 52.7715 44.7732 175.7608 102 S 4.6965 8.9448 119.5064 58.4816 64.0198 174.9645 103 V 3.9848 8.0606 120.9250 64.8431 31.8955 176.5440 104 I 4.0432 7.8148 111.5008 61.1427 38.1822 174.6919 105 S 4.6763 8.4170 114.7331 57.3996 65.4813 174.0728 106 L 4.4389 8.9297 123.1039 54.1785 41.4956 176.2614 107 S 4.4773 7.8581 112.7735 58.0153 66.4126 175.1535 108 G 3.8764 8.5144 108.6133 45.0067 0.0000 173.5171 109 D 4.4188 8.7379 117.0234 57.2251 41.4922 177.5701 110 H 4.9271 8.1751 114.8233 55.5437 28.9438 174.1086 111 C 4.9851 8.3107 120.7551 59.1420 31.9291 173.4262 112 I 3.9170 8.0075 118.2479 60.3874 38.3138 175.5138 113 I 3.6625 7.3338 123.0064 62.9526 37.4571 176.2844 114 G 3.8058 9.3785 113.2548 45.4385 0.0000 172.9024 115 R 4.9564 7.3984 119.1299 54.7483 33.7983 174.5127 116 T 4.9608 7.9497 115.7216 62.0434 71.2777 173.6673 117 L 4.7883 8.5682 128.6608 54.0291 43.9681 175.3438 118 V 5.0347 8.8317 126.0516 60.9851 34.9359 174.2225 119 V 5.1415 8.6128 126.8446 60.4644 33.8335 174.6043 120 H 5.3197 8.7656 120.4694 53.9373 31.0675 174.3775 121 E 4.1974 9.3337 121.8196 58.9097 29.9829 176.7927 122 K 4.7578 8.3504 117.2703 53.7937 35.8837 175.9191 123 A 4.4085 8.2990 123.7305 52.1712 18.9544 176.3865 124 D 4.8006 9.3467 121.8957 53.9501 41.8366 176.1931 125 D 4.5764 9.2378 125.3963 53.1281 39.8694 176.9296 126 L 3.5215 9.8493 119.5936 56.0763 39.5556 175.9915 127 G 4.0008 8.6410 105.1445 45.8447 0.0000 174.8640 128 K 4.4516 7.9086 116.9819 55.9214 32.5950 177.6099 129 G 3.6823 7.9468 109.3053 45.6659 0.0000 175.3880 130 G 3.9674 8.2770 107.0360 46.0408 0.0000 172.5038 131 N 5.1196 7.3795 114.8044 50.0792 40.1047 175.3273 132 E 3.9301 8.5851 117.4044 59.4509 29.8742 179.6380 133 E 4.0668 7.7235 116.3716 58.9462 29.1784 178.9344 134 S 4.1408 8.2929 113.9345 61.4509 62.2367 175.5056 135 T 4.5136 7.4364 109.0222 61.4801 68.5445 175.3864 136 K 4.2742 7.7469 119.5704 58.2027 34.0622 177.1661 137 T 4.0142 8.0355 105.8081 60.3220 70.6184 175.2772 138 G 3.8397 7.8280 109.7143 44.7751 0.0000 173.1868 139 N 4.3311 7.9167 114.6515 54.3256 36.5078 174.8386 140 A 4.4475 7.5105 118.3840 51.2286 19.6550 179.8065 141 G 4.0680 7.9230 104.1653 45.4632 0.0000 173.8437 142 S 4.3717 8.7023 116.6336 58.7982 64.4317 174.2748 143 R 4.4001 8.4186 121.6347 55.6553 29.8233 176.3122 144 L 4.3903 9.0075 125.6148 57.0075 43.3010 176.8915 145 A 4.8635 7.7169 117.8674 51.4272 22.7646 174.8271 146 C 5.4498 8.4359 113.3881 58.6751 33.7103 172.8040 147 G 4.6482 8.1026 104.3600 46.1984 0.0000 172.4473 148 V 4.4921 8.2585 120.9273 62.2474 32.8334 175.4855 149 I 4.1606 8.7529 129.4324 60.8950 38.0205 175.3184 150 G 4.4105 8.9334 114.7013 43.9142 0.0000 172.2063 151 I 4.2732 8.3084 121.6556 61.1291 37.5857 175.5336 152 A 4.9275 8.6094 128.5162 49.6734 22.0598 176.4444 153 Q 4.1094 8.4925 115.8707 56.5081 28.9912 176.1271 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 A 8.25 4.34 1.27 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 0.00 0.00 0.00 2 T 8.26 4.38 4.46 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 1.24 0.00 0.00 3 K 8.34 5.35 0.00 1.73 1.76 0.00 1.85 0.00 0.00 1.93 0.00 0.00 3.05 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.50 7.81 4 A 9.15 5.42 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.76 5.00 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 0.81 0.00 0.00 0.94 0.00 0.00 6 C 9.23 4.99 0.00 3.11 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 7 V 8.44 4.59 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 8.90 4.91 0.00 1.72 1.59 1.03 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.10 4.88 0.00 1.65 1.62 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.38 7.81 10 G 7.97 4.34 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 0.00 11 D 8.83 4.58 0.00 2.94 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 12 G 7.61 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 0.00 0.00 0.00 0.00 13 P 0.00 4.42 0.00 2.22 2.29 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.94 0.00 14 V 7.55 4.23 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 0.79 0.00 0.00 0.93 0.00 0.00 15 Q 8.59 4.81 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.40 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 16 G 8.28 4.16 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 0.00 17 I 8.05 5.15 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.47 0.82 0.00 0.00 18 I 8.79 4.58 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.28 0.48 0.00 0.00 19 N 8.38 4.99 0.00 1.44 1.42 0.00 0.00 6.40 7.99 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 20 F 8.72 5.36 0.00 2.91 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 21 E 9.66 5.20 0.00 2.45 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 2.31 2.55 0.00 22 Q 9.28 4.86 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.63 0.00 23 K 8.97 4.23 0.00 1.81 1.87 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 E 7.93 4.70 0.00 2.03 1.79 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 2.29 2.34 0.00 25 S 8.83 4.28 0.00 3.62 3.68 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 26 N 8.94 4.21 0.00 2.84 2.91 0.00 0.00 6.96 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 27 G 7.95 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 0.00 0.00 0.00 28 P 0.00 4.60 0.00 2.13 2.10 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 29 V 8.88 4.57 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 1.30 0.00 0.00 1.06 0.00 0.00 30 K 9.21 4.80 0.00 1.94 1.88 0.00 1.30 0.00 0.00 0.83 0.00 0.00 2.13 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.52 1.35 7.81 31 V 9.11 4.91 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 0.82 0.00 0.00 1.09 0.00 0.00 32 W 7.65 6.07 0.00 3.51 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 33 G 7.64 3.68 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 0.00 0.00 0.00 34 S 7.64 5.13 0.00 3.81 3.61 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 35 I 8.74 5.10 1.79 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.46 0.88 0.00 0.00 36 K 9.32 4.82 0.00 1.73 1.88 0.00 1.32 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.34 7.81 37 G 8.84 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 38 L 7.64 4.40 0.00 1.80 1.40 0.80 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.12 4.35 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 1.24 0.00 0.00 40 E 8.51 4.16 0.00 1.96 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 2.29 2.43 0.00 41 G 8.49 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 42 L 8.18 4.93 0.00 1.49 1.59 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.18 4.99 0.00 3.01 3.31 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.12 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 0.00 0.00 0.00 45 F 8.87 5.53 0.00 2.98 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 46 H 8.97 5.10 0.00 3.13 2.92 0.00 5.67 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.54 4.47 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.87 0.00 0.00 48 H 9.27 5.06 0.00 3.02 3.39 0.00 5.67 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.84 3.73 0.00 1.64 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.12 0.00 50 F 8.07 5.01 0.00 3.17 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 51 G 8.44 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.10 4.81 0.00 2.61 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 53 N 8.47 5.20 0.00 2.72 2.69 0.00 0.00 6.90 7.22 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 54 T 8.60 3.88 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 1.25 0.00 0.00 55 A 8.14 4.64 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 56 G 7.95 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 57 C 8.51 4.20 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 58 T 7.94 3.91 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 1.26 0.00 0.00 59 S 7.86 4.34 0.00 4.21 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 60 A 7.60 4.51 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 61 G 8.19 4.16 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 0.00 62 P 0.00 4.73 0.00 2.05 2.21 0.00 3.52 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 2.03 1.97 0.00 63 H 8.49 4.28 0.00 2.81 3.17 0.00 5.72 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 64 F 9.08 4.29 0.00 2.91 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 65 N 7.87 5.09 0.00 2.45 2.42 0.00 0.00 6.92 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 66 P 0.00 4.16 0.00 2.07 1.96 0.00 2.99 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.18 0.00 67 L 7.62 4.30 0.00 1.56 1.68 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.55 3.62 0.00 4.01 3.89 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 69 R 8.08 4.50 0.00 1.87 1.95 0.00 3.42 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 70 K 8.72 4.39 0.00 1.67 1.69 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.37 7.81 71 H 8.66 3.96 0.00 3.16 3.14 0.00 5.96 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 72 G 7.50 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 0.00 0.00 0.00 73 G 8.96 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 0.00 0.00 0.00 74 P 0.00 4.37 0.00 2.23 2.36 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 75 K 7.98 4.35 0.00 1.77 1.88 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.41 7.81 76 D 7.65 4.86 0.00 2.75 2.56 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 77 E 8.73 3.89 0.00 1.92 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 2.28 2.29 0.00 78 E 7.98 4.27 0.00 2.06 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 2.32 2.30 0.00 79 R 7.61 4.66 0.00 1.96 1.77 0.00 2.86 0.00 0.00 2.63 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 80 H 8.99 4.46 0.00 3.45 3.37 0.00 5.66 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.34 3.43 1.50 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 0.79 0.00 0.00 0.45 0.00 0.00 82 G 8.29 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 0.00 0.00 0.00 83 D 8.14 4.98 0.00 2.69 2.75 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 84 L 8.47 4.54 0.00 1.77 1.89 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.58 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 0.00 0.00 0.00 86 N 8.66 5.64 0.00 2.58 2.69 0.00 0.00 6.65 7.68 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 87 V 8.65 4.34 1.81 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 -0.22 0.00 0.00 0.72 0.00 0.00 88 T 8.26 4.99 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 1.20 0.00 0.00 89 A 9.03 4.90 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 90 D 8.45 5.10 0.00 2.92 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 91 K 8.52 3.93 0.00 1.76 1.92 0.00 1.76 0.00 0.00 1.88 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.62 1.38 7.81 92 D 8.11 4.42 0.00 2.76 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 93 G 8.72 4.34 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 0.00 94 V 8.17 4.79 2.19 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 0.95 0.00 0.00 0.96 0.00 0.00 95 A 8.88 5.26 1.14 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 96 D 8.65 4.99 0.00 2.56 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 97 V 8.71 4.22 1.99 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 0.79 0.00 0.00 0.69 0.00 0.00 98 S 8.43 4.72 0.00 3.91 3.73 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 99 I 9.22 4.85 1.99 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.74 1.02 0.00 0.00 100 E 8.85 5.25 0.00 1.84 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 2.23 2.28 0.00 101 D 9.34 4.87 0.00 2.82 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 0.00 102 S 8.94 4.70 0.00 3.90 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 8.06 3.98 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 0.82 0.00 0.00 0.95 0.00 0.00 104 I 7.81 4.04 1.94 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.81 1.03 0.00 0.00 105 S 8.42 4.68 0.00 3.84 3.85 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 0.00 106 L 8.93 4.44 0.00 1.76 1.63 1.04 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.86 4.48 0.00 3.89 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.51 3.88 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 0.00 0.00 0.00 109 D 8.74 4.42 0.00 2.68 2.74 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 0.00 110 H 8.18 4.93 0.00 3.29 3.42 0.00 5.69 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.31 4.99 0.00 3.10 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 I 8.01 3.92 1.61 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.13 0.96 0.00 0.00 113 I 7.33 3.66 1.78 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.38 0.84 0.00 0.00 114 G 9.38 3.81 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 0.00 0.00 0.00 115 R 7.40 4.96 0.00 1.59 1.80 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.22 0.00 116 T 7.95 4.96 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 1.25 0.00 0.00 117 L 8.57 4.79 0.00 1.78 1.53 0.42 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.83 5.03 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 0.78 0.00 0.00 0.79 0.00 0.00 119 V 8.61 5.14 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 0.80 0.00 0.00 0.98 0.00 0.00 120 H 8.77 5.32 0.00 3.30 3.54 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.33 4.20 0.00 2.07 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 2.36 2.34 0.00 122 K 8.35 4.76 0.00 1.74 1.68 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.38 7.81 123 A 8.30 4.41 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 0.00 124 D 9.35 4.80 0.00 2.69 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 0.00 125 D 9.24 4.58 0.00 2.93 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 0.00 126 L 9.85 3.52 0.00 1.85 1.79 0.94 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.64 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 0.00 0.00 0.00 128 K 7.91 4.45 0.00 1.84 1.83 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.36 7.81 129 G 7.95 3.68 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 0.00 0.00 0.00 130 G 8.28 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 0.00 131 N 7.38 5.12 0.00 2.96 2.91 0.00 0.00 7.02 7.54 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 0.00 132 E 8.59 3.93 0.00 2.05 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 2.40 2.33 0.00 133 E 7.72 4.07 0.00 2.16 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 2.32 2.31 0.00 134 S 8.29 4.14 0.00 4.02 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 T 7.44 4.51 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 0.00 136 K 7.75 4.27 0.00 1.78 1.81 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.32 1.52 7.81 137 T 8.04 4.01 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 1.13 0.00 0.00 138 G 7.83 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 0.00 139 N 7.92 4.33 0.00 2.91 2.93 0.00 0.00 6.87 7.09 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 0.00 140 A 7.51 4.45 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 0.00 141 G 7.92 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.70 4.37 0.00 3.94 3.82 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 0.00 143 R 8.42 4.40 0.00 1.66 1.80 0.00 3.17 0.00 0.00 3.12 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.65 0.00 144 L 9.01 4.39 0.00 1.69 1.69 0.97 0.95 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 0.00 145 A 7.72 4.86 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 0.00 0.00 0.00 0.00 0.00 0.00 146 C 8.44 5.45 0.00 3.04 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 0.00 147 G 8.10 4.65 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 0.00 148 V 8.26 4.49 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 0.82 0.00 0.00 0.92 0.00 0.00 149 I 8.75 4.16 1.79 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.25 0.45 0.00 0.00 150 G 8.93 4.41 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 0.00 151 I 8.31 4.27 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.54 0.91 0.00 0.00 152 A 8.61 4.93 1.24 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 0.00 0.00 153 Q 8.49 4.11 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00