NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.6649 8.3044 120.2866 55.3229 33.8671 174.1569 3 V 3.9739 8.7312 123.1931 59.9878 32.5414 173.3767 4 W 4.6074 9.0368 135.0000 57.0856 31.7238 174.9476 5 T 3.9619 7.8928 122.0699 61.5421 67.1609 172.2756 6 P 4.5870 0.0000 0.0000 62.9636 32.3012 175.4712 7 V 3.9924 7.4047 119.6679 62.9222 32.6667 175.3853 8 N 4.2672 8.5897 125.0033 55.0148 36.1038 173.7192 9 N 4.8327 7.5721 108.6170 52.7551 40.1298 174.2176 10 K 4.0224 8.4566 116.5846 56.7365 32.7556 176.6688 11 M 4.9332 8.3478 121.2719 53.9627 35.2190 175.4488 12 F 4.5830 8.2938 116.4634 57.0202 40.8773 175.9863 13 E 3.5308 8.1780 121.8384 56.8398 27.8015 174.7738 14 T 3.7322 8.4285 120.4841 66.7640 68.7037 173.9828 15 F 4.5203 9.0721 124.5437 57.5707 36.7313 176.4683 16 S 4.4942 8.3771 114.7130 60.2451 62.9476 174.4038 17 Y 4.4148 8.2577 117.4751 58.0176 38.2918 175.1325 18 L 4.7450 7.5980 120.2419 52.1696 43.7158 174.6120 19 P 4.4780 0.0000 0.0000 61.6555 31.8499 174.9105 20 P 4.1886 0.0000 0.0000 63.0585 31.6519 176.4305 21 L 4.2084 8.3901 123.4480 54.5781 42.2624 177.9130 22 S 4.4380 9.4667 119.2489 57.9173 65.3227 175.2010 23 D 4.3851 8.5761 121.9110 57.3298 40.5603 178.7230 24 E 3.9983 8.0680 119.7130 59.1954 29.8944 178.5320 25 Q 3.9865 7.8372 117.8106 58.6130 28.7150 178.6415 26 I 3.7923 7.9662 121.0202 64.2291 37.2092 178.1671 27 A 4.0483 8.1630 121.4723 55.0819 18.1420 179.5797 28 A 3.9834 7.8765 119.0613 55.4775 18.4717 179.9083 29 Q 4.0982 7.9558 116.2275 59.0776 28.7753 179.2091 30 V 3.7484 8.1756 119.3892 66.2054 31.6208 177.8254 31 D 4.4431 8.3812 118.6758 57.4344 40.4803 178.1344 32 Y 4.2142 8.1126 120.1406 60.7237 38.8065 178.1685 33 I 3.9359 7.8930 120.6532 64.5875 37.2975 178.5788 34 V 3.5188 7.8674 118.6461 66.0220 31.1694 177.8387 35 A 3.9052 8.2803 119.5081 54.5755 18.2080 178.3092 36 N 4.1040 7.0507 112.0345 51.8428 38.6235 175.4341 37 G 3.7989 7.4121 108.1325 46.2381 0.0000 174.2393 38 W 4.9011 7.5692 118.7974 55.9026 30.7660 176.2899 39 I 4.3611 8.8257 123.0922 59.6253 37.7641 174.0877 40 P 4.8740 0.0000 0.0000 62.9510 32.7480 175.1619 41 C 4.9719 8.6561 120.8810 58.5314 35.6085 172.4474 42 L 5.3496 8.6976 124.1457 53.1789 44.6287 175.1728 43 E 5.6386 9.1709 120.9336 54.9530 34.2190 174.5402 44 F 5.5740 9.1216 116.4122 56.1527 42.2211 172.8329 45 A 4.3845 8.1346 118.3859 50.6588 22.6206 176.3383 46 E 4.3883 8.3882 118.5683 55.7386 31.1817 177.9708 47 S 4.3656 9.0028 116.0911 62.2965 62.8868 177.0233 48 D 4.5701 8.1758 117.1523 56.2622 40.6878 177.0939 49 K 4.6406 7.9870 117.5394 56.0431 32.6665 176.9595 50 A 3.9302 7.7840 124.2854 54.0636 18.7136 178.4097 51 Y 4.7674 7.3962 111.0405 55.6745 40.4801 176.0840 52 V 4.4833 8.4931 115.2052 61.5800 32.2537 175.5800 53 S 4.7638 8.3743 115.8541 57.6128 66.2915 173.7717 54 N 5.3127 8.5775 113.8815 52.6031 39.6045 176.1160 55 E 3.9112 8.6129 119.6465 60.2422 29.1382 179.5761 56 S 3.9830 8.9853 116.0920 60.4326 62.7241 176.2288 57 A 2.5800 7.5566 123.2918 53.8033 17.7342 179.1070 58 I 3.5187 7.0096 116.4867 63.3173 38.0576 177.0392 59 R 4.3584 7.4837 116.6785 55.4730 30.5344 176.1100 60 F 5.0375 7.3543 118.3636 56.1621 41.3928 176.5433 61 G 4.0965 8.1803 114.5799 46.0906 0.0000 175.5235 62 S 4.6272 8.4331 113.7487 58.7271 62.2845 174.3576 63 V 4.4772 7.2202 106.9354 61.1989 33.0890 177.6000 64 S 4.4801 8.2510 114.4606 59.3811 63.6468 173.3770 65 C 3.9802 8.0917 119.0220 61.6322 27.9649 173.3157 66 L 3.6401 8.5121 123.9333 55.8055 38.9555 173.3978 67 Y 4.4618 7.3878 118.3023 55.8282 40.8573 174.3615 68 Y 4.8664 6.9964 122.5851 56.8300 42.3169 174.3553 69 D 4.5627 8.9250 123.5038 54.8965 42.0630 177.1174 70 N 4.4885 8.8643 116.0330 54.0908 35.9525 175.9563 71 R 4.0102 7.9081 118.7253 59.0331 30.4999 176.9718 72 Y 4.4555 7.7596 114.9903 57.6595 38.4590 174.7183 73 W 5.0468 8.7136 123.8682 55.2542 32.8735 174.5616 74 T 4.2840 8.2834 117.4387 62.6704 69.3677 174.6708 75 M 4.7097 8.5516 126.4241 55.3049 33.2819 175.1618 76 W 4.9300 9.5133 135.0000 56.0055 31.4550 176.9934 77 K 3.4112 8.5389 128.7837 57.4170 30.7681 178.2338 78 L 4.9134 8.2557 124.4265 52.7599 45.3927 173.9328 79 P 4.3127 0.0000 0.0000 63.3052 32.3731 177.5584 80 M 4.3297 8.8895 123.2102 53.7469 30.4900 176.2847 81 F 4.4823 7.2514 117.7047 59.1934 40.1173 175.8516 82 G 4.1624 9.1828 113.7393 45.5846 0.0000 173.3243 83 C 3.8247 7.5392 118.7934 60.5021 31.5412 173.4547 84 R 4.5700 8.6658 123.9077 55.5273 31.2441 174.4639 85 D 4.8108 7.8387 118.3773 51.1909 42.9098 174.4346 86 P 4.3528 0.0000 0.0000 66.3977 31.0508 178.2022 87 M 4.1581 8.5534 118.3965 58.0452 31.8028 178.7227 88 Q 3.9844 8.0659 118.5560 58.8376 28.9087 178.7693 89 V 3.5847 7.7577 118.6453 66.1983 31.4250 177.7748 90 L 4.0259 7.9589 118.5956 58.0646 41.3440 179.8917 91 R 3.9833 8.0723 117.9114 59.1419 30.0040 178.8998 92 E 4.1140 8.2035 118.4708 59.2012 29.4086 179.3034 93 I 3.5530 7.7380 120.1953 64.2231 37.1134 178.6257 94 V 3.4580 7.4118 118.6149 65.8441 31.3961 177.9167 95 A 3.9709 8.0647 120.7507 55.1881 18.1505 179.1965 96 C 2.0000 7.8926 117.5127 62.0456 31.6419 176.0182 97 T 3.6366 7.5384 111.2016 64.3563 67.9415 176.3182 98 K 3.9207 7.7273 121.9102 59.2636 32.2872 178.4022 99 A 4.0188 7.4625 120.1576 53.5830 18.3285 177.6711 100 F 4.6201 7.9469 115.9513 54.7655 39.2623 173.7965 101 P 4.4603 0.0000 0.0000 64.1617 31.7871 177.4649 102 D 4.8254 7.3417 117.8198 53.7789 41.4851 175.1479 103 A 4.8329 7.5547 116.7684 49.7090 22.9311 176.0629 104 Y 4.1787 8.7526 117.6116 57.6321 39.5052 175.2082 105 V 5.2331 8.8856 123.1144 61.1571 35.3389 174.3102 106 R 4.9768 9.4765 123.4838 54.3003 33.2104 173.5900 107 L 4.7465 8.1399 123.4575 53.8126 44.0314 175.6707 108 V 4.8373 8.6366 118.2791 59.5891 36.7031 174.0804 109 A 4.9735 8.0209 121.6151 50.6092 22.6514 175.2876 110 F 5.2735 9.0169 120.6304 55.7843 42.4718 174.3182 111 D 5.3684 8.7450 122.3597 52.6284 42.6757 176.3412 112 N 4.7914 9.1812 122.8448 53.8968 38.2854 176.1461 113 Q 4.2073 9.3103 119.2661 58.8027 29.1079 177.3589 114 K 4.1243 8.2985 113.9177 56.3398 32.9941 176.4338 115 Q 3.4747 7.6815 118.1757 55.3988 27.3867 172.4804 116 V 4.3621 6.8441 116.9145 60.1625 34.1879 173.2034 117 Q 4.4653 8.7798 123.1079 56.5659 29.2539 175.6444 118 I 4.0794 8.2278 125.3813 61.5507 39.0308 174.4569 119 M 4.4695 6.5536 117.3069 54.2904 34.1101 173.7454 120 G 4.9747 8.2696 110.7634 47.5150 0.0000 171.8037 121 F 4.9861 7.0196 114.7137 55.3278 41.0113 172.7787 122 L 4.4801 8.8659 122.9619 55.6377 41.8967 176.8068 123 V 4.4132 8.8427 118.8781 61.7226 33.8153 175.8552 124 Q 4.4674 7.7104 120.7920 54.3640 32.6276 173.1991 125 R 4.1412 8.0561 124.9861 53.2701 33.3187 172.9105 126 P 4.0489 0.0000 0.0000 62.9517 31.6939 177.6038 127 K 3.9961 8.8331 123.7744 59.3877 32.1748 178.2246 128 S 4.3123 7.9640 111.0530 59.3640 63.5694 174.3602 129 A 4.3605 7.7581 125.2799 52.7775 18.5023 177.4487 130 R 4.7091 8.5477 120.8291 56.2594 31.8307 175.4035 131 D 4.9177 8.7629 115.2790 52.6235 39.7673 175.1367 132 W 5.6093 7.6189 114.7325 54.0013 31.4619 173.9743 133 Q 4.2061 8.4188 116.8649 52.9826 31.4602 174.0883 134 P 4.6620 0.0000 0.0000 62.0110 32.2161 176.9288 135 A 4.0068 8.9472 122.2765 55.6151 18.0901 179.6345 136 N 4.5550 8.1207 110.2569 54.5960 37.6671 175.6710 137 K 4.4608 7.8596 117.9958 56.2723 32.8627 177.3855 138 R 3.6023 7.5459 120.5378 57.7429 30.1900 176.7165 139 S 5.0359 7.4327 110.2034 56.3154 66.3869 174.2281 140 V 3.9798 8.7879 114.6046 61.7103 32.0490 175.6588 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 2 M 8.30 4.66 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.73 3.97 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 0.95 0.00 0.00 0.96 0.00 0.00 4 W 9.04 4.61 0.00 3.42 3.04 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 5 T 7.89 3.96 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 0.99 0.00 0.00 6 P 0.00 4.59 0.00 2.23 2.19 0.00 3.78 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 1.93 1.95 0.00 7 V 7.40 3.99 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 0.76 0.00 0.00 0.90 0.00 0.00 8 N 8.59 4.27 0.00 2.84 2.85 0.00 0.00 6.53 6.92 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 9 N 7.57 4.83 0.00 2.62 2.69 0.00 0.00 7.29 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 10 K 8.46 4.02 0.00 2.04 1.73 0.00 0.61 0.00 0.00 1.35 0.00 0.00 2.26 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.41 1.49 7.81 11 M 8.35 4.93 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.65 0.00 12 F 8.29 4.58 0.00 3.13 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 13 E 8.18 3.53 0.00 2.17 1.81 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 2.21 2.15 0.00 14 T 8.43 3.73 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 0.04 0.00 0.00 15 F 9.07 4.52 0.00 3.27 3.12 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 0.00 0.00 0.00 0.00 16 S 8.38 4.49 0.00 4.15 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 0.00 17 Y 8.26 4.41 0.00 3.04 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 18 L 7.60 4.74 0.00 1.80 1.60 0.81 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.48 0.00 2.05 2.02 0.00 3.72 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 2.05 2.15 0.00 20 P 0.00 4.19 0.00 2.06 2.04 0.00 3.74 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 2.16 2.23 0.00 21 L 8.39 4.21 0.00 1.56 1.51 0.77 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 22 S 9.47 4.44 0.00 3.98 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 23 D 8.58 4.39 0.00 2.78 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 24 E 8.07 4.00 0.00 2.02 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 2.35 2.38 0.00 25 Q 7.84 3.99 0.00 2.14 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.60 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 26 I 7.97 3.79 2.07 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 1.60 0.95 1.09 0.00 0.00 27 A 8.16 4.05 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 28 A 7.88 3.98 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 29 Q 7.96 4.10 0.00 2.51 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.42 1.90 0.00 30 V 8.18 3.75 2.32 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 1.15 0.00 0.00 1.09 0.00 0.00 31 D 8.38 4.44 0.00 2.98 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 32 Y 8.11 4.21 0.00 3.23 3.40 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 33 I 7.89 3.94 2.16 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.89 1.08 0.00 0.00 34 V 7.87 3.52 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 1.03 0.00 0.00 0.96 0.00 0.00 35 A 8.28 3.91 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 36 N 7.05 4.10 0.00 1.44 1.42 0.00 0.00 6.99 8.90 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 37 G 7.41 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 38 W 7.57 4.90 0.00 3.38 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 39 I 8.83 4.36 2.11 0.00 0.00 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 1.47 1.06 0.76 0.00 0.00 40 P 0.00 4.87 0.00 2.08 1.98 0.00 3.81 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 41 C 8.66 4.97 0.00 3.04 2.60 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 42 L 8.70 5.35 0.00 1.86 1.60 0.86 0.82 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 43 E 9.17 5.64 0.00 2.09 2.07 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 2.37 2.31 0.00 44 F 9.12 5.57 0.00 2.93 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 45 A 8.13 4.38 -0.08 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 46 E 8.39 4.39 0.00 2.18 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 2.29 2.30 0.00 47 S 9.00 4.37 0.00 4.01 4.18 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 0.00 0.00 0.00 48 D 8.18 4.57 0.00 2.68 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 49 K 7.99 4.64 0.00 1.49 1.68 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.42 7.81 50 A 7.78 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.40 4.77 0.00 2.89 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 52 V 8.49 4.48 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 0.32 0.00 0.00 0.78 0.00 0.00 53 S 8.37 4.76 0.00 4.00 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 54 N 8.58 5.31 0.00 2.77 2.84 0.00 0.00 6.53 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 55 E 8.61 3.91 0.00 2.19 2.27 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 2.68 2.45 0.00 56 S 8.99 3.98 0.00 4.00 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 57 A 7.56 2.58 1.18 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 0.00 0.00 0.00 0.00 0.00 58 I 7.01 3.52 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 0.86 0.00 0.00 59 R 7.48 4.36 0.00 1.87 2.00 0.00 3.19 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 60 F 7.35 5.04 0.00 2.97 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.18 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.43 4.63 0.00 3.86 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 63 V 7.22 4.48 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 0.67 0.00 0.00 0.53 0.00 0.00 64 S 8.25 4.48 0.00 4.10 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 65 C 8.09 3.98 0.00 2.96 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 66 L 8.51 3.64 0.00 1.77 1.76 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.39 4.46 0.00 2.91 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 68 Y 7.00 4.87 0.00 2.82 2.71 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 69 D 8.92 4.56 0.00 2.79 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 70 N 8.86 4.49 0.00 3.05 3.23 0.00 0.00 6.98 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 71 R 7.91 4.01 0.00 1.52 1.70 0.00 3.07 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 72 Y 7.76 4.46 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 73 W 8.71 5.05 0.00 3.07 3.17 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 74 T 8.28 4.28 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 75 M 8.55 4.71 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.78 0.00 76 W 9.51 4.93 0.00 3.60 3.29 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 77 K 8.54 3.41 0.00 1.57 0.74 0.00 1.62 0.00 0.00 1.51 0.00 0.00 2.71 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.80 0.21 7.81 78 L 8.26 4.91 0.00 1.58 1.56 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.31 0.00 0.53 1.80 0.00 3.66 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 2.00 2.17 0.00 80 M 8.89 4.33 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 81 F 7.25 4.48 0.00 3.11 2.99 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 82 G 9.18 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 83 C 7.54 3.82 0.00 3.05 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 R 8.67 4.57 0.00 1.80 1.86 0.00 3.20 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.89 0.00 85 D 7.84 4.81 0.00 2.72 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 86 P 0.00 4.35 0.00 2.33 2.34 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 87 M 8.55 4.16 0.00 2.07 2.45 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.74 0.00 88 Q 8.07 3.98 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.63 0.00 89 V 7.76 3.58 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 1.09 0.00 0.00 0.97 0.00 0.00 90 L 7.96 4.03 0.00 1.76 1.73 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.07 3.98 0.00 2.18 2.01 0.00 3.14 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 92 E 8.20 4.11 0.00 2.25 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 2.59 2.65 0.00 93 I 7.74 3.55 2.00 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 1.33 0.79 0.83 0.00 0.00 94 V 7.41 3.46 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 0.97 0.00 0.00 0.98 0.00 0.00 95 A 8.06 3.97 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 96 C 7.89 2.00 0.00 1.23 2.34 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 97 T 7.54 3.64 4.10 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 0.00 0.00 0.00 1.13 0.00 0.00 98 K 7.73 3.92 0.00 1.84 1.97 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.39 7.81 99 A 7.46 4.02 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 0.00 100 F 7.95 4.62 0.00 2.77 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 0.00 101 P 0.00 4.46 0.00 2.11 2.10 0.00 3.28 0.00 0.00 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.83 0.00 102 D 7.34 4.83 0.00 2.68 2.68 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 0.00 103 A 7.55 4.83 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 0.00 104 Y 8.75 4.18 0.00 2.42 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 0.00 105 V 8.89 5.23 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 1.01 0.00 0.00 0.89 0.00 0.00 106 R 9.48 4.98 0.00 1.81 1.91 0.00 2.32 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.37 0.00 107 L 8.14 4.75 0.00 1.50 0.82 0.84 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.64 4.84 1.65 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 0.57 0.00 0.00 0.51 0.00 0.00 109 A 8.02 4.97 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 0.00 110 F 9.02 5.27 0.00 3.02 2.89 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 0.00 111 D 8.75 5.37 0.00 2.45 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 0.00 112 N 9.18 4.79 0.00 2.93 3.04 0.00 0.00 6.31 7.39 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 0.00 113 Q 9.31 4.21 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 114 K 8.30 4.12 0.00 1.75 1.86 0.00 1.97 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.46 7.81 115 Q 7.68 3.47 0.00 2.17 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.69 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 116 V 6.84 4.36 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 0.57 0.00 0.00 0.92 0.00 0.00 117 Q 8.78 4.47 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.90 0.00 0.00 0.00 0.00 0.00 2.24 2.00 0.00 118 I 8.23 4.08 1.16 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.06 -0.58 0.00 0.00 119 M 6.55 4.47 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.76 0.00 120 G 8.27 4.97 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 0.00 121 F 7.02 4.99 0.00 3.23 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 0.00 122 L 8.87 4.48 0.00 1.62 1.62 0.66 0.39 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 0.00 123 V 8.84 4.41 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 0.56 0.00 0.00 0.90 0.00 0.00 124 Q 7.71 4.47 0.00 1.96 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.87 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 125 R 8.06 4.14 0.00 1.41 1.33 0.00 2.21 0.00 0.00 2.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.24 0.00 126 P 0.00 4.05 0.00 1.91 2.01 0.00 2.28 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 127 K 8.83 4.00 0.00 1.69 1.89 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.52 7.81 128 S 7.96 4.31 0.00 4.00 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 0.00 129 A 7.76 4.36 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 0.00 130 R 8.55 4.71 0.00 1.77 1.83 0.00 3.25 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.53 0.00 131 D 8.76 4.92 0.00 2.95 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 0.00 132 W 7.62 5.61 0.00 3.67 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 0.00 133 Q 8.42 4.21 0.00 1.95 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.09 0.00 0.00 0.00 0.00 0.00 2.32 2.02 0.00 134 P 0.00 4.66 0.00 2.32 2.07 0.00 3.41 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.77 0.00 135 A 8.95 4.01 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 0.00 136 N 8.12 4.56 0.00 2.82 2.95 0.00 0.00 5.83 7.13 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 0.00 137 K 7.86 4.46 0.00 1.54 1.74 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.26 1.37 7.81 138 R 7.55 3.60 0.00 1.79 0.72 0.00 3.03 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.21 0.00 139 S 7.43 5.04 0.00 4.08 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 0.00 140 V 8.79 3.98 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 0.91 0.00 0.00