NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3902 8.3044 120.3494 54.8537 33.4157 174.9473 2 I 3.6546 8.3548 126.2426 61.0138 38.8368 173.2771 3 Q 4.8838 8.3548 124.9133 54.1915 33.6188 173.8477 4 S 5.1376 8.5418 115.7462 56.9678 66.4139 173.1318 5 Q 4.8008 8.9654 120.6984 54.7118 30.3051 175.7687 6 I 4.4412 8.3883 111.6159 60.0606 38.7458 174.6921 7 N 4.8884 7.8456 120.2671 51.0672 40.8909 174.7904 8 R 4.0240 8.6076 123.5616 59.2427 29.4293 178.3618 9 N 4.3617 8.9122 117.8106 55.8940 38.3769 177.3136 10 I 3.6804 7.3992 120.7166 64.6530 37.2222 178.7263 11 R 4.0066 7.8950 118.1710 59.0240 29.9227 179.0220 12 L 4.0091 8.1676 119.2005 57.6398 41.7025 179.0737 13 D 4.3475 8.5061 119.4400 57.1755 40.7595 178.4491 14 L 3.9204 7.9347 120.5942 58.1421 42.0024 178.7413 15 A 4.1430 8.2005 120.7594 55.5153 18.2769 179.3594 16 D 4.2847 8.1676 117.0060 57.4557 40.8896 178.9339 17 A 4.0050 7.9757 121.0494 55.0786 18.3224 179.6249 18 I 3.6576 8.2543 118.7431 64.7385 37.2495 178.7090 19 L 4.0666 8.2156 119.8338 57.4525 41.2770 179.4674 20 L 3.9170 7.9600 120.5056 58.1354 42.1017 178.7760 21 S 4.0381 8.1056 113.1310 61.3170 62.2713 175.9253 22 K 3.7819 8.4121 122.3765 59.5819 31.8687 178.6157 23 A 3.9534 7.9502 120.8869 55.0611 18.0945 179.7259 24 K 3.9291 8.1377 116.3568 59.2103 32.2302 178.8535 25 K 4.1805 8.0548 115.8692 55.4447 32.9024 175.9022 26 D 4.2879 7.6511 118.0743 55.0416 40.0891 173.1172 27 L 4.6769 7.7654 116.7299 53.7430 43.6561 177.3991 28 S 4.6386 8.7232 116.2491 56.7817 66.4242 175.4273 29 F 4.1489 8.2836 121.4902 60.6385 38.6606 177.6123 30 A 4.0819 8.1979 120.1931 55.3665 17.9855 179.3261 31 E 4.0632 8.2013 114.4967 59.1996 29.9305 178.9246 32 I 3.8286 7.6746 120.1583 64.1785 37.5494 177.7574 33 A 4.2404 8.2555 120.7599 52.8602 18.4343 176.9946 34 D 4.4293 7.2640 117.4562 55.8714 41.5811 176.6868 35 G 3.9882 9.0541 114.6571 45.5781 0.0000 173.7391 36 T 4.0402 7.8762 113.5368 62.1160 67.7658 176.2489 37 G 3.8778 8.3060 107.4588 45.5875 0.0000 172.8336 38 L 4.7389 7.0446 118.5610 51.9328 44.7355 176.9524 39 A 4.1648 8.2789 122.6610 52.0607 20.2261 178.4809 40 E 3.9117 8.8993 123.0449 59.5073 29.7436 179.4267 41 A 3.9203 7.9567 120.2512 54.9160 18.5017 179.2793 42 F 3.8646 8.1406 118.6804 61.4420 39.6853 177.3920 43 V 3.6226 8.0937 117.9282 66.2531 31.3247 178.0903 44 T 3.7902 8.1504 115.3628 66.5693 68.2574 176.2030 45 A 3.8247 7.7918 122.3940 55.1928 18.2934 179.4834 46 A 4.1354 7.5140 120.1607 54.8311 18.2519 179.6636 47 L 3.9987 7.6802 115.9847 57.8373 41.7572 178.9085 48 L 4.5112 7.6201 116.0294 54.4028 41.6599 177.5289 49 G 3.8917 8.0046 106.7514 45.7756 0.0000 174.4601 50 Q 4.5031 8.1840 116.3423 55.4866 29.7914 175.1131 51 Q 4.4194 7.4054 115.9192 54.4824 32.9173 172.5804 52 A 4.9539 8.2697 120.9340 50.5066 20.9594 176.5255 53 L 4.6421 8.6297 122.0401 53.0862 43.5710 175.1137 54 P 4.5183 0.0000 0.0000 62.5183 32.4964 177.2843 55 A 3.9831 8.8082 123.3771 55.6745 18.3048 179.9517 56 D 4.3190 8.1100 116.5905 57.4683 40.8856 178.7789 57 A 4.0241 8.0011 120.6270 54.9157 18.5100 179.1903 58 A 3.9693 8.2158 119.4529 55.6240 18.4345 180.1850 59 R 3.9111 8.1211 116.4368 59.0286 30.1472 179.0902 60 L 3.9324 8.0442 120.1386 58.4419 42.2144 179.5468 61 V 3.7928 8.2787 112.8735 64.2422 31.3459 178.8721 62 G 3.6018 8.3253 105.4985 47.5257 0.0000 175.6492 63 A 3.9924 8.1692 123.1300 55.0841 18.2631 179.9387 64 K 3.9720 7.8385 115.4319 58.8637 32.1906 178.5787 65 L 4.4187 7.7209 116.1943 53.3198 42.5068 175.8528 66 D 4.4088 7.6802 117.3413 55.2010 38.8433 173.9974 67 L 4.3093 8.0834 118.2834 54.0000 42.8827 177.7977 68 D 4.6861 8.3067 122.2414 52.9202 41.8274 177.3734 69 E 3.9942 8.5500 118.5033 59.5724 29.3621 179.2658 70 D 4.3848 8.0508 118.5362 57.4504 40.9505 178.8566 71 S 4.1463 8.5613 115.7095 61.6736 62.6145 176.7743 72 I 3.7376 7.5508 121.4751 64.1266 37.0353 178.0320 73 L 4.2402 8.0738 121.1355 58.2808 42.0269 178.7099 74 L 3.9508 8.2710 119.3524 58.2024 41.5508 179.6584 75 L 4.1100 8.1265 118.1014 57.1618 41.2898 178.7645 76 Q 4.6391 7.8193 117.8626 55.7317 29.4238 176.0017 77 M 4.4973 7.2685 120.0810 54.8933 33.0964 176.4646 78 I 4.0004 8.7898 124.6987 60.8081 38.0918 174.3181 79 P 4.6815 0.0000 0.0000 62.3032 32.7999 176.1581 80 L 4.3354 8.2964 123.1655 54.1201 41.6841 176.4635 81 R 4.2142 8.4304 125.3248 55.7112 30.9573 175.1333 82 G 3.0014 7.9163 107.2919 44.9845 0.0000 173.3337 83 C 4.3082 8.1056 122.1495 58.5518 30.6889 174.3123 84 I 4.1078 7.4349 122.0821 60.2876 37.7208 174.9469 85 D 4.4501 8.8638 125.4887 57.1250 41.6462 176.5137 86 D 4.6425 7.3406 114.9898 53.2104 41.5172 174.0530 87 R 4.2315 8.1636 127.1082 56.6548 29.3463 177.1769 88 I 4.0077 7.1825 116.4708 58.2376 38.9696 173.8762 89 P 4.3980 0.0000 0.0000 63.0231 31.7861 176.5144 90 T 4.1441 8.3583 111.6777 63.5512 69.8621 175.4691 91 D 4.4976 7.9715 122.2465 53.1608 42.5079 174.5904 92 P 4.3292 0.0000 0.0000 66.1713 31.1992 178.7082 93 T 3.9481 8.0094 112.8403 67.1436 68.6413 176.1119 94 M 4.4909 8.1967 120.6471 58.4479 31.9752 178.0993 95 Y 4.0491 8.8941 120.1902 60.8584 38.9493 178.0417 96 Q 3.9806 8.3085 118.9300 59.2321 28.4838 179.2855 97 F 4.1299 7.8886 118.7491 60.5649 38.8789 177.0688 98 Y 3.9769 7.9705 118.7974 60.6347 38.5269 177.6356 99 E 3.6467 8.0951 120.6412 59.2764 29.6219 178.4762 100 M 4.0803 8.0064 118.8471 58.6069 31.9645 178.7629 101 L 4.0123 7.4531 118.6936 57.7104 41.5786 179.4573 102 Q 3.7755 7.5496 117.3568 58.3922 28.5791 178.6151 103 V 3.6829 7.6655 118.5082 65.1129 32.1605 176.8475 104 Y 4.7009 8.0611 114.1501 57.4733 38.3752 177.6445 105 G 3.7241 8.2352 109.3265 48.2944 0.0000 176.0716 106 T 4.0629 7.8332 111.6141 64.3462 69.0326 176.9664 107 T 3.8999 7.8874 118.4053 66.3977 68.5131 176.2101 108 L 3.9661 8.3828 121.3780 57.7481 41.7249 179.3459 109 K 3.7351 8.0765 119.0097 59.5438 32.1319 178.4888 110 A 4.0225 8.1123 120.7671 55.3963 18.2895 179.7034 111 L 4.0353 8.4581 117.8647 57.5551 41.6153 179.8640 112 V 3.7957 8.1520 118.7761 66.4940 31.3891 177.8027 113 H 4.8801 8.1242 117.1936 58.3678 28.2975 177.5105 114 E 3.9153 8.0904 120.0773 59.3677 29.6373 178.7469 115 K 3.9529 8.2219 117.4115 58.0411 32.1356 177.2700 116 F 4.1109 9.0072 114.7511 59.8205 41.2397 175.5880 117 G 4.1346 7.8920 105.0502 43.2326 0.0000 171.7259 118 D 4.6375 8.5909 119.6046 54.7719 42.4687 174.8920 119 G 4.2231 7.9797 111.8996 45.1674 0.0000 172.6592 120 I 4.7909 8.5305 116.3957 59.3080 41.8277 174.8295 121 I 4.5719 8.1469 123.9852 60.1292 38.2722 175.6784 122 S 4.2878 9.1361 123.5020 58.1167 63.1446 174.4439 123 A 3.6036 8.6004 128.4650 52.6745 18.9015 177.3373 124 I 4.2252 7.7623 115.9695 63.0689 38.6931 176.9297 125 N 4.7772 7.7806 123.0515 52.1503 37.7724 172.0321 126 F 5.4497 8.0552 122.6915 56.6045 42.7598 172.5152 127 K 4.5706 8.2370 123.8389 55.1381 36.2805 174.7834 128 L 5.6516 8.2157 119.9606 53.3871 43.9486 174.8546 129 D 4.7880 8.3454 117.7153 52.0526 43.2526 173.8502 130 V 4.8289 8.3497 119.4459 61.1823 33.6876 174.6673 131 K 4.6950 8.9608 127.2507 54.4086 35.3790 175.0060 132 K 4.8943 8.6398 125.6055 55.3940 33.5599 175.7673 133 V 4.5899 8.7110 126.3157 60.6273 35.1169 174.4309 134 A 4.3561 8.6893 129.0089 52.0905 19.3672 176.3749 135 D 4.5669 8.9119 122.5064 52.3954 41.8088 175.6778 136 P 4.4758 0.0000 0.0000 65.6267 31.2512 176.8915 137 E 4.1595 8.3789 116.7251 55.9370 29.7831 176.4836 138 G 4.0329 8.8507 108.7959 45.8519 0.0000 175.4704 139 G 3.8618 9.3350 109.1656 44.0810 0.0000 171.5895 140 E 5.1559 8.3523 117.4467 54.7203 33.6569 175.4676 141 R 4.8196 9.3259 120.4163 54.3900 34.2956 174.2376 142 A 5.0334 8.5590 123.0072 50.4277 21.1708 176.4942 143 V 4.1652 8.8919 123.5605 61.4646 33.2460 174.5176 144 I 4.8126 8.3646 129.5601 60.1352 38.7752 175.3884 145 T 4.4945 8.6455 124.8528 61.9821 70.2893 173.7240 146 L 4.7629 8.5268 126.8461 53.2108 43.5512 175.6782 147 D 4.6915 8.7303 123.8956 52.3801 43.4289 174.2891 148 G 4.7232 8.4657 111.9068 42.6612 0.0000 170.7791 149 K 4.3088 8.9005 124.6890 56.1486 33.5927 175.3193 150 Y 4.7043 8.6243 128.6906 57.5104 39.7004 174.3309 151 L 4.4420 8.5917 127.8369 51.9649 43.8776 174.3123 152 P 4.5674 0.0000 0.0000 62.8829 32.5499 176.0369 153 T 4.4845 8.7173 119.6328 62.3929 69.6751 174.1743 154 K 4.6940 8.4868 125.5922 53.5314 35.2244 174.5289 155 P 4.5318 0.0000 0.0000 62.9272 32.0480 176.6413 156 F 4.5029 7.8239 113.6738 57.4692 37.5397 174.1961 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 4.39 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.35 3.65 1.88 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 1.42 1.06 0.91 0.00 0.00 3 Q 8.35 4.88 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.50 2.26 0.00 4 S 8.54 5.14 0.00 3.80 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 5 Q 8.97 4.80 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 6 I 8.39 4.44 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 0.66 0.91 0.00 0.00 7 N 7.85 4.89 0.00 2.76 2.67 0.00 0.00 6.94 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 8 R 8.61 4.02 0.00 2.06 2.31 0.00 3.13 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 9 N 8.91 4.36 0.00 2.83 2.91 0.00 0.00 6.85 6.83 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 10 I 7.40 3.68 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 1.52 0.93 0.91 0.00 0.00 11 R 7.89 4.01 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.45 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.17 4.01 0.00 1.68 1.70 0.91 0.86 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 13 D 8.51 4.35 0.00 2.91 2.72 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 0.00 0.00 0.00 0.00 14 L 7.93 3.92 0.00 1.78 1.88 0.92 1.17 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 15 A 8.20 4.14 1.41 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 16 D 8.17 4.28 0.00 2.91 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 17 A 7.98 4.00 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 18 I 8.25 3.66 2.06 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 1.53 0.74 0.95 0.00 0.00 19 L 8.22 4.07 0.00 1.86 1.75 0.99 0.90 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 20 L 7.96 3.92 0.00 1.78 1.81 0.92 0.88 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 21 S 8.11 4.04 0.00 3.93 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 22 K 8.41 3.78 0.00 1.80 1.91 0.00 1.13 0.00 0.00 1.18 0.00 0.00 2.14 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.23 7.81 23 A 7.95 3.95 1.35 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 0.00 0.00 24 K 8.14 3.93 0.00 1.87 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.59 7.81 25 K 8.05 4.18 0.00 1.69 1.82 0.00 1.83 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.60 7.81 26 D 7.65 4.29 0.00 2.76 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 27 L 7.77 4.68 0.00 1.54 1.44 0.94 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.72 4.64 0.00 4.00 3.93 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 29 F 8.28 4.15 0.00 3.21 3.14 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 30 A 8.20 4.08 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 31 E 8.20 4.06 0.00 2.13 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 2.53 2.32 0.00 32 I 7.67 3.83 1.92 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 1.42 0.63 0.95 0.00 0.00 33 A 8.26 4.24 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 34 D 7.26 4.43 0.00 2.76 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 35 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 36 T 7.88 4.04 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 37 G 8.31 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 38 L 7.04 4.74 0.00 1.84 1.64 1.02 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.28 4.16 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 40 E 8.90 3.91 0.00 2.08 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 2.44 2.47 0.00 41 A 7.96 3.92 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 42 F 8.14 3.86 0.00 3.20 3.23 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 43 V 8.09 3.62 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 1.05 0.00 0.00 1.11 0.00 0.00 44 T 8.15 3.79 4.05 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 0.41 0.00 0.00 45 A 7.79 3.82 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 46 A 7.51 4.14 1.22 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 0.00 0.00 0.00 47 L 7.68 4.00 0.00 1.86 1.85 1.15 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.62 4.51 0.00 1.55 1.63 0.74 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.00 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 0.00 0.00 0.00 50 Q 8.18 4.50 0.00 1.88 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.43 6.62 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 51 Q 7.41 4.42 0.00 1.39 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.89 0.00 0.00 0.00 0.00 0.00 2.03 1.46 0.00 52 A 8.27 4.95 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 53 L 8.63 4.64 0.00 1.65 1.65 0.95 0.98 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 54 P 0.00 4.52 0.00 2.10 1.99 0.00 3.72 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 55 A 8.81 3.98 1.33 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 0.00 0.00 0.00 56 D 8.11 4.32 0.00 2.71 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 57 A 8.00 4.02 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 58 A 8.22 3.97 1.41 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 59 R 8.12 3.91 0.00 2.03 1.99 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 60 L 8.04 3.93 0.00 1.92 1.82 0.93 0.85 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 61 V 8.28 3.79 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 0.72 0.00 0.00 1.03 0.00 0.00 62 G 8.33 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 63 A 8.17 3.99 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.84 3.97 0.00 1.92 1.88 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.70 7.81 65 L 7.72 4.42 0.00 1.72 1.69 0.96 1.09 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 66 D 7.68 4.41 0.00 2.83 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 67 L 8.08 4.31 0.00 1.61 1.59 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.31 4.69 0.00 2.94 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 69 E 8.55 3.99 0.00 2.00 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 2.34 0.00 70 D 8.05 4.38 0.00 2.72 2.72 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 0.00 0.00 0.00 0.00 71 S 8.56 4.15 0.00 4.03 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 72 I 7.55 3.74 2.00 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 1.57 0.55 0.99 0.00 0.00 73 L 8.07 4.24 0.00 1.89 1.86 0.93 0.48 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 74 L 8.27 3.95 0.00 1.86 1.73 0.92 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.13 4.11 0.00 1.87 1.73 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.82 4.64 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.87 0.00 0.00 0.00 0.00 0.00 2.54 2.26 0.00 77 M 7.27 4.50 0.00 1.92 2.12 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 2.86 2.53 0.00 78 I 8.79 4.00 1.88 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 1.31 0.78 0.92 0.00 0.00 79 P 0.00 4.68 0.00 2.11 2.04 0.00 3.75 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 1.96 1.93 0.00 80 L 8.30 4.34 0.00 1.67 1.65 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.43 4.21 0.00 1.82 1.88 0.00 3.24 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 82 G 7.92 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 0.00 0.00 0.00 83 C 8.11 4.31 0.00 3.06 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 84 I 7.43 4.11 1.85 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 1.29 0.55 0.92 0.00 0.00 85 D 8.86 4.45 0.00 2.62 2.69 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 0.00 0.00 0.00 86 D 7.34 4.64 0.00 2.60 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.16 4.23 0.00 1.98 2.05 0.00 3.21 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 88 I 7.18 4.01 1.75 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.74 0.65 0.00 0.00 89 P 0.00 4.40 0.00 2.19 2.05 0.00 3.36 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 90 T 8.36 4.14 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 1.19 0.00 0.00 91 D 7.97 4.50 0.00 2.85 2.65 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 92 P 0.00 4.33 0.00 2.23 2.13 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 93 T 8.01 3.95 4.48 0.00 0.00 0.00 0.00 0.00 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 94 M 8.20 4.49 0.00 2.11 2.21 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 2.69 2.59 0.00 95 Y 8.89 4.05 0.00 3.17 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 96 Q 8.31 3.98 0.00 1.85 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 97 F 7.89 4.13 0.00 3.28 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 98 Y 7.97 3.98 0.00 2.95 2.65 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 99 E 8.10 3.65 0.00 1.87 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 2.28 2.35 0.00 100 M 8.01 4.08 0.00 2.16 2.33 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.60 0.00 101 L 7.45 4.01 0.00 1.50 1.55 0.91 0.94 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 0.00 102 Q 7.55 3.78 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.90 0.00 0.00 0.00 0.00 0.00 1.64 2.35 0.00 103 V 7.67 3.68 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 0.23 0.00 0.00 0.89 0.00 0.00 104 Y 8.06 4.70 0.00 3.23 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 0.00 105 G 8.24 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 7.83 4.06 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 1.20 0.00 0.00 107 T 7.89 3.90 4.61 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 1.34 0.00 0.00 108 L 8.38 3.97 0.00 1.85 1.73 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.08 3.74 0.00 1.82 1.99 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.44 7.81 110 A 8.11 4.02 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.46 4.04 0.00 1.76 1.76 0.94 0.85 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 0.00 112 V 8.15 3.80 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 0.97 0.00 0.00 0.96 0.00 0.00 113 H 8.12 4.88 0.00 3.26 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.09 3.92 0.00 1.99 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 2.29 2.33 0.00 115 K 8.22 3.95 0.00 1.66 1.21 0.00 1.73 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.50 7.81 116 F 9.01 4.11 0.00 2.33 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 0.00 117 G 7.89 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 0.00 118 D 8.59 4.64 0.00 2.75 2.81 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 0.00 119 G 7.98 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 0.00 0.00 0.00 0.00 120 I 8.53 4.79 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.24 0.92 0.00 0.00 121 I 8.15 4.57 1.81 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.63 0.94 0.00 0.00 122 S 9.14 4.29 0.00 3.85 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 0.00 123 A 8.60 3.60 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 0.00 124 I 7.76 4.23 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.92 0.93 0.00 0.00 125 N 7.78 4.78 0.00 2.79 2.75 0.00 0.00 6.50 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 0.00 126 F 8.06 5.45 0.00 3.07 2.92 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 0.00 0.00 0.00 0.00 127 K 8.24 4.57 0.00 1.63 1.67 0.00 1.22 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.13 1.15 7.81 128 L 8.22 5.65 0.00 1.69 1.32 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.35 4.79 0.00 2.66 2.69 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 0.00 0.00 0.00 130 V 8.35 4.83 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 0.88 0.00 0.00 0.91 0.00 0.00 131 K 8.96 4.70 0.00 1.72 1.65 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.52 7.81 132 K 8.64 4.89 0.00 1.78 1.72 0.00 1.73 0.00 0.00 1.64 0.00 0.00 3.11 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.44 7.81 133 V 8.71 4.59 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 0.71 0.00 0.00 0.94 0.00 0.00 134 A 8.69 4.36 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 0.00 135 D 8.91 4.57 0.00 2.72 2.72 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 0.00 0.00 0.00 0.00 136 P 0.00 4.48 0.00 2.22 2.18 0.00 3.81 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 137 E 8.38 4.16 0.00 2.13 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 2.33 2.25 0.00 138 G 8.85 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 0.00 0.00 0.00 139 G 9.33 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 0.00 140 E 8.35 5.16 0.00 1.82 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 2.21 2.32 0.00 141 R 9.33 4.82 0.00 1.67 1.78 0.00 3.24 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 142 A 8.56 5.03 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 0.00 143 V 8.89 4.17 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 0.96 0.00 0.00 0.94 0.00 0.00 144 I 8.36 4.81 2.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.81 0.93 0.00 0.00 145 T 8.65 4.49 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 1.18 0.00 0.00 146 L 8.53 4.76 0.00 1.64 1.93 1.01 1.17 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 0.00 147 D 8.73 4.69 0.00 2.60 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.47 4.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 K 8.90 4.31 0.00 1.92 1.70 0.00 1.56 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.45 7.81 150 Y 8.62 4.70 0.00 2.56 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 0.00 151 L 8.59 4.44 0.00 1.44 1.40 0.87 0.64 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 0.00 152 P 0.00 4.57 0.00 2.03 1.91 0.00 3.47 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 153 T 8.72 4.48 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 1.28 0.00 0.00 154 K 8.49 4.69 0.00 1.76 1.74 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.45 7.81 155 P 0.00 4.53 0.00 2.03 1.94 0.00 3.72 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 156 F 7.82 4.50 0.00 3.05 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