NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -6 Q 4.3253 8.3449 119.6873 54.7412 30.1980 174.9131 -5 P 4.2069 0.0000 0.0000 61.2437 31.8773 174.0445 -4 T 4.7205 8.5031 112.3713 60.0421 72.8276 172.3660 -3 A 4.5303 8.0657 122.6364 50.9375 22.0272 176.0842 -2 A 4.5061 8.1449 123.3698 50.4282 20.8978 176.8933 -1 N 4.3874 8.2553 115.2448 53.0613 37.9437 174.3643 -4 S 4.8405 8.6631 114.4713 56.5421 66.8276 172.2660 -3 G 4.1703 8.1557 107.6364 43.5375 0.0000 173.1842 -2 E 4.5361 8.3249 119.7698 54.5282 31.6978 175.6933 -1 I 3.8174 7.8553 116.4448 61.0613 37.8437 175.5643 6 S 4.5571 8.2445 115.9788 57.7912 65.3913 174.4474 7 Y 4.1484 8.6219 122.6141 60.9023 38.5399 177.8922 8 A 3.9430 8.2427 121.1656 55.5111 18.2375 179.0892 9 D 4.3894 7.8632 115.3979 56.5317 41.2733 178.6014 10 F 4.3051 7.7148 121.6029 61.2536 39.3044 176.9898 11 E 3.2562 7.9101 117.9719 58.6406 29.3655 178.5462 12 K 4.0952 7.5906 117.8387 57.9050 32.6646 177.1344 13 V 3.4300 6.8126 120.4666 62.2672 31.4527 175.0078 14 D 4.4566 8.6851 128.9566 53.1039 41.5327 174.2180 15 I 4.7254 7.8063 126.4945 59.5145 39.3817 175.0860 16 R 5.2917 8.8532 125.7191 54.2727 34.3671 174.7552 17 V 4.8430 8.4894 120.9459 60.7386 33.7611 175.2057 18 G 3.9977 8.8841 109.4388 45.1783 0.0000 171.1451 19 T 4.9750 8.1498 116.6558 61.3081 70.9303 174.6539 20 I 4.0629 8.6608 128.3151 61.9097 37.4540 176.9735 21 V 4.4192 8.8073 120.2173 61.5449 33.7692 175.7079 22 E 4.8261 7.9354 119.7905 54.6201 33.4719 173.8685 23 A 5.1525 8.3213 125.6656 50.9849 22.2493 175.8186 24 V 4.5563 8.8424 114.8288 58.8065 36.7230 173.2149 25 P 4.5300 0.0000 0.0000 63.1744 32.3589 176.5579 26 F 4.8153 8.7340 125.2591 55.7151 38.8172 174.0035 27 P 4.3066 0.0000 0.0000 64.8697 31.5252 177.4474 28 E 4.1982 8.0955 114.4911 56.3850 30.0727 176.4459 29 A 3.4981 6.8639 122.6693 51.8949 18.9404 177.7664 30 R 3.9321 8.5016 122.5247 58.6196 30.4833 176.9025 31 K 4.6106 7.4646 114.8520 53.3389 34.5180 174.1898 32 P 4.1646 0.0000 0.0000 63.6193 31.9044 175.3865 33 A 4.9502 8.2020 122.0241 50.9216 23.3929 174.5134 34 I 4.9887 8.6778 119.2273 59.5262 40.8406 175.2265 35 K 4.4687 8.7802 126.3816 55.4812 33.6216 176.3322 36 V 4.9587 8.9704 117.1919 59.4835 36.3195 174.4590 37 K 5.0899 8.7803 121.7192 54.7536 34.9831 175.2518 38 I 4.6292 8.8652 125.6597 59.3593 40.3938 174.3006 39 D 4.6602 9.0450 127.8092 53.1921 41.7564 175.5874 40 F 4.6046 9.0263 125.8327 57.4287 40.3140 177.1374 41 G 3.9948 9.0498 106.7096 44.1033 0.0000 173.4315 42 P 4.2640 0.0000 0.0000 66.1789 31.5134 178.7004 43 E 4.1551 8.1991 114.2516 58.9202 30.0759 181.7123 44 I 3.8285 7.7661 119.3131 62.3834 37.8647 177.3420 45 G 3.8182 8.5824 108.1841 44.4242 0.0000 170.9736 46 I 4.8793 8.0713 119.2272 60.2446 38.4686 175.8062 47 K 4.9722 9.1435 125.6093 54.5433 36.2613 175.4984 48 K 4.9572 9.3702 123.0685 56.2463 34.0691 175.9293 49 S 5.2069 9.3496 117.4367 58.2519 66.6154 172.3886 50 S 5.2084 8.6277 114.7096 57.2409 66.0947 173.0250 51 A 4.6005 8.8993 120.9329 50.6096 22.7339 176.2707 52 Q 4.9202 8.3962 122.8520 54.9699 27.7072 175.6070 53 I 4.8727 7.3121 112.1523 60.6937 38.7548 178.2000 54 T 4.2606 8.1745 111.9416 64.4830 69.4897 176.0631 55 V 3.6315 7.8627 121.8194 66.2151 31.6476 176.4641 56 H 4.4631 7.7961 113.3809 56.2422 29.2287 174.3927 57 Y 4.9537 7.3396 114.6345 55.7316 41.6868 175.0805 58 T 4.8107 8.3145 110.3093 58.7933 71.7523 173.1473 59 P 4.2845 0.0000 0.0000 66.0712 31.0715 178.8462 60 E 4.3106 8.1202 116.4688 58.9361 29.6209 178.5755 61 S 4.4509 8.0642 112.7849 60.2416 63.7709 176.1037 62 L 4.2092 7.9585 123.1708 56.1201 41.2958 177.3909 63 V 3.8214 6.6500 118.5318 64.3747 31.6557 176.0242 64 G 3.9724 9.1357 116.9163 44.9054 0.0000 173.4007 65 R 4.1459 8.0171 121.4963 56.1958 31.5264 175.2853 66 Q 4.8006 8.6448 125.1188 55.5052 30.3590 175.3281 67 V 4.7431 8.7447 116.8257 59.5144 35.9220 174.2653 68 L 5.3218 8.4461 121.4204 53.3395 44.0937 176.0305 69 G 4.5092 9.1589 109.5367 44.4607 0.0000 171.6805 70 V 4.1366 8.6189 123.2028 62.5384 32.0659 176.6908 71 V 4.1256 8.3596 121.0731 60.5736 32.6733 176.3062 72 N 4.8401 7.4467 117.6384 52.2888 37.6603 174.7428 73 F 4.7973 7.7578 116.7175 56.8672 40.0373 173.9553 74 P 4.4775 0.0000 0.0000 61.8932 31.8122 174.4021 75 P 4.4974 0.0000 0.0000 63.2973 32.1641 175.5470 76 R 4.4855 8.7959 123.5623 54.4615 32.6094 174.3030 77 Q 4.4920 8.7552 128.3146 55.7250 29.9199 175.4690 78 I 4.4197 9.2894 129.5822 60.0416 38.3492 177.0444 79 G 3.7803 8.1930 118.9074 46.3591 0.0000 171.6472 80 P 4.5075 0.0000 0.0000 63.1098 31.9760 175.4584 81 F 4.6540 8.5121 123.3392 56.7361 40.2699 174.3566 82 R 4.5005 7.7840 128.6595 54.5511 29.7414 175.0244 83 S 3.9142 8.3336 121.4896 58.0518 63.1176 174.1507 84 E 4.6508 9.0248 124.9540 56.5962 31.2282 176.3557 85 V 4.6648 7.6458 117.6014 60.9866 35.3080 174.0289 86 L 4.6364 8.6092 128.7602 54.2042 43.4157 175.2963 87 T 4.8171 8.6104 123.6524 62.9937 69.6855 174.2579 88 L 4.5257 8.8977 126.8804 54.0168 43.8343 176.3139 89 G 4.3992 7.8902 107.9887 45.9726 0.0000 171.7264 90 F 5.0937 9.3116 117.0321 55.5112 43.6919 174.3716 91 A 4.7874 8.7936 124.4649 51.8495 19.2691 177.7044 92 D 4.6643 9.2407 122.9599 52.1009 41.4425 176.7684 93 A 3.9735 8.6180 120.8630 55.0785 18.2204 178.0809 94 N 4.6682 8.7549 111.2590 52.9842 39.1040 176.0662 95 G 3.9881 8.4171 107.3429 45.1245 0.0000 173.5412 96 D 4.7407 7.8881 119.4182 53.7457 42.6748 175.3722 97 I 4.7157 8.3133 122.4819 60.8158 38.3708 175.2570 98 V 4.7459 9.0705 127.4881 60.9791 33.7144 174.8601 99 L 4.6128 9.0820 128.3735 54.3325 42.1343 177.0554 100 A 4.5032 8.6313 124.8455 52.7112 19.2628 176.5468 101 A 4.6158 8.3499 121.3712 51.3463 22.4470 175.6656 102 V 4.5520 7.9021 110.7722 59.3963 34.4279 176.2551 103 E 4.1039 8.8136 123.9254 58.8638 29.7840 176.8737 104 R 4.7234 7.4451 112.1079 53.5705 32.4352 172.7565 105 P 5.1008 0.0000 0.0000 62.5431 31.8131 176.1585 106 V 4.5870 8.0822 113.5374 58.3865 35.6043 173.6611 107 P 4.3291 0.0000 0.0000 62.6665 31.3830 176.1815 108 N 4.3420 8.6269 120.1495 55.0156 38.9064 175.9900 109 G 4.2637 9.1375 111.1146 46.0065 0.0000 173.5448 110 E 4.1917 7.8697 120.0960 56.2012 30.6293 176.0456 111 K 4.7351 8.4673 124.6318 55.6447 33.5885 175.7685 112 M 4.4758 8.7493 127.8807 55.5594 33.0019 175.8994 113 C 4.5833 8.5313 119.5321 58.8540 29.5888 173.5871 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 -6 Q 8.34 4.33 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.89 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 -5 P 0.00 4.21 0.00 2.12 1.99 0.00 3.62 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 2.03 2.13 0.00 -4 T 8.50 4.72 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 -3 A 8.07 4.53 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.14 4.51 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 -1 N 8.26 4.39 0.00 2.86 2.85 0.00 0.00 5.83 7.64 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 -4 S 8.66 4.84 0.00 3.96 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 -3 G 8.16 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 0.00 0.00 0.00 0.00 -2 E 8.32 4.54 0.00 1.82 1.80 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 2.23 2.20 0.00 -1 I 7.86 3.82 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.91 0.91 0.00 0.00 6 S 8.24 4.56 0.00 4.15 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 7 Y 8.62 4.15 0.00 3.08 3.08 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 8 A 8.24 3.94 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 9 D 7.86 4.39 0.00 2.85 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 10 F 7.71 4.31 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 11 E 7.91 3.26 0.00 1.16 1.56 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 2.13 2.43 0.00 12 K 7.59 4.10 0.00 1.86 1.90 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.59 1.33 7.81 13 V 6.81 3.43 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 0.53 0.00 0.00 0.82 0.00 0.00 14 D 8.69 4.46 0.00 2.57 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 15 I 7.81 4.73 1.79 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 1.24 0.45 0.92 0.00 0.00 16 R 8.85 5.29 0.00 1.41 1.85 0.00 3.42 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.41 0.00 17 V 8.49 4.84 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 1.03 0.00 0.00 1.00 0.00 0.00 18 G 8.88 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 19 T 8.15 4.98 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 1.20 0.00 0.00 20 I 8.66 4.06 1.99 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.56 0.89 0.00 0.00 21 V 8.81 4.42 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 0.59 0.00 0.00 0.92 0.00 0.00 22 E 7.94 4.83 0.00 1.97 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 2.24 2.29 0.00 23 A 8.32 5.15 1.17 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 0.00 0.00 0.00 24 V 8.84 4.56 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 0.68 0.00 0.00 0.84 0.00 0.00 25 P 0.00 4.53 0.00 1.95 2.01 0.00 3.63 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 2.03 2.10 0.00 26 F 8.73 4.82 0.00 2.87 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 27 P 0.00 4.31 0.00 2.14 2.14 0.00 3.94 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 2.09 2.16 0.00 28 E 8.10 4.20 0.00 1.97 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 2.34 2.40 0.00 29 A 6.86 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.50 3.93 0.00 1.71 1.90 0.00 3.17 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 31 K 7.46 4.61 0.00 1.85 1.66 0.00 1.91 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.39 7.81 32 P 0.00 4.16 0.00 2.03 2.01 0.00 3.65 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 2.02 2.09 0.00 33 A 8.20 4.95 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 34 I 8.68 4.99 1.89 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.74 0.95 0.00 0.00 35 K 8.78 4.47 0.00 1.32 1.12 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.60 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.30 0.52 7.81 36 V 8.97 4.96 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 0.72 0.00 0.00 0.97 0.00 0.00 37 K 8.78 5.09 0.00 1.67 1.68 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.40 7.81 38 I 8.87 4.63 1.57 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.78 -0.11 0.00 0.00 39 D 9.04 4.66 0.00 2.61 2.47 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 40 F 9.03 4.60 0.00 3.27 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 41 G 9.05 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 42 P 0.00 4.26 0.00 2.20 2.21 0.00 3.79 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 43 E 8.20 4.16 0.00 2.01 1.89 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 2.23 1.90 0.00 44 I 7.77 3.83 2.11 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.92 0.84 0.00 0.00 45 G 8.58 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 46 I 8.07 4.88 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.64 0.92 0.00 0.00 47 K 9.14 4.97 0.00 1.96 1.78 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.58 7.81 48 K 9.37 4.96 0.00 1.61 1.86 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.40 7.81 49 S 9.35 5.21 0.00 4.01 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 50 S 8.63 5.21 0.00 4.06 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 51 A 8.90 4.60 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 52 Q 8.40 4.92 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.47 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 53 I 7.31 4.87 2.08 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.86 0.95 0.00 0.00 54 T 8.17 4.26 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 1.22 0.00 0.00 55 V 7.86 3.63 1.92 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 0.68 0.00 0.00 0.89 0.00 0.00 56 H 7.80 4.46 0.00 2.16 2.58 0.00 5.69 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Y 7.34 4.95 0.00 3.15 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 58 T 8.31 4.81 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 1.23 0.00 0.00 59 P 0.00 4.28 0.00 2.18 2.26 0.00 3.61 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 60 E 8.12 4.31 0.00 1.93 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 2.32 2.43 0.00 61 S 8.06 4.45 0.00 4.09 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 0.00 62 L 7.96 4.21 0.00 1.78 1.72 0.93 0.62 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 V 6.65 3.82 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 0.72 0.00 0.00 0.98 0.00 0.00 64 G 9.14 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 65 R 8.02 4.15 0.00 1.90 1.94 0.00 2.94 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 66 Q 8.64 4.80 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.51 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 67 V 8.74 4.74 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 0.71 0.00 0.00 0.93 0.00 0.00 68 L 8.45 5.32 0.00 1.65 1.62 1.01 0.77 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 69 G 9.16 4.51 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 0.00 70 V 8.62 4.14 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 -0.16 0.00 0.00 0.82 0.00 0.00 71 V 8.36 4.13 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 0.69 0.00 0.00 72 N 7.45 4.84 0.00 2.66 2.69 0.00 0.00 6.12 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 73 F 7.76 4.80 0.00 3.05 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 74 P 0.00 4.48 0.00 2.17 2.06 0.00 3.95 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 75 P 0.00 4.50 0.00 1.91 1.97 0.00 3.60 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 76 R 8.80 4.49 0.00 1.78 1.73 0.00 3.04 0.00 0.00 3.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 77 Q 8.76 4.49 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.63 0.00 78 I 9.29 4.42 2.34 0.00 0.00 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 1.35 1.20 1.15 0.00 0.00 79 G 8.19 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 80 P 0.00 4.51 0.00 2.30 2.26 0.00 4.14 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.08 0.00 81 F 8.51 4.65 0.00 2.84 3.20 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 82 R 7.78 4.50 0.00 1.74 1.63 0.00 3.31 0.00 0.00 3.07 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.54 0.00 83 S 8.33 3.91 0.00 3.92 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 84 E 9.02 4.65 0.00 1.97 1.94 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 2.19 2.11 0.00 85 V 7.65 4.66 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 0.88 0.00 0.00 86 L 8.61 4.64 0.00 2.12 1.80 0.99 0.74 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 87 T 8.61 4.82 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 1.22 0.00 0.00 88 L 8.90 4.53 0.00 1.70 1.51 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 89 G 7.89 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.31 5.09 0.00 2.99 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 91 A 8.79 4.79 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 92 D 9.24 4.66 0.00 2.91 2.93 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 0.00 0.00 0.00 93 A 8.62 3.97 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 94 N 8.75 4.67 0.00 2.94 2.86 0.00 0.00 7.15 8.52 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 95 G 8.42 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 96 D 7.89 4.74 0.00 2.97 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 97 I 8.31 4.72 2.13 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.81 1.01 0.00 0.00 98 V 9.07 4.75 2.26 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 1.18 0.00 0.00 1.03 0.00 0.00 99 L 9.08 4.61 0.00 1.48 1.53 0.22 0.93 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 0.00 100 A 8.63 4.50 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 0.00 101 A 8.35 4.62 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 0.00 102 V 7.90 4.55 2.21 0.00 0.00 0.00 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 1.02 0.00 0.00 103 E 8.81 4.10 0.00 1.93 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 0.00 2.30 2.25 0.00 104 R 7.45 4.72 0.00 1.91 1.83 0.00 3.10 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 105 P 0.00 5.10 0.00 2.06 2.03 0.00 3.67 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 106 V 8.08 4.59 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 0.83 0.00 0.00 0.96 0.00 0.00 107 P 0.00 4.33 0.00 2.19 1.99 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 108 N 8.63 4.34 0.00 2.76 2.93 0.00 0.00 7.34 7.94 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 0.00 109 G 9.14 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 0.00 0.00 0.00 0.00 110 E 7.87 4.19 0.00 1.93 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 2.48 2.43 0.00 111 K 8.47 4.74 0.00 1.74 1.69 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.31 1.56 7.81 112 M 8.75 4.48 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.64 0.00 113 C 8.53 4.58 0.00 3.24 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