NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3886 8.3044 120.3495 54.8465 33.4191 174.9633 2 I 3.6610 8.3363 126.0431 61.1783 38.7962 173.2898 3 Q 4.8178 8.3138 124.3232 54.2013 33.8022 173.6911 4 S 5.2101 8.6553 116.2199 56.8287 66.4189 173.0633 5 Q 4.8397 8.9423 120.3731 54.5949 30.4204 175.7836 6 I 4.3970 8.4002 111.6009 60.0145 39.1766 174.7216 7 N 4.8410 7.8599 120.0112 51.0705 40.3978 174.4834 8 R 3.9588 8.6502 124.2386 59.5017 29.1589 178.2592 9 N 4.3899 8.7399 117.3364 55.9084 38.5266 177.3585 10 I 3.6881 7.4978 121.6976 64.5948 37.1675 178.6680 11 R 4.0295 7.9021 118.2270 58.9360 30.0373 178.9285 12 L 3.9897 8.0939 119.1258 57.6856 41.6209 179.1800 13 D 4.3322 8.3141 119.0605 57.2766 40.7144 178.4732 14 L 3.9307 7.8507 120.2168 58.0684 41.9694 178.7260 15 A 4.1080 8.2701 120.8951 55.4123 18.3203 179.2614 16 D 4.2900 8.0852 116.8787 57.4754 40.8790 178.8785 17 A 4.0067 7.9214 120.9942 55.3390 18.3987 179.7484 18 I 3.6629 7.9916 118.3816 64.6263 37.1854 178.7787 19 L 4.1776 8.2624 119.9878 57.3020 41.2908 179.3549 20 L 3.8785 8.0009 120.5096 58.1842 42.0796 178.7783 21 S 4.0331 8.1334 113.1079 61.3513 62.2763 175.7600 22 K 3.7014 8.4543 122.3571 59.6564 31.7763 178.5049 23 A 3.9103 7.9762 120.6219 55.1794 18.1566 179.5876 24 K 3.8527 8.0556 116.0203 59.4050 32.2476 178.8059 25 K 4.1884 8.1028 115.6772 55.4083 32.8489 175.9072 26 D 4.2994 7.6663 117.9924 55.0701 40.1021 173.1084 27 L 4.6858 7.7644 116.6132 53.5098 43.7296 177.5085 28 S 4.5624 8.6024 116.6339 56.9945 66.2063 175.5120 29 F 4.1644 8.3124 121.2168 60.5941 38.6855 177.5094 30 A 4.0797 8.2428 120.2364 55.4604 17.9160 179.4034 31 E 4.0185 8.0223 114.4659 59.3757 29.8812 178.9482 32 I 3.8265 7.5683 119.8881 64.2437 37.4868 177.9190 33 A 4.2684 8.3249 121.4415 53.3565 18.1815 177.1448 34 D 4.4588 7.5496 117.3632 56.2771 41.4551 176.4259 35 G 4.0989 9.1106 115.1884 45.6612 0.0000 174.2855 36 T 4.0223 7.6970 108.8763 62.3448 69.2336 176.2070 37 G 3.9422 8.3708 109.0141 45.1874 0.0000 172.8273 38 L 4.6654 7.4507 118.6931 52.3172 44.2138 176.9104 39 A 4.1621 8.2590 123.0522 51.9235 20.2244 178.3070 40 E 3.8967 8.9562 123.3798 59.6485 29.6494 179.4259 41 A 3.9312 8.0076 120.0009 55.0309 18.4609 179.2888 42 F 3.8689 8.1449 118.5711 61.4319 39.7051 177.3979 43 V 3.6076 8.0972 117.9288 66.2285 31.2479 177.9491 44 T 3.7462 8.2055 115.5324 66.6703 68.3206 176.0930 45 A 3.7956 7.7164 122.2533 55.1982 18.2611 179.4789 46 A 4.2417 7.6097 120.1466 54.8882 18.2619 179.8123 47 L 3.9957 7.6986 115.9552 57.8021 41.7542 178.9383 48 L 4.4041 7.8338 116.1971 54.6428 41.6066 177.7690 49 G 3.9047 8.0682 107.2696 45.6619 0.0000 174.3485 50 Q 4.4820 8.3008 116.8086 55.5514 29.9817 175.1325 51 Q 4.4231 7.3517 115.8862 54.0282 32.9868 172.9207 52 A 4.9225 8.3055 120.9616 50.7933 20.5809 176.8774 53 L 4.5889 8.6018 122.4067 53.2580 43.4554 175.1658 54 P 4.6442 0.0000 0.0000 62.4699 32.5031 177.1698 55 A 3.9834 8.9389 123.5447 55.8953 18.2036 180.0325 56 D 4.3145 8.0781 116.3674 57.4401 40.8853 178.7810 57 A 4.0227 7.9994 120.6570 54.9884 18.4336 179.2876 58 A 3.9672 8.3292 119.6073 55.5078 18.3713 180.1333 59 R 3.8875 8.4705 116.9509 59.1568 30.0779 179.3767 60 L 3.9720 7.9770 118.8175 58.1039 41.8707 180.0866 61 V 3.8428 8.2819 112.7080 63.9820 31.3233 178.9993 62 G 3.5923 8.3812 105.8041 47.6583 0.0000 175.5920 63 A 4.0044 8.2549 123.6355 54.9502 18.1989 179.9276 64 K 3.9833 7.9903 115.7759 58.6783 32.1659 178.5726 65 L 4.4796 7.5371 115.6352 53.0584 42.6716 175.6034 66 D 4.3490 7.6402 116.9317 55.1030 40.0762 173.5843 67 L 4.3350 7.9796 117.3210 53.9513 43.0333 177.7730 68 D 4.7181 8.2655 121.8600 52.5338 41.9723 177.3881 69 E 3.9448 8.5276 118.1311 59.8488 29.4161 179.2993 70 D 4.3554 8.0961 118.2958 57.4415 40.8464 179.0500 71 S 4.1463 8.5283 115.7899 61.5649 62.6502 176.6770 72 I 3.6988 7.5752 121.4106 64.1577 37.1398 177.9138 73 L 4.2152 8.1692 121.3216 58.3164 41.9799 178.7664 74 L 3.9835 8.2837 119.2602 58.1507 41.6059 179.6541 75 L 4.0735 8.0126 118.1750 57.1938 41.2953 178.6930 76 Q 4.7883 7.7386 117.5075 55.5466 29.4193 175.9214 77 M 4.5096 7.3548 120.3133 54.8735 33.1555 176.3944 78 I 4.0229 8.7681 124.6498 60.6958 38.0763 174.2559 79 P 4.6343 0.0000 0.0000 62.4155 32.6374 176.4481 80 L 4.3061 8.3310 123.5193 54.2613 41.4539 176.5126 81 R 4.1626 8.2969 124.8706 55.6855 30.9156 175.1135 82 G 3.0086 8.2321 107.7690 44.8854 0.0000 173.2952 83 C 4.3293 8.1319 122.3321 58.3666 30.7001 174.2518 84 I 4.0740 7.4887 122.0552 60.3873 37.6739 174.8676 85 D 4.4840 8.8642 125.5713 57.0990 41.4038 176.7770 86 D 4.6336 7.3405 116.0610 53.4191 41.6837 174.1275 87 R 4.1400 8.2588 126.8111 56.6349 29.3941 176.9239 88 I 4.0089 7.1791 116.4643 58.2730 38.9359 173.9054 89 P 4.4170 0.0000 0.0000 62.9350 31.8103 176.4893 90 T 4.1543 8.3240 111.3494 63.4484 69.9162 175.4679 91 D 4.4612 7.9871 122.3619 53.2751 42.3108 174.4727 92 P 4.3341 0.0000 0.0000 66.3242 31.1837 178.7511 93 T 3.9638 7.9783 112.7922 66.9774 68.8780 176.2723 94 M 4.5025 8.2017 120.7504 58.5285 32.0213 178.0106 95 Y 4.0709 8.8345 120.0989 60.9365 38.8897 178.3886 96 R 3.9140 8.1333 118.8424 59.3858 29.9358 179.0778 97 F 4.0565 7.8780 117.2240 60.5005 38.9206 177.0249 98 Y 3.9846 7.9706 118.7519 60.7112 38.5065 177.6695 99 E 3.6931 8.2966 120.4161 59.3329 29.6855 178.4344 100 M 4.0916 8.0628 118.8410 58.6393 31.9488 178.7699 101 L 3.9758 7.5369 118.8992 57.9198 41.5443 179.6527 102 Q 3.7680 7.4400 116.9136 58.1837 28.5869 178.3610 103 V 3.7279 7.7653 118.7871 64.8376 32.2543 176.7497 104 Y 4.6827 8.1636 113.9542 57.3517 38.5204 177.5838 105 G 3.7592 8.2673 109.4993 48.3510 0.0000 176.0482 106 T 4.0533 7.8273 111.6425 64.4250 68.9467 176.9416 107 T 3.9006 7.8866 118.3012 66.3778 68.5142 176.2752 108 L 3.9772 8.4364 121.3654 57.7059 41.6236 179.4363 109 K 3.7652 8.0880 119.0509 59.4659 32.1555 178.4527 110 A 4.0220 8.1681 121.0379 55.4210 18.3138 179.6939 111 L 4.0109 8.2186 117.6154 57.6698 41.6346 179.6809 112 V 3.8125 8.0398 118.4995 66.6317 31.2965 177.8979 113 H 5.0096 8.3187 117.2501 58.3193 28.2900 177.4955 114 E 3.9259 8.0743 120.3067 59.3857 29.6358 178.7708 115 K 3.9781 8.3923 117.4929 58.1387 32.1709 178.1457 116 F 4.1933 8.6844 115.7917 60.5816 41.4125 174.5352 117 G 3.8911 7.5660 102.9296 43.6844 0.0000 172.1449 118 D 4.6591 8.6463 119.1862 54.6810 42.3727 175.4129 119 G 4.2449 8.0329 111.1410 45.1661 0.0000 172.5468 120 I 4.7678 8.3131 114.3665 59.3665 41.8100 174.7663 121 I 4.5229 8.2303 124.2572 59.9282 37.7207 176.2270 122 G 3.8011 9.1507 115.4747 46.1102 0.0000 173.0209 123 A 4.1263 8.4681 122.8367 51.5434 19.6543 176.5744 124 I 4.2761 7.4955 114.9670 63.4364 39.4874 176.8741 125 N 4.7585 7.7991 124.2997 52.7166 37.8837 172.0953 126 F 5.4730 8.1155 123.3146 56.6863 42.7839 172.5170 127 K 4.6245 8.0076 123.4459 55.2353 36.3137 174.6615 128 L 5.4276 7.9820 120.2446 53.6199 44.1442 174.5865 129 D 4.4660 7.8574 115.2196 52.7521 42.0520 174.8379 130 V 4.7781 8.5399 120.0903 61.2230 33.8422 174.6250 131 K 4.6894 8.8409 127.2429 54.3767 35.4680 175.1024 132 K 4.7983 8.6488 125.7962 55.5458 33.4655 175.8224 133 V 4.4843 8.6546 126.6816 60.6103 34.5679 174.4474 134 A 4.3293 8.8805 129.6410 52.5057 19.1868 176.2229 135 D 4.5687 9.3927 122.0402 52.3509 41.3349 175.4769 136 P 3.6559 0.0000 0.0000 65.3424 31.4720 176.8688 137 E 4.4035 8.5111 116.4421 55.8015 29.4316 176.7814 138 G 3.8439 8.6123 106.9730 47.1457 0.0000 175.0763 139 G 3.8455 8.6683 108.6087 44.4056 0.0000 171.5315 140 E 5.0694 8.3406 116.5341 54.5342 32.5148 176.1457 141 R 4.7884 8.7653 120.4384 54.3911 33.8744 174.4209 142 A 5.0428 8.5850 123.9795 50.5564 21.0222 176.5180 143 V 4.1674 8.6416 123.2941 61.4394 33.1496 174.5254 144 I 4.8561 8.3738 129.5388 60.4644 38.6488 175.3645 145 T 4.5826 8.7373 124.2607 61.7814 70.7599 173.3739 146 L 4.8160 8.5314 126.2548 53.0910 43.8372 175.5889 147 D 4.6094 8.4712 123.2622 52.4790 43.6418 174.2193 148 G 4.6958 8.5601 111.9205 43.9722 0.0000 170.5267 149 K 4.4242 8.6927 123.0477 55.8947 33.6656 175.3376 150 Y 4.7455 8.6652 128.6110 57.4386 39.7960 174.2733 151 L 4.4589 8.5500 127.5493 51.9500 44.0416 174.2856 152 P 4.5758 0.0000 0.0000 62.8504 32.5706 176.0489 153 T 4.4614 8.6781 119.5435 62.4364 69.6225 174.2059 154 K 4.7865 8.4905 125.6050 53.4061 35.1919 174.5857 155 P 4.4347 0.0000 0.0000 62.9749 31.9386 176.6056 156 F 4.5577 8.0151 114.6362 57.1317 37.9833 174.6782 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 8.34 3.66 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 1.05 0.91 0.00 0.00 3 Q 8.31 4.82 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.56 0.00 0.00 0.00 0.00 0.00 2.51 2.27 0.00 4 S 8.66 5.21 0.00 3.81 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 5 Q 8.94 4.84 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 6 I 8.40 4.40 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 7.86 4.84 0.00 2.76 2.69 0.00 0.00 6.93 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 8.65 3.96 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 1.68 1.72 0.00 9 N 8.74 4.39 0.00 2.84 2.91 0.00 0.00 6.85 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 10 I 7.50 3.69 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 1.11 0.91 0.00 0.00 11 R 7.90 4.03 0.00 1.80 1.95 0.00 3.28 0.00 0.00 3.52 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 12 L 8.09 3.99 0.00 1.69 1.71 0.91 0.86 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 13 D 8.31 4.33 0.00 2.94 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 14 L 7.85 3.93 0.00 1.79 1.83 0.93 0.85 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 15 A 8.27 4.11 1.44 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 0.00 0.00 16 D 8.09 4.29 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 7.92 4.01 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 18 I 7.99 3.66 2.05 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 1.54 0.61 0.96 0.00 0.00 19 L 8.26 4.18 0.00 1.85 1.75 0.99 0.86 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 20 L 8.00 3.88 0.00 1.77 1.82 0.92 0.63 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 21 S 8.13 4.03 0.00 3.92 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 22 K 8.45 3.70 0.00 1.80 1.91 0.00 1.12 0.00 0.00 1.21 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.24 7.81 23 A 7.98 3.91 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 24 K 8.06 3.85 0.00 1.87 1.89 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 1.62 7.81 25 K 8.10 4.19 0.00 1.68 1.82 0.00 1.83 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.42 1.56 7.81 26 D 7.67 4.30 0.00 2.77 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 7.76 4.69 0.00 1.54 1.47 0.88 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.60 4.56 0.00 4.03 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 29 F 8.31 4.16 0.00 3.19 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 30 A 8.24 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 8.02 4.02 0.00 2.15 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 2.54 2.32 0.00 32 I 7.57 3.83 1.93 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 1.43 0.61 0.96 0.00 0.00 33 A 8.32 4.27 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 34 D 7.55 4.46 0.00 2.78 2.80 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 35 G 9.11 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 36 T 7.70 4.02 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 1.34 0.00 0.00 37 G 8.37 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 0.00 0.00 0.00 38 L 7.45 4.67 0.00 1.76 1.67 1.08 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.26 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 8.96 3.90 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 41 A 8.01 3.93 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 3.87 0.00 3.20 3.26 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 43 V 8.10 3.61 2.17 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 1.05 0.00 0.00 1.13 0.00 0.00 44 T 8.21 3.75 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 0.29 0.00 0.00 45 A 7.72 3.80 1.19 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 0.00 0.00 0.00 0.00 0.00 0.00 46 A 7.61 4.24 1.20 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 47 L 7.70 4.00 0.00 1.86 1.84 1.15 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.83 4.40 0.00 1.62 1.63 0.73 1.28 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 49 G 8.07 3.90 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 0.00 0.00 0.00 50 Q 8.30 4.48 0.00 1.95 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.66 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 51 Q 7.35 4.42 0.00 1.36 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.94 0.00 0.00 0.00 0.00 0.00 1.98 1.33 0.00 52 A 8.31 4.92 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 53 L 8.60 4.59 0.00 1.67 1.65 0.95 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 54 P 0.00 4.64 0.00 2.10 1.99 0.00 3.71 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 2.13 2.14 0.00 55 A 8.94 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 8.08 4.31 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 8.33 3.97 1.44 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 0.00 0.00 59 R 8.47 3.89 0.00 1.99 2.00 0.00 3.14 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 60 L 7.98 3.97 0.00 1.92 1.73 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.28 3.84 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 1.03 0.00 0.00 1.02 0.00 0.00 62 G 8.38 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.25 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 64 K 7.99 3.98 0.00 1.92 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.59 7.81 65 L 7.54 4.48 0.00 1.71 1.66 0.97 0.79 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 66 D 7.64 4.35 0.00 2.75 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 67 L 7.98 4.33 0.00 1.67 1.58 0.93 1.25 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 68 D 8.27 4.72 0.00 2.95 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 8.53 3.94 0.00 2.03 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 2.40 0.00 70 D 8.10 4.36 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 8.53 4.15 0.00 4.07 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 7.58 3.70 2.02 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 1.41 0.64 0.92 0.00 0.00 73 L 8.17 4.22 0.00 1.84 1.84 0.93 0.96 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 74 L 8.28 3.98 0.00 1.86 1.72 0.92 0.54 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 75 L 8.01 4.07 0.00 1.90 1.73 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.74 4.79 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.87 0.00 0.00 0.00 0.00 0.00 2.55 2.26 0.00 77 M 7.35 4.51 0.00 1.91 2.09 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 2.72 2.52 0.00 78 I 8.77 4.02 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 0.66 0.92 0.00 0.00 79 P 0.00 4.63 0.00 2.09 2.06 0.00 3.75 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 1.95 1.93 0.00 80 L 8.33 4.31 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 1.65 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.30 4.16 0.00 1.82 1.89 0.00 3.24 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 82 G 8.23 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 0.00 0.00 0.00 83 C 8.13 4.33 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 7.49 4.07 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 1.30 0.54 0.90 0.00 0.00 85 D 8.86 4.48 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 4.63 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 8.26 4.14 0.00 1.97 2.03 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 1.52 1.62 0.00 88 I 7.18 4.01 1.74 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.74 0.59 0.00 0.00 89 P 0.00 4.42 0.00 2.16 2.03 0.00 3.24 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 90 T 8.32 4.15 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 7.99 4.46 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 3.68 0.00 0.00 3.91 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 7.98 3.96 4.49 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 1.35 0.00 0.00 94 M 8.20 4.50 0.00 2.13 2.32 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 2.84 2.61 0.00 95 Y 8.83 4.07 0.00 3.18 3.18 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 96 R 8.13 3.91 0.00 1.43 1.66 0.00 3.33 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.75 0.00 97 F 7.88 4.06 0.00 3.38 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 98 Y 7.97 3.98 0.00 2.94 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 3.69 0.00 1.82 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 2.28 2.37 0.00 100 M 8.06 4.09 0.00 2.15 2.29 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.59 0.00 101 L 7.54 3.98 0.00 1.46 1.54 0.91 0.93 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 0.00 102 Q 7.44 3.77 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.87 0.00 0.00 0.00 0.00 0.00 1.65 2.35 0.00 103 V 7.77 3.73 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 0.20 0.00 0.00 0.87 0.00 0.00 104 Y 8.16 4.68 0.00 3.23 2.91 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 0.00 105 G 8.27 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 0.00 0.00 0.00 106 T 7.83 4.05 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 1.35 0.00 0.00 108 L 8.44 3.98 0.00 1.84 1.73 0.94 0.94 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 0.00 109 K 8.09 3.77 0.00 1.83 1.98 0.00 1.68 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 1.46 1.44 7.81 110 A 8.17 4.02 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 0.00 111 L 8.22 4.01 0.00 1.79 1.77 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.04 3.81 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 0.98 0.00 0.00 0.85 0.00 0.00 113 H 8.32 5.01 0.00 3.25 3.37 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 8.07 3.93 0.00 2.00 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 0.00 2.31 2.34 0.00 115 K 8.39 3.98 0.00 1.72 1.35 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.59 7.81 116 F 8.68 4.19 0.00 2.47 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 7.57 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 0.00 118 D 8.65 4.66 0.00 2.76 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 0.00 119 G 8.03 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 0.00 0.00 0.00 0.00 120 I 8.31 4.77 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 1.17 0.92 0.00 0.00 121 I 8.23 4.52 1.80 0.00 0.00 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 1.04 0.58 0.94 0.00 0.00 122 G 9.15 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 0.00 123 A 8.47 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.50 4.28 1.88 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 1.27 0.95 0.93 0.00 0.00 125 N 7.80 4.76 0.00 2.80 2.76 0.00 0.00 6.46 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 8.12 5.47 0.00 3.12 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 0.00 127 K 8.01 4.62 0.00 1.66 1.68 0.00 1.23 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.20 1.16 7.81 128 L 7.98 5.43 0.00 1.68 1.41 0.98 0.83 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 0.00 129 D 7.86 4.47 0.00 2.65 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 8.54 4.78 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 0.88 0.00 0.00 0.90 0.00 0.00 131 K 8.84 4.69 0.00 1.73 1.65 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.51 7.81 132 K 8.65 4.80 0.00 1.78 1.72 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.44 7.81 133 V 8.65 4.48 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 0.91 0.00 0.00 0.94 0.00 0.00 134 A 8.88 4.33 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 9.39 4.57 0.00 2.68 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 0.00 136 P 0.00 3.66 0.00 2.08 2.13 0.00 3.72 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 137 E 8.51 4.40 0.00 2.08 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 2.29 2.24 0.00 138 G 8.61 3.84 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 0.00 0.00 0.00 139 G 8.67 3.85 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 0.00 0.00 0.00 140 E 8.34 5.07 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 2.21 2.31 0.00 141 R 8.77 4.79 0.00 1.88 1.79 0.00 3.11 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 142 A 8.58 5.04 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 0.00 143 V 8.64 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 8.37 4.86 2.00 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 1.48 0.67 0.92 0.00 0.00 145 T 8.74 4.58 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 1.18 0.00 0.00 146 L 8.53 4.82 0.00 1.62 1.89 1.01 1.16 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 0.00 147 D 8.47 4.61 0.00 2.62 2.41 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 0.00 148 G 8.56 4.70 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 0.00 0.00 0.00 149 K 8.69 4.42 0.00 1.96 1.71 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.46 7.81 150 Y 8.67 4.75 0.00 2.75 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 0.00 151 L 8.55 4.46 0.00 1.41 1.38 0.86 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.58 0.00 2.04 1.94 0.00 3.46 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.90 0.00 153 T 8.68 4.46 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 1.31 0.00 0.00 154 K 8.49 4.79 0.00 1.76 1.74 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.43 7.81 155 P 0.00 4.43 0.00 2.03 1.95 0.00 3.66 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 2.04 2.09 0.00 156 F 8.02 4.56 0.00 3.09 2.91 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