NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5578 8.3049 120.2783 55.3637 33.7475 173.9398 2 R 4.2894 8.2624 119.2927 54.1225 33.9733 173.0689 3 H 5.5427 9.0613 118.3877 55.1704 31.5518 175.1176 4 Y 5.3771 8.0751 118.3624 57.4826 41.2407 173.7973 5 E 4.2466 8.8265 127.3694 56.0158 29.7663 174.5256 6 I 4.9686 8.4846 127.6958 59.0204 40.4137 174.3743 7 V 5.4725 8.6721 127.5760 58.9956 33.1412 174.0112 8 F 5.0850 8.7791 121.7648 54.9865 40.3782 174.1711 9 M 4.3406 8.1866 121.0392 53.8319 33.0262 175.4243 10 V 4.7131 8.5186 122.4372 60.7752 34.8201 174.0984 11 H 4.2588 8.9596 125.5419 56.2654 29.9558 173.0177 12 P 4.2981 0.0000 0.0000 66.5123 31.1579 179.3440 13 D 4.8422 7.6906 119.1254 53.8396 40.4536 176.9825 14 Q 5.1127 8.8096 114.2443 53.8053 31.3322 177.2698 15 S 4.2241 8.4885 117.2989 62.0242 62.7005 176.2277 16 E 4.0013 8.3457 119.4165 59.7800 28.9365 179.1404 17 Q 4.0611 8.5986 119.1281 58.1253 28.8351 178.2421 18 V 3.5575 7.7368 120.0654 65.6392 31.4152 176.3014 19 P 4.3354 0.0000 0.0000 65.7792 31.2133 178.3759 20 G 3.5613 8.0099 105.2098 47.7205 0.0000 175.0222 21 M 3.5413 8.4597 121.7303 57.9441 32.0140 178.5460 22 I 3.6419 7.5445 119.4344 64.7321 37.2895 177.8271 23 E 3.9140 8.2559 119.7658 59.5092 29.3317 179.2527 24 R 3.8718 7.7848 117.7311 59.6346 30.1656 178.2328 25 Y 4.3196 7.7576 116.8780 61.4371 37.8108 178.6104 26 T 3.9487 8.3793 110.1229 65.3763 68.5503 175.5916 27 A 3.9580 7.9317 122.7914 54.8818 18.4377 179.1484 28 A 3.9334 7.9130 118.0395 55.5787 18.4577 179.4700 29 I 3.6111 7.8465 117.8999 65.3427 37.2223 178.6568 30 T 4.1521 8.4536 116.4936 66.6755 68.0728 176.7898 31 G 3.7394 8.3057 107.0513 47.5767 0.0000 174.4519 32 A 4.4891 7.7076 120.9416 51.8073 19.3129 177.1409 33 E 3.7583 8.1598 117.6073 58.7913 27.4406 175.3333 34 G 3.9647 8.1181 105.6303 46.1303 0.0000 173.9461 35 K 4.7134 8.3093 119.8417 54.3932 35.3430 175.3688 36 I 4.5175 8.4592 126.1485 60.4357 38.1956 175.4133 37 H 4.7989 8.1453 124.3257 55.4055 29.4276 174.4093 38 R 4.4106 7.1911 117.3379 56.1899 32.3418 173.9162 39 L 4.5550 8.0158 117.8670 54.9932 43.1815 173.8275 40 E 4.4532 8.4286 127.6896 57.8085 32.0269 176.0108 41 D 5.1681 7.8865 113.0574 54.9098 42.1928 177.7855 42 W 4.1567 9.1070 120.5000 56.4425 29.6450 178.1129 43 G 3.7733 8.2251 108.1504 45.4795 0.0000 172.7074 44 R 5.0890 8.1618 117.7446 56.3718 28.9444 176.4906 45 R 4.7660 8.3099 125.3522 53.8340 33.0601 174.6865 46 Q 4.3677 8.7189 125.3452 56.4174 29.9111 175.0674 47 L 4.3248 8.1657 124.8929 53.0265 43.0495 175.9126 48 A 3.8785 8.9223 126.4100 54.0003 18.9481 176.7460 49 Y 4.6944 7.2507 114.9421 54.2106 40.5974 175.4424 50 P 4.4772 0.0000 0.0000 62.0917 28.9606 175.0792 51 I 3.7210 7.2531 120.8077 62.7818 37.7898 174.7899 52 N 3.9957 9.3796 129.1102 54.4319 36.9787 174.0089 53 K 3.8413 7.9527 117.7467 56.8667 31.8711 175.9313 54 L 3.5167 8.2547 112.5004 56.5880 38.3429 175.5900 55 H 4.8384 7.5512 120.9206 54.6795 28.7164 175.6543 56 K 5.0204 8.5454 117.7748 56.4977 36.6514 175.6309 57 A 4.6009 8.7314 124.9360 50.6419 23.6751 173.6708 58 H 5.3420 8.4826 116.8581 53.9191 30.7724 173.0997 59 Y 4.5743 8.6520 123.6726 57.6629 40.2627 174.7834 60 V 4.6565 7.6664 108.1193 60.8307 36.6010 172.7615 61 L 4.9853 8.5970 121.9973 53.1431 44.5776 174.6333 62 M 4.7069 8.6597 117.5686 52.0583 34.6113 175.3883 63 N 4.7513 8.0788 113.6285 53.6775 36.9044 174.3437 64 V 4.2598 7.4103 117.9553 62.4126 34.4127 173.8486 65 E 5.6000 9.0227 114.9473 54.2197 29.3193 174.3620 66 A 4.7668 7.6606 122.6128 49.2964 22.3703 175.1204 67 P 4.5034 0.0000 0.0000 62.3745 32.3605 177.4655 68 Q 3.8986 9.0681 120.1075 59.7246 27.7505 179.0869 69 E 3.8804 8.2011 119.6844 59.4471 29.9072 178.9954 70 V 3.8820 7.7616 112.1412 64.5150 31.6501 178.4147 71 I 3.5789 7.8246 112.3489 64.2910 36.3672 177.3503 72 D 4.7502 7.7762 120.2689 56.8354 40.9179 178.1149 73 E 3.9554 7.9079 117.3743 58.6301 29.6696 178.6067 74 L 3.9022 7.3146 121.1411 56.6835 42.6059 177.8940 75 E 4.1474 8.7907 119.9309 59.7355 29.3172 179.6333 76 T 3.9527 7.5213 108.9764 64.4847 68.8127 176.8217 77 T 3.8176 7.4049 112.6898 64.8305 68.1163 176.0096 78 F 4.2747 7.4721 118.7073 60.5167 39.0660 177.4785 79 R 4.0416 8.0141 116.4250 57.8410 31.0035 177.5527 80 F 5.2513 7.2525 117.6624 55.3738 38.4712 177.5213 81 N 4.8669 7.7888 116.3819 52.6469 40.8328 173.8863 82 D 4.4210 8.5532 122.0433 56.9950 41.9116 178.2881 83 A 4.1545 8.0145 121.0317 54.9734 18.4391 177.9672 84 V 4.5936 8.0140 113.7841 60.9414 33.8017 176.7807 85 I 4.4991 7.6930 121.7005 60.7762 36.7919 177.2534 86 R 3.9818 8.6310 126.6073 58.3157 30.8156 174.9888 87 S 4.6887 8.5410 116.9786 56.6812 64.8967 172.3377 88 M 4.9334 7.9793 124.5298 53.8450 36.3009 174.6123 89 V 4.5360 7.9383 116.1739 61.6218 33.5166 172.4273 90 M 4.5908 8.7446 126.6094 53.8900 34.5262 175.5811 91 R 4.2866 8.1181 116.3930 57.2167 31.6859 175.8714 92 T 3.8007 8.6812 112.5634 62.0719 68.4048 174.3575 93 K 3.8641 8.9439 120.7302 57.7331 30.2562 171.3896 94 H 4.1433 7.2980 124.5739 55.5510 28.6112 174.2264 95 A 3.4965 7.8213 127.3435 51.5679 17.4383 176.7917 96 V 4.0255 8.0317 122.0400 63.4387 32.6053 175.2743 97 T 4.8746 8.3116 119.8662 61.6207 72.9659 174.5856 98 E 3.1582 9.4265 117.4434 57.9708 31.6591 174.9031 99 A 3.4902 9.1319 124.8045 53.0166 17.9957 177.6599 100 S 4.2199 8.5045 112.4235 59.3851 62.7155 171.2811 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 M 8.30 4.56 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.69 0.00 2 R 8.26 4.29 0.00 1.33 1.45 0.00 3.11 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 3 H 9.06 5.54 0.00 3.12 3.16 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 8.08 5.38 0.00 2.93 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 5 E 8.83 4.25 0.00 2.05 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 2.37 2.50 0.00 6 I 8.48 4.97 1.91 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.38 1.08 0.00 0.00 7 V 8.67 5.47 2.13 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 0.78 0.00 0.00 0.94 0.00 0.00 8 F 8.78 5.08 0.00 2.90 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 9 M 8.19 4.34 0.00 0.51 1.33 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 10 V 8.52 4.71 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 1.06 0.00 0.00 1.04 0.00 0.00 11 H 8.96 4.26 0.00 3.26 3.27 0.00 5.83 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 12 P 0.00 4.30 0.00 2.16 2.32 0.00 3.15 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 13 D 7.69 4.84 0.00 2.83 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 14 Q 8.81 5.11 0.00 2.30 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.17 6.70 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 15 S 8.49 4.22 0.00 3.90 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 16 E 8.35 4.00 0.00 2.16 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 0.00 2.38 2.37 0.00 17 Q 8.60 4.06 0.00 2.35 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.66 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 18 V 7.74 3.56 2.13 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 0.88 0.00 0.00 0.71 0.00 0.00 19 P 0.00 4.34 0.00 2.29 2.29 0.00 3.82 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 2.15 2.03 0.00 20 G 8.01 3.56 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 0.00 0.00 0.00 21 M 8.46 3.54 0.00 1.93 2.29 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.68 0.00 22 I 7.54 3.64 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.14 1.00 0.00 0.00 23 E 8.26 3.91 0.00 2.03 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 2.29 2.36 0.00 24 R 7.78 3.87 0.00 1.97 1.93 0.00 3.16 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 25 Y 7.76 4.32 0.00 3.13 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 26 T 8.38 3.95 4.29 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 1.35 0.00 0.00 27 A 7.93 3.96 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 7.91 3.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 I 7.85 3.61 2.07 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.78 0.96 0.00 0.00 30 T 8.45 4.15 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 1.23 0.00 0.00 31 G 8.31 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.71 4.49 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 33 E 8.16 3.76 0.00 2.16 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 0.00 2.24 2.40 0.00 34 G 8.12 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 35 K 8.31 4.71 0.00 1.81 1.62 0.00 1.64 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.45 7.81 36 I 8.46 4.52 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.45 0.99 0.00 0.00 37 H 8.15 4.80 0.00 3.49 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 7.19 4.41 0.00 1.75 1.80 0.00 3.52 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 39 L 8.02 4.56 0.00 1.65 1.57 1.09 1.13 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 40 E 8.43 4.45 0.00 2.15 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 41 D 7.89 5.17 0.00 2.78 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 42 W 9.11 4.16 0.00 3.39 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 43 G 8.23 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.16 5.09 0.00 1.73 1.86 0.00 3.01 0.00 0.00 3.78 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.42 0.00 45 R 8.31 4.77 0.00 2.26 2.00 0.00 3.43 0.00 0.00 3.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 46 Q 8.72 4.37 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.50 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 47 L 8.17 4.32 0.00 1.50 1.37 0.85 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 48 A 8.92 3.88 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 49 Y 7.25 4.69 0.00 3.11 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 50 P 0.00 4.48 0.00 2.25 2.17 0.00 3.95 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 51 I 7.25 3.72 1.51 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 1.27 0.73 0.72 0.00 0.00 52 N 9.38 4.00 0.00 2.87 2.82 0.00 0.00 7.27 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 7.95 3.84 0.00 1.97 1.88 0.00 1.99 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.41 7.81 54 L 8.25 3.52 0.00 1.71 1.53 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 55 H 7.55 4.84 0.00 3.19 3.48 0.00 5.45 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.55 5.02 0.00 1.47 1.67 0.00 1.33 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.33 1.39 7.81 57 A 8.73 4.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 H 8.48 5.34 0.00 3.15 3.04 0.00 5.64 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.65 4.57 0.00 3.05 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 V 7.67 4.66 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 0.67 0.00 0.00 -0.32 0.00 0.00 61 L 8.60 4.99 0.00 1.75 1.71 1.20 1.40 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 62 M 8.66 4.71 0.00 1.93 2.25 0.00 0.00 0.00 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.73 0.00 63 N 8.08 4.75 0.00 3.05 2.93 0.00 0.00 7.27 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 64 V 7.41 4.26 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 1.05 0.00 0.00 1.04 0.00 0.00 65 E 9.02 5.60 0.00 2.02 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 2.18 2.16 0.00 66 A 7.66 4.77 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 67 P 0.00 4.50 0.00 2.26 2.23 0.00 3.78 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 68 Q 9.07 3.90 0.00 2.26 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.88 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 69 E 8.20 3.88 0.00 1.98 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 2.29 2.41 0.00 70 V 7.76 3.88 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 0.83 0.00 0.00 1.03 0.00 0.00 71 I 7.82 3.58 1.58 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.74 0.79 0.00 0.00 72 D 7.78 4.75 0.00 2.83 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 73 E 7.91 3.96 0.00 1.96 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 2.30 2.49 0.00 74 L 7.31 3.90 0.00 1.50 1.60 -0.08 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.79 4.15 0.00 2.07 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 0.00 2.33 2.51 0.00 76 T 7.52 3.95 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 1.22 0.00 0.00 77 T 7.40 3.82 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 1.09 0.00 0.00 78 F 7.47 4.27 0.00 2.97 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 79 R 8.01 4.04 0.00 1.66 1.70 0.00 3.23 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.69 0.00 80 F 7.25 5.25 0.00 3.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 N 7.79 4.87 0.00 2.86 2.74 0.00 0.00 7.02 8.49 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 82 D 8.55 4.42 0.00 2.71 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 83 A 8.01 4.15 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 84 V 8.01 4.59 2.38 0.00 0.00 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 1.26 0.00 0.00 85 I 7.69 4.50 1.81 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 1.32 0.64 0.91 0.00 0.00 86 R 8.63 3.98 0.00 1.74 1.89 0.00 3.13 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 87 S 8.54 4.69 0.00 3.49 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 88 M 7.98 4.93 0.00 2.13 1.84 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 2.47 2.44 0.00 89 V 7.94 4.54 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 0.63 0.00 0.00 0.93 0.00 0.00 90 M 8.74 4.59 0.00 2.05 2.10 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 2.59 2.51 0.00 91 R 8.12 4.29 0.00 1.87 2.18 0.00 2.95 0.00 0.00 3.35 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 92 T 8.68 3.80 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 1.34 0.00 0.00 93 K 8.94 3.86 0.00 1.92 1.93 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.45 7.81 94 H 7.30 4.14 0.00 3.50 3.34 0.00 5.71 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.82 3.50 0.95 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 0.00 0.00 96 V 8.03 4.03 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 0.86 0.00 0.00 1.02 0.00 0.00 97 T 8.31 4.87 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 1.26 0.00 0.00 98 E 9.43 3.16 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 99 A 9.13 3.49 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 0.00 100 S 8.50 4.22 0.00 4.09 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