NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.0877 0.0000 0.0000 62.0555 33.4961 174.5188 2 L 5.4259 8.0843 119.7439 51.5428 44.9039 174.8754 3 R 4.7884 10.3178 120.2266 55.0974 34.1268 173.1673 4 L 4.7538 8.3944 119.5086 53.8877 42.3900 178.4837 5 G 3.8568 8.9253 113.9016 45.0855 0.0000 174.1266 6 G 3.5965 8.5494 107.4358 48.3317 0.0000 174.7191 7 N 4.3080 8.0360 117.5661 54.8358 39.2080 175.6373 8 G 4.0580 7.6772 104.4868 44.9657 0.0000 173.0674 9 Q 4.3396 7.4153 120.9988 54.8301 30.1145 175.3285 10 L 4.5729 8.5654 125.7980 55.3163 43.2270 175.7783 11 Q 4.6399 9.5724 127.0704 54.6009 32.2593 172.8057 12 Y 5.2570 8.8696 127.6892 55.8879 40.5760 174.5736 13 W 5.1149 7.6783 122.6012 54.2535 31.2821 173.0405 14 P 3.9311 0.0000 0.0000 61.5883 31.8425 175.9527 15 F 4.0525 8.0603 117.7252 57.9825 39.5160 175.5780 16 S 4.1803 8.6959 119.9866 58.0332 63.0949 174.3583 17 S 3.8341 9.0535 123.8219 61.9536 62.4887 177.1101 18 S 4.1162 7.9131 117.0759 60.6445 62.5754 175.9775 19 D 3.5860 7.4911 122.8126 56.6301 40.3048 178.5843 20 L 3.8021 6.8699 118.8596 57.9988 41.6821 178.8904 21 Y 4.3750 7.3472 116.5694 61.1969 37.5522 178.4490 22 N 4.2612 7.6558 116.1324 56.3131 38.7574 177.1313 23 W 4.5316 8.0843 120.4721 59.4856 28.9299 178.5078 24 K 4.1270 8.4874 119.9997 59.6972 31.5437 178.0459 25 N 4.9303 8.6311 113.2355 53.6749 38.2968 175.0894 26 N 5.1358 7.7047 114.3849 52.6471 40.3526 173.7341 27 N 5.0436 7.9836 114.8611 51.1349 42.7500 172.6790 28 P 4.7047 0.0000 0.0000 61.2285 33.6459 176.1114 29 S 4.3295 8.3758 112.6966 58.5231 64.4976 174.7326 30 F 4.2746 8.8400 124.8492 61.9720 38.9716 177.3900 31 S 3.9877 8.7177 113.4956 61.9726 62.6771 176.5447 32 E 4.3112 8.4788 120.3573 57.5184 29.0951 176.7528 33 D 4.7384 7.8649 124.0287 51.5944 42.7660 174.6267 34 P 4.8454 0.0000 0.0000 64.9499 31.7610 178.3601 35 G 3.7083 7.9350 104.6101 46.6610 0.0000 175.3729 36 K 4.0158 7.9441 121.8459 59.3368 32.5234 178.3363 37 L 4.1825 7.5284 115.0662 56.8526 41.5738 179.5164 38 T 3.8905 7.8668 116.1155 66.5569 68.5736 176.4968 39 A 3.9494 7.9508 122.7088 55.0692 18.3109 179.4874 40 L 3.7031 7.6102 118.7116 58.3025 42.1681 179.1661 41 I 3.3536 7.4109 119.4874 64.2143 36.9878 177.6264 42 E 4.0255 8.1911 120.3164 59.7832 29.2839 179.0050 43 S 4.0689 8.0170 112.6376 61.3934 62.4230 176.3467 44 V 3.6977 8.0342 122.6193 65.1602 30.7628 177.8481 45 L 4.0204 8.5228 119.8870 58.1965 41.3451 179.8136 46 T 3.9756 7.7640 115.2826 66.9517 68.4086 177.2368 47 T 3.9844 8.3433 111.7489 64.1345 68.8875 175.0718 48 H 4.6955 8.6601 117.0313 55.2885 30.7283 174.2764 49 Q 3.5825 7.9941 118.7157 55.5674 26.0522 172.7504 50 P 4.3127 0.0000 0.0000 62.9028 32.5455 177.5973 51 T 4.4259 9.2416 111.7741 60.4049 71.5125 175.5427 52 W 3.7981 8.7299 129.5259 60.8296 30.5111 177.3542 53 D 4.2344 8.2578 118.1722 57.3930 40.2458 178.3688 54 D 4.4026 7.9778 119.2430 57.5212 40.7545 178.4125 55 C 4.1280 8.3953 117.6579 62.9098 28.0377 176.2340 56 Q 3.6927 7.5367 119.3422 58.9679 27.7414 178.8634 57 Q 3.9289 7.8329 118.6988 58.9376 28.7794 178.3637 58 L 3.7826 8.2380 121.5033 58.4411 42.0268 179.0063 59 L 4.0008 8.3462 118.9185 57.7307 41.4962 179.4232 60 G 3.8176 8.5504 102.3937 46.2803 0.0000 174.4037 61 T 4.5011 7.4025 116.0287 64.3017 70.6609 175.0079 62 L 4.4153 7.6726 118.1046 55.0283 42.4828 176.5387 63 L 4.9913 7.4443 118.2294 52.3530 44.6447 177.1058 64 T 4.2403 9.6104 113.5592 61.4620 70.5866 175.8305 65 G 3.8006 8.7157 109.1459 48.2373 0.0000 175.6458 66 E 4.1317 8.0821 119.9384 59.5559 29.7034 178.9517 67 E 4.0702 8.6791 118.9405 59.4846 29.4658 179.5160 68 K 3.9070 8.2170 119.6478 59.2152 32.1479 178.8306 69 Q 3.9180 7.9192 120.1361 59.1574 29.0473 177.8238 70 R 3.9140 8.1053 118.6987 59.6093 30.1108 178.6484 71 V 3.4861 7.8927 117.2986 66.2224 31.5641 177.8955 72 L 3.7862 8.2583 118.8847 57.7956 41.0203 179.6105 73 L 3.9246 8.0217 118.8021 58.0002 41.3984 179.4765 74 E 4.0443 7.9189 116.5759 58.5491 29.5921 179.0122 75 A 3.9604 7.5216 121.3001 55.1688 18.1576 179.9057 76 R 3.8491 7.2687 114.4149 58.3643 30.1578 178.4434 77 K 4.2613 7.2450 115.1487 56.9618 32.5720 177.7321 78 A 4.4428 7.7591 120.6397 52.2472 18.9456 177.1126 79 V 3.5418 7.5128 117.2811 63.3709 31.4890 175.2245 80 R 4.5490 8.3624 126.5639 55.1585 31.3529 176.9336 81 G 3.9596 8.7819 110.8503 44.2718 0.0000 174.1715 82 N 4.2938 8.5800 117.6257 56.6372 38.7564 175.8489 83 D 4.3688 7.9854 116.1213 54.8557 39.5398 177.1314 84 G 3.9868 8.5220 108.1175 45.0098 0.0000 173.3756 85 R 4.5764 7.6615 117.4169 53.0768 32.4976 173.6841 86 P 4.5260 0.0000 0.0000 63.4923 31.2809 175.7126 87 T 4.6051 7.8796 116.5598 60.2858 69.4988 173.4211 88 Q 4.5554 8.3582 124.4020 55.0489 30.2114 175.7810 89 L 3.9842 8.3013 118.0338 54.9587 42.6268 175.6326 90 P 4.2481 0.0000 0.0000 65.8853 30.9362 178.1778 91 N 4.3437 8.2493 114.9976 56.3364 37.0791 176.7818 92 E 4.0413 8.1278 120.2267 59.1396 29.6636 179.3637 93 V 3.7452 7.8751 118.3065 66.0712 31.4385 177.8472 94 D 4.4925 8.5336 117.6896 56.7551 40.6436 177.8867 95 A 4.4040 7.5783 119.2092 53.7388 19.1059 178.8125 96 A 4.6428 7.9687 118.1517 53.3190 20.5999 177.8094 97 F 4.8916 8.1224 120.5212 55.2782 39.1868 172.3175 98 P 4.6343 0.0000 0.0000 62.2184 32.2574 177.3432 99 L 4.5834 8.5781 120.3090 57.0159 42.4239 177.4631 100 E 4.4080 7.8044 116.3417 54.8043 30.5337 176.3668 101 R 2.0000 7.9055 118.4346 54.8765 29.7350 175.0148 102 P 3.9949 0.0000 0.0000 61.6505 32.5141 176.2094 103 D 4.5162 7.7339 119.1971 51.3148 38.1173 173.7934 104 W 4.8133 7.8307 125.3865 55.9250 30.7675 175.2668 105 D 4.6662 8.6056 123.4932 52.7137 41.3241 176.2959 106 Y 4.4316 8.1031 125.0601 58.9165 38.6270 175.3904 107 T 4.4633 7.0875 111.2343 61.5011 69.4409 174.2621 108 T 4.6206 7.3784 109.8118 60.9713 71.8890 174.3472 109 T 3.9586 8.3887 118.5704 66.3507 68.3946 177.3017 110 E 3.9208 8.0857 120.3416 59.2259 29.6906 178.8781 111 G 3.8971 7.8889 107.0089 47.4534 0.0000 175.8145 112 R 3.9488 7.7265 121.0664 58.6365 30.0685 179.0638 113 N 4.2533 8.1188 116.3583 56.5914 38.4914 176.9895 114 H 3.6969 8.0793 117.9740 58.5859 28.4549 177.6058 115 L 3.8971 7.6594 121.9699 58.2607 41.7614 179.2723 116 V 3.6051 7.7842 118.1533 65.7053 31.3831 177.8137 117 L 4.7951 7.8283 121.6311 57.6598 41.8694 177.9028 118 Y 4.1660 8.3959 119.9195 61.1904 38.2902 178.5883 119 R 4.0695 8.6177 118.5505 58.7290 30.1303 179.1594 120 Q 4.0684 7.6826 117.0388 58.7791 29.0047 178.1651 121 L 3.9845 7.9816 119.9940 57.5122 41.5900 179.2536 122 L 3.8560 8.2751 120.6211 58.2792 42.1004 178.7123 123 L 3.9653 7.6216 118.8318 58.0884 41.8372 178.9389 124 A 4.0364 7.9451 120.6895 55.1799 18.3347 179.7207 125 G 3.5679 8.4820 104.5117 47.8809 0.0000 175.8612 126 L 3.9513 8.2796 121.4824 57.6899 41.5303 179.4120 127 Q 4.0369 7.9028 116.3926 59.1419 28.9596 178.5411 128 N 4.4473 8.7327 117.2849 56.4646 38.4346 177.1481 129 A 4.1230 8.1683 121.0109 55.2396 18.5403 179.4891 130 G 3.8663 8.5278 105.4816 46.7307 0.0000 175.0193 131 R 4.4435 7.4206 122.7017 53.6584 28.6689 182.6088 132 S 4.3838 7.7152 119.4461 58.5361 63.0846 176.8061 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 P 0.00 4.09 0.00 0.49 1.42 0.00 2.34 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 1.12 0.00 2 L 8.08 5.43 0.00 1.49 1.55 0.95 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 3 R 10.32 4.79 0.00 1.80 2.20 0.00 2.48 0.00 0.00 2.91 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.38 0.00 4 L 8.39 4.75 0.00 1.54 1.63 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.93 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 6 G 8.55 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.04 4.31 0.00 2.69 2.85 0.00 0.00 7.26 7.98 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 8 G 7.68 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 9 Q 7.42 4.34 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.58 2.46 0.00 10 L 8.57 4.57 0.00 1.75 1.72 1.18 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 9.57 4.64 0.00 2.05 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.57 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 12 Y 8.87 5.26 0.00 2.41 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 13 W 7.68 5.11 0.00 3.14 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 14 P 0.00 3.93 0.00 2.13 2.11 0.00 3.52 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.22 0.00 15 F 8.06 4.05 0.00 2.95 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 16 S 8.70 4.18 0.00 3.86 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 17 S 9.05 3.83 0.00 4.00 4.11 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 0.00 0.00 0.00 0.00 18 S 7.91 4.12 0.00 4.00 4.14 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 19 D 7.49 3.59 0.00 2.26 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 6.87 3.80 0.00 1.19 1.34 0.68 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.35 4.37 0.00 2.96 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 22 N 7.66 4.26 0.00 2.57 2.70 0.00 0.00 7.10 7.51 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 23 W 8.08 4.53 0.00 3.48 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 24 K 8.49 4.13 0.00 1.92 2.15 0.00 1.88 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.51 1.55 7.81 25 N 8.63 4.93 0.00 2.73 2.84 0.00 0.00 6.92 8.17 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 26 N 7.70 5.14 0.00 2.85 2.80 0.00 0.00 6.66 7.88 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 27 N 7.98 5.04 0.00 2.65 2.69 0.00 0.00 6.86 7.86 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 28 P 0.00 4.70 0.00 2.28 2.10 0.00 3.81 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 1.97 1.95 0.00 29 S 8.38 4.33 0.00 4.12 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 30 F 8.84 4.27 0.00 3.06 3.45 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 31 S 8.72 3.99 0.00 3.83 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.48 4.31 0.00 1.88 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 2.33 2.30 0.00 33 D 7.86 4.74 0.00 2.60 2.51 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 34 P 0.00 4.85 0.00 1.84 1.69 0.00 3.83 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 1.91 1.66 0.00 35 G 7.93 3.71 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 0.00 0.00 0.00 36 K 7.94 4.02 0.00 1.99 1.83 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.68 1.53 7.81 37 L 7.53 4.18 0.00 1.96 1.75 0.97 0.71 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 38 T 7.87 3.89 4.33 0.00 0.00 0.00 0.00 0.00 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 39 A 7.95 3.95 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 40 L 7.61 3.70 0.00 1.57 1.51 0.83 0.30 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 41 I 7.41 3.35 1.75 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.79 0.80 0.00 0.00 42 E 8.19 4.03 0.00 1.99 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 2.30 2.33 0.00 43 S 8.02 4.07 0.00 3.98 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 44 V 8.03 3.70 1.74 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 1.01 0.00 0.00 -0.08 0.00 0.00 45 L 8.52 4.02 0.00 1.84 1.74 0.92 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 46 T 7.76 3.98 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 1.23 0.00 0.00 47 T 8.34 3.98 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 1.35 0.00 0.00 48 H 8.66 4.70 0.00 3.39 3.29 0.00 5.87 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 7.99 3.58 0.00 2.26 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 50 P 0.00 4.31 0.00 2.20 2.07 0.00 3.97 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 2.05 2.04 0.00 51 T 9.24 4.43 4.33 0.00 0.00 0.00 0.00 0.00 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 52 W 8.73 3.80 0.00 3.07 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 53 D 8.26 4.23 0.00 2.77 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 54 D 7.98 4.40 0.00 2.79 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 55 C 8.40 4.13 0.00 2.96 3.07 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 56 Q 7.54 3.69 0.00 1.85 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 57 Q 7.83 3.93 0.00 2.39 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 58 L 8.24 3.78 0.00 1.96 1.75 0.74 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.35 4.00 0.00 1.81 1.63 0.93 0.67 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 60 G 8.55 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 0.00 0.00 0.00 61 T 7.40 4.50 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 1.20 0.00 0.00 62 L 7.67 4.42 0.00 1.56 1.70 0.81 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.44 4.99 0.00 1.67 1.48 0.64 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 64 T 9.61 4.24 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 1.31 0.00 0.00 65 G 8.72 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 0.00 0.00 0.00 66 E 8.08 4.13 0.00 2.05 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 2.41 2.42 0.00 67 E 8.68 4.07 0.00 2.15 2.16 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 2.54 2.42 0.00 68 K 8.22 3.91 0.00 1.94 1.92 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.40 7.81 69 Q 7.92 3.92 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.47 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 70 R 8.11 3.91 0.00 2.17 2.05 0.00 3.27 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 71 V 7.89 3.49 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 0.91 0.00 0.00 0.74 0.00 0.00 72 L 8.26 3.79 0.00 1.72 1.80 1.09 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.02 3.92 0.00 1.96 1.68 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 74 E 7.92 4.04 0.00 2.12 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 2.43 2.46 0.00 75 A 7.52 3.96 0.26 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 76 R 7.27 3.85 0.00 1.87 2.00 0.00 3.31 0.00 0.00 3.26 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 77 K 7.25 4.26 0.00 1.71 1.81 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.41 7.81 78 A 7.76 4.44 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.51 3.54 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 1.05 0.00 0.00 1.08 0.00 0.00 80 R 8.36 4.55 0.00 1.85 1.84 0.00 3.26 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.80 0.00 81 G 8.78 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 0.00 0.00 0.00 82 N 8.58 4.29 0.00 2.69 2.89 0.00 0.00 7.23 8.95 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 83 D 7.99 4.37 0.00 2.83 2.80 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 84 G 8.52 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 0.00 0.00 0.00 85 R 7.66 4.58 0.00 2.05 1.83 0.00 3.14 0.00 0.00 3.41 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 86 P 0.00 4.53 0.00 2.18 2.09 0.00 3.73 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 87 T 7.88 4.61 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 1.33 0.00 0.00 88 Q 8.36 4.56 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.62 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 89 L 8.30 3.98 0.00 1.72 1.64 0.99 0.91 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 90 P 0.00 4.25 0.00 2.17 2.13 0.00 3.63 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 91 N 8.25 4.34 0.00 2.93 3.11 0.00 0.00 6.14 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 92 E 8.13 4.04 0.00 2.20 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 0.00 2.43 2.39 0.00 93 V 7.88 3.75 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.00 0.00 0.00 94 D 8.53 4.49 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 95 A 7.58 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.97 4.64 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 0.00 0.00 0.00 0.00 0.00 0.00 97 F 8.12 4.89 0.00 3.05 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 98 P 0.00 4.63 0.00 2.03 1.96 0.00 4.26 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.24 0.00 99 L 8.58 4.58 0.00 1.77 1.91 1.02 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 100 E 7.80 4.41 0.00 1.85 1.69 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 2.27 2.29 0.00 101 R 7.91 2.00 0.00 1.21 1.41 0.00 2.93 0.00 0.00 3.08 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.31 0.00 102 P 0.00 3.99 0.00 0.49 0.86 0.00 2.20 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 0.49 0.44 0.00 103 D 7.73 4.52 0.00 2.70 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 0.00 104 W 7.83 4.81 0.00 3.33 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 0.00 105 D 8.61 4.67 0.00 2.62 2.50 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 0.00 106 Y 8.10 4.43 0.00 3.11 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 T 7.09 4.46 4.19 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 0.99 0.00 0.00 108 T 7.38 4.62 4.33 0.00 0.00 0.00 0.00 0.00 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 0.00 109 T 8.39 3.96 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 1.21 0.00 0.00 110 E 8.09 3.92 0.00 2.03 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 2.38 2.40 0.00 111 G 7.89 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 0.00 112 R 7.73 3.95 0.00 1.87 2.00 0.00 3.19 0.00 0.00 3.39 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.00 0.00 113 N 8.12 4.25 0.00 2.86 2.71 0.00 0.00 6.97 7.78 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 0.00 114 H 8.08 3.70 0.00 2.30 1.31 0.00 5.62 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 0.00 115 L 7.66 3.90 0.00 1.91 1.78 1.13 1.04 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 0.00 116 V 7.78 3.61 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 0.95 0.00 0.00 0.96 0.00 0.00 117 L 7.83 4.80 0.00 1.88 1.82 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 118 Y 8.40 4.17 0.00 3.40 3.27 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 0.00 119 R 8.62 4.07 0.00 1.97 2.05 0.00 3.24 0.00 0.00 3.35 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.99 0.00 120 Q 7.68 4.07 0.00 2.35 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 121 L 7.98 3.98 0.00 2.04 1.72 1.10 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.28 3.86 0.00 1.70 1.69 1.01 0.64 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 0.00 123 L 7.62 3.97 0.00 1.83 1.86 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 124 A 7.95 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 G 8.48 3.57 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 0.00 0.00 0.00 126 L 8.28 3.95 0.00 1.79 1.73 0.81 0.36 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 0.00 127 Q 7.90 4.04 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.94 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 128 N 8.73 4.45 0.00 2.74 3.00 0.00 0.00 6.96 7.03 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 0.00 129 A 8.17 4.12 1.58 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 0.00 0.00 130 G 8.53 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 0.00 0.00 0.00 131 R 7.42 4.44 0.00 1.82 1.74 0.00 3.31 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.41 0.00 132 S 7.72 4.38 0.00 3.56 3.57 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