NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.3363 8.3349 115.4095 58.0831 64.1289 172.6106 4 I 4.1445 8.3600 126.3846 58.6570 38.8291 173.3398 5 N 4.8683 9.8055 128.5882 51.7627 41.6286 172.6758 6 L 4.7252 8.4446 126.8146 53.2271 43.4475 176.0104 7 N 4.7270 8.7723 123.3471 51.9192 39.1564 173.8049 8 P 4.5289 0.0000 0.0000 65.2971 31.7043 176.9158 9 Q 4.4599 8.5878 118.1604 55.6168 29.0736 177.1054 10 F 4.4086 8.1951 119.2489 59.5581 37.3146 176.9675 11 D 4.0472 6.3654 117.4827 57.1656 41.0590 178.0926 12 Q 3.9007 7.6865 118.0289 58.7853 28.7441 178.5979 13 I 3.6423 7.8034 121.0188 64.2338 37.1413 178.6722 14 G 3.5443 8.0201 106.3282 47.8341 0.0000 175.8685 15 K 4.0447 8.1829 121.7516 59.2091 32.1589 179.6214 16 Q 4.0204 8.3488 118.5343 58.5989 28.5176 178.4403 17 F 3.7978 8.2621 121.7316 61.4489 39.4672 177.6658 18 V 3.1963 7.8934 111.9582 64.1098 31.2825 178.2900 19 Q 4.0482 7.8813 119.2190 59.5423 28.9062 178.0101 20 H 3.9875 7.8892 118.6196 59.2048 29.7683 176.2489 21 Y 3.7218 7.6032 121.4427 61.1630 38.5375 178.0411 22 Y 3.8001 7.7544 117.3478 60.8752 37.9594 178.3549 23 Q 4.0220 7.9633 120.1444 59.5339 29.1278 178.5165 24 T 3.7666 7.8208 116.8249 66.4043 68.1814 176.5006 25 F 3.8024 7.8670 122.0228 61.3321 39.4051 176.8812 26 Q 4.3870 8.3037 117.1233 58.0779 28.6783 177.4382 27 T 4.6005 7.6213 109.0734 61.9882 71.7411 174.7196 28 N 4.9327 8.3710 119.8487 50.8522 40.4763 174.2650 29 R 3.5517 8.1777 122.1596 58.3020 30.3663 176.2760 30 P 4.2410 0.0000 0.0000 65.2369 31.2682 178.3766 31 A 4.0253 7.8908 119.7023 54.7865 18.2157 179.4026 32 L 3.9008 7.6384 117.9644 57.9407 40.9775 179.8591 33 G 4.0205 8.0899 105.4858 47.4861 0.0000 175.0562 34 G 3.9836 8.0150 105.2122 45.5816 0.0000 174.5965 35 L 4.5255 8.2444 120.9043 54.3393 42.1659 175.7240 36 Y 5.0695 7.2494 115.3515 56.3022 40.2876 174.4343 37 G 4.3416 8.9391 110.4944 42.6561 0.0000 172.5638 38 P 4.3101 0.0000 0.0000 65.1579 31.0557 177.6721 39 Q 4.6258 7.9318 114.8105 55.5020 29.5854 175.4160 40 S 3.9636 7.7434 115.5834 58.6987 64.6184 172.9957 41 M 5.2336 8.6396 119.6567 53.7160 36.6326 174.1179 42 L 5.2604 8.9271 123.9626 53.6212 45.5524 175.1072 43 T 4.9444 9.3814 123.2543 61.8514 71.1426 173.3354 44 W 4.7705 9.5878 135.0000 55.5183 31.6533 174.9948 45 E 3.7077 9.4583 129.4909 57.0259 27.4479 174.7522 46 D 4.7683 8.1688 115.8912 53.2031 39.0860 174.7603 47 T 4.4625 7.7864 117.1460 61.8802 70.9274 172.8646 48 Q 4.7528 8.3595 127.7696 54.6862 30.9144 174.5298 49 F 4.7097 9.4091 124.8718 55.7482 41.9040 173.8341 50 Q 4.5034 8.8925 125.9651 55.8724 29.9885 176.1458 51 G 4.1999 9.5044 112.9087 45.7147 0.0000 173.6835 52 Q 3.9086 8.8973 121.4112 59.1643 28.8800 179.1468 53 A 3.9603 7.9375 120.8791 55.3494 18.5398 179.2149 54 N 4.2490 8.0595 114.4521 56.3791 38.7050 177.5691 55 I 3.2967 7.8046 121.2944 64.2456 37.0881 178.5894 56 V 3.6468 7.9453 119.3259 66.1759 31.3555 177.7505 57 N 4.1742 8.1380 116.1833 55.9520 38.0776 177.3211 58 K 3.2837 7.2432 119.9578 59.3367 32.3544 178.5387 59 F 4.2963 7.4875 117.9008 60.7581 38.5829 177.5438 60 N 4.3262 8.1881 115.4366 55.8890 38.4067 177.0642 61 S 4.2071 7.5881 113.8582 58.6457 63.5455 174.5545 62 L 3.5081 6.7618 124.1476 54.8975 41.6847 177.5780 63 N 4.6406 7.7918 122.3315 51.1701 37.4361 172.5656 64 F 5.3119 7.7825 117.9401 55.5892 41.8907 176.0246 65 Q 4.2301 9.7157 125.2180 58.5741 29.2179 176.1620 66 R 4.7609 7.8082 115.3307 55.4919 33.5433 174.0843 67 V 4.7091 8.2897 123.6119 60.4645 34.2903 173.8401 68 Q 4.6550 8.8142 124.1491 53.9219 31.9555 174.4758 69 F 5.0842 8.9467 121.8898 55.9248 41.7291 175.5902 70 E 4.5858 9.3932 121.2863 54.6438 32.5723 174.6172 71 I 4.3375 8.4393 126.1319 61.2268 37.1441 176.1155 72 T 4.4472 8.6802 116.6103 62.4564 71.4169 174.3793 73 R 4.6617 7.4724 120.8991 54.9285 33.8033 173.9464 74 V 4.9162 8.2521 124.5896 61.5330 34.6325 173.8085 75 D 5.1658 9.3185 127.0015 52.8344 44.6265 174.6066 76 C 5.6483 8.8455 118.3012 58.4859 32.6589 173.2524 77 Q 4.3475 8.8315 118.4981 53.4724 33.2206 172.6791 78 P 4.7136 0.0000 0.0000 62.7648 32.5154 176.1897 79 S 4.6224 8.4600 117.9940 56.6453 65.2709 173.2832 80 P 4.4996 0.0000 0.0000 64.3322 31.1941 177.3842 81 N 4.9959 7.4582 114.7682 52.9323 38.8966 174.2014 82 N 4.3870 8.4878 113.7376 54.5918 38.8240 173.9682 83 G 5.1272 7.6730 104.2970 44.1787 0.0000 172.5706 84 S 5.2417 8.4141 115.6717 57.0082 68.0555 173.1622 85 I 4.7962 8.9876 124.4939 59.9238 38.9161 174.7660 86 V 4.9211 9.2949 127.5889 60.9861 34.5009 173.9056 87 F 5.6549 9.6631 130.6022 56.9051 41.4818 173.8229 88 V 4.9118 9.1965 126.9465 61.5986 34.5856 174.2688 89 T 4.3652 7.9990 119.4161 60.5945 71.0989 173.7067 90 G 4.0046 6.6057 113.2363 45.4510 0.0000 171.4895 91 D 5.6807 8.4507 119.9548 52.5403 45.2052 175.6313 92 V 4.6546 9.0353 120.5098 60.0423 34.9815 174.2545 93 R 4.7566 8.7012 123.4526 54.3483 32.8429 174.7737 94 I 4.4439 8.1126 123.9303 60.0998 39.9422 175.5507 95 D 4.4400 9.6718 126.3121 55.6026 38.9725 173.3511 96 D 4.3679 8.1778 112.6890 55.4380 38.5453 174.5167 97 G 4.0844 7.6399 109.8477 44.1301 0.0000 174.3250 98 Q 4.1353 8.3471 118.1010 54.9850 29.2861 174.5901 99 P 4.6779 0.0000 0.0000 62.9699 32.5124 175.3406 100 L 4.8237 8.7188 120.9977 52.7513 45.2545 175.7739 101 K 4.8922 8.5841 124.6446 56.1926 33.7302 175.4140 102 F 5.4417 8.9869 121.0736 55.4371 42.0052 173.5468 103 S 5.0365 9.2843 114.7578 57.2195 67.5267 173.0360 104 Q 5.1960 9.7064 123.3452 54.8179 33.0753 173.3257 105 V 5.0325 8.9623 125.3160 61.1544 34.6220 174.1699 106 F 5.3195 9.4229 125.9441 55.7444 42.8673 173.7604 107 N 5.3574 9.2824 121.4406 51.9045 40.9143 172.4343 108 L 4.9305 8.7802 126.6453 53.8534 43.6352 175.9462 109 M 5.2824 9.0467 122.4718 52.5174 34.9754 173.5778 110 P 3.8497 0.0000 0.0000 62.7325 31.8573 177.8609 111 S 4.0302 8.5734 118.3616 59.4666 63.2755 175.1415 112 G 4.0110 7.4299 109.0346 45.1763 0.0000 174.0168 113 N 4.7795 7.4615 113.7175 52.4935 37.5069 175.2413 114 G 3.9149 8.2768 107.6861 45.4434 0.0000 173.9284 115 G 4.1612 8.0625 107.1214 44.8493 0.0000 172.4974 116 F 5.4183 8.8061 117.0583 55.7285 42.5812 174.5270 117 M 5.0418 9.3067 118.2794 53.6090 35.2615 174.0272 118 I 4.3685 8.7630 120.8813 60.5833 37.8234 175.4996 119 F 4.5451 9.4823 130.0579 59.4824 41.2292 175.1785 120 N 5.4393 8.2698 115.2173 51.3834 42.2807 173.3453 121 D 4.9723 9.0011 122.1179 52.9659 44.8543 173.8268 122 L 5.2452 8.9499 126.9507 52.9870 44.7873 175.3281 123 F 5.5230 9.4091 127.3038 56.3819 42.0904 174.1884 124 R 4.7742 8.6629 125.8956 54.4923 32.9612 175.3249 125 L 5.0238 10.3667 122.5211 54.7819 42.8964 175.8879 126 N 4.5392 8.3938 122.0772 53.6167 38.8501 174.3687 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 3 S 8.33 4.34 0.00 3.98 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 4 I 8.36 4.14 1.85 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 1.21 0.25 0.88 0.00 0.00 5 N 9.81 4.87 0.00 2.81 2.66 0.00 0.00 6.75 6.27 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 6 L 8.44 4.73 0.00 1.56 1.55 0.87 1.05 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 7 N 8.77 4.73 0.00 2.93 2.83 0.00 0.00 6.95 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 8 P 0.00 4.53 0.00 2.26 2.24 0.00 3.87 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 2.04 2.04 0.00 9 Q 8.59 4.46 0.00 2.28 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 10 F 8.20 4.41 0.00 3.29 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 6.37 4.05 0.00 1.92 2.30 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 12 Q 7.69 3.90 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 13 I 7.80 3.64 1.71 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.92 -0.25 0.00 0.00 14 G 8.02 3.54 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 0.00 0.00 0.00 15 K 8.18 4.04 0.00 1.87 1.87 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.55 7.81 16 Q 8.35 4.02 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 17 F 8.26 3.80 0.00 3.21 3.02 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 18 V 7.89 3.20 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 0.42 0.00 0.00 1.13 0.00 0.00 19 Q 7.88 4.05 0.00 2.12 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 20 H 7.89 3.99 0.00 3.09 3.11 0.00 5.66 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 21 Y 7.60 3.72 0.00 2.56 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.75 3.80 0.00 2.99 2.66 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 0.00 0.00 0.00 0.00 23 Q 7.96 4.02 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 24 T 7.82 3.77 4.03 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 0.00 0.00 1.00 0.00 0.00 25 F 7.87 3.80 0.00 2.73 3.03 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 0.00 0.00 0.00 26 Q 8.30 4.39 0.00 2.32 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.55 0.00 0.00 0.00 0.00 0.00 2.86 2.99 0.00 27 T 7.62 4.60 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 1.23 0.00 0.00 28 N 8.37 4.93 0.00 2.69 2.60 0.00 0.00 7.11 7.33 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 29 R 8.18 3.55 0.00 1.77 1.71 0.00 3.05 0.00 0.00 3.42 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.77 0.00 30 P 0.00 4.24 0.00 2.10 2.06 0.00 3.70 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 2.07 2.28 0.00 31 A 7.89 4.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.64 3.90 0.00 1.33 1.47 -1.08 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.09 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 34 G 8.01 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 8.24 4.53 0.00 1.58 1.76 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 36 Y 7.25 5.07 0.00 3.07 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 37 G 8.94 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 38 P 0.00 4.31 0.00 2.27 2.38 0.00 3.75 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.05 0.00 39 Q 7.93 4.63 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.08 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 40 S 7.74 3.96 0.00 4.00 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 41 M 8.64 5.23 0.00 1.89 1.81 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 42 L 8.93 5.26 0.00 1.63 1.41 1.29 0.07 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 43 T 9.38 4.94 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 1.26 0.00 0.00 44 W 9.59 4.77 0.00 3.75 3.32 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 45 E 9.46 3.71 0.00 1.86 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 0.00 2.30 2.31 0.00 46 D 8.17 4.77 0.00 3.03 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 47 T 7.79 4.46 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 0.75 0.00 0.00 48 Q 8.36 4.75 0.00 1.97 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 49 F 9.41 4.71 0.00 2.87 2.83 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 50 Q 8.89 4.50 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.49 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 51 G 9.50 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 0.00 0.00 0.00 0.00 52 Q 8.90 3.91 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.54 2.59 0.00 53 A 7.94 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 N 8.06 4.25 0.00 3.10 3.02 0.00 0.00 7.09 7.49 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 55 I 7.80 3.30 1.74 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.94 0.13 0.00 0.00 56 V 7.95 3.65 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 1.10 0.00 0.00 1.02 0.00 0.00 57 N 8.14 4.17 0.00 2.83 2.69 0.00 0.00 6.69 6.89 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 58 K 7.24 3.28 0.00 0.79 1.10 0.00 1.00 0.00 0.00 0.79 0.00 0.00 2.56 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.62 0.68 7.81 59 F 7.49 4.30 0.00 2.97 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 60 N 8.19 4.33 0.00 2.65 2.80 0.00 0.00 7.11 8.42 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 61 S 7.59 4.21 0.00 3.85 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 62 L 6.76 3.51 0.00 1.36 0.52 1.04 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.79 4.64 0.00 2.58 2.71 0.00 0.00 6.91 7.45 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 64 F 7.78 5.31 0.00 3.09 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 65 Q 9.72 4.23 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.65 0.00 0.00 0.00 0.00 0.00 2.43 2.36 0.00 66 R 7.81 4.76 0.00 1.86 1.69 0.00 3.15 0.00 0.00 3.37 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 67 V 8.29 4.71 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 0.99 0.00 0.00 0.31 0.00 0.00 68 Q 8.81 4.66 0.00 1.85 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.80 0.00 0.00 0.00 0.00 0.00 2.21 2.41 0.00 69 F 8.95 5.08 0.00 2.78 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 70 E 9.39 4.59 0.00 1.84 1.86 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 2.22 2.41 0.00 71 I 8.44 4.34 1.89 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.77 0.99 0.00 0.00 72 T 8.68 4.45 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 73 R 7.47 4.66 0.00 1.81 1.58 0.00 3.13 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 74 V 8.25 4.92 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 0.95 0.00 0.00 1.01 0.00 0.00 75 D 9.32 5.17 0.00 2.74 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 C 8.85 5.65 0.00 3.20 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 77 Q 8.83 4.35 0.00 1.91 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.01 0.00 0.00 0.00 0.00 0.00 2.17 2.31 0.00 78 P 0.00 4.71 0.00 1.88 1.62 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 1.61 1.40 0.00 79 S 8.46 4.62 0.00 3.92 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 80 P 0.00 4.50 0.00 2.16 2.10 0.00 3.53 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 2.07 2.06 0.00 81 N 7.46 5.00 0.00 2.75 2.77 0.00 0.00 6.89 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 82 N 8.49 4.39 0.00 2.84 2.92 0.00 0.00 6.76 8.16 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 83 G 7.67 5.13 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 84 S 8.41 5.24 0.00 3.61 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 85 I 8.99 4.80 1.87 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 1.09 0.87 0.92 0.00 0.00 86 V 9.29 4.92 2.36 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 1.21 0.00 0.00 0.95 0.00 0.00 87 F 9.66 5.65 0.00 3.02 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 9.20 4.91 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 1.09 0.00 0.00 1.34 0.00 0.00 89 T 8.00 4.37 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 0.93 0.00 0.00 90 G 6.61 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 91 D 8.45 5.68 0.00 2.56 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 V 9.04 4.65 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 -0.16 0.00 0.00 93 R 8.70 4.76 0.00 1.63 1.76 0.00 3.04 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 94 I 8.11 4.44 1.69 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.32 0.51 0.00 0.00 95 D 9.67 4.44 0.00 2.72 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 96 D 8.18 4.37 0.00 2.81 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 97 G 7.64 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 98 Q 8.35 4.14 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 99 P 0.00 4.68 0.00 2.05 2.02 0.00 3.68 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 1.97 1.98 0.00 100 L 8.72 4.82 0.00 1.59 1.69 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.58 4.89 0.00 1.85 1.62 0.00 1.77 0.00 0.00 1.84 0.00 0.00 2.88 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.42 1.38 7.81 102 F 8.99 5.44 0.00 2.96 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 0.00 103 S 9.28 5.04 0.00 3.75 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 0.00 104 Q 9.71 5.20 0.00 2.73 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 1.33 2.44 0.00 105 V 8.96 5.03 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 0.99 0.00 0.00 0.88 0.00 0.00 106 F 9.42 5.32 0.00 2.92 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 0.00 107 N 9.28 5.36 0.00 2.90 2.91 0.00 0.00 7.00 6.23 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 0.00 108 L 8.78 4.93 0.00 1.40 1.26 0.32 -0.29 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 0.00 109 M 9.05 5.28 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.47 0.00 110 P 0.00 3.85 0.00 2.05 1.69 0.00 3.60 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 2.12 2.27 0.00 111 S 8.57 4.03 0.00 3.91 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 0.00 112 G 7.43 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 0.00 113 N 7.46 4.78 0.00 2.81 2.85 0.00 0.00 7.18 6.88 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 0.00 114 G 8.28 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 0.00 0.00 0.00 115 G 8.06 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 0.00 116 F 8.81 5.42 0.00 2.95 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 0.00 117 M 9.31 5.04 0.00 2.08 2.30 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.59 0.00 118 I 8.76 4.37 1.39 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.53 1.12 0.00 0.00 119 F 9.48 4.55 0.00 3.23 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 0.00 120 N 8.27 5.44 0.00 2.77 2.74 0.00 0.00 6.47 8.08 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 0.00 121 D 9.00 4.97 0.00 3.03 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 0.00 122 L 8.95 5.25 0.00 1.64 1.56 0.94 0.96 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 0.00 123 F 9.41 5.52 0.00 3.04 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 0.00 124 R 8.66 4.77 0.00 1.79 1.62 0.00 3.08 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.78 0.00 125 L 10.37 5.02 0.00 1.59 1.02 0.93 0.35 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 0.00 126 N 8.39 4.54 0.00 2.97 2.74 0.00 0.00 6.85 7.56 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