NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4790 8.3044 120.3265 56.3090 32.6858 174.9357 2 M 4.9180 8.0231 135.0000 55.5104 34.7449 172.6898 3 N 4.5059 7.6164 111.9012 53.1727 43.9707 174.6334 4 E 4.8200 7.8495 112.8108 55.6872 30.1517 173.8583 5 K 4.9398 7.7127 121.8707 55.6966 34.6943 176.4925 6 I 4.6601 8.6072 125.8159 59.2915 41.1749 174.7866 7 L 4.9367 8.4674 125.8615 53.5195 45.0973 175.6591 8 I 4.3697 8.5722 129.0840 60.4357 38.2696 175.3100 9 V 4.3842 8.1265 128.9607 61.9020 32.3045 174.2687 10 D 4.5784 8.3844 125.7349 54.4452 45.1727 175.8858 11 D 4.6231 8.3923 122.1535 54.7166 41.0221 176.8655 12 Q 4.2657 7.3813 116.3132 56.4176 28.6275 176.1903 13 Y 4.0619 8.4172 123.1234 57.6366 39.5669 173.4013 14 G 4.2380 7.5182 114.9163 46.5353 0.0000 176.4179 15 I 3.8206 7.6949 120.7709 63.3284 36.9239 178.7633 16 R 3.9296 7.7579 118.4915 58.6594 29.8297 178.3282 17 I 3.6578 7.4110 119.1663 62.8664 37.3926 178.2824 18 L 3.8852 7.5182 119.7546 57.8559 41.7882 179.2092 19 L 3.5481 7.8583 118.3020 56.8806 41.4672 179.0402 20 N 4.3378 7.5104 117.4475 56.5789 39.0564 176.6631 21 E 3.9256 8.0759 119.7825 59.4049 29.7518 179.4214 22 V 3.4339 7.5011 117.9984 66.1626 31.6381 177.6979 23 F 4.7657 7.4588 115.3863 58.8556 38.6201 177.2811 24 N 4.4610 8.1172 117.6328 56.2013 38.4579 177.5326 25 K 3.9789 7.9439 118.3638 59.5277 32.3598 178.5434 26 E 4.1732 7.8677 118.2031 58.8380 30.4846 177.2063 27 G 4.2761 7.8451 106.9714 45.9017 0.0000 173.3837 28 Y 4.5834 8.3411 114.1351 56.5683 42.7742 178.1948 29 Q 4.6209 8.7929 123.9812 55.0751 27.8110 174.8928 30 T 4.9516 8.1587 112.3139 61.0056 71.3767 174.4801 31 F 4.9876 8.9712 121.4439 55.8789 42.8927 173.9088 32 Q 5.1153 8.7486 116.2479 55.2390 32.5581 174.9951 33 A 4.2818 8.6152 121.9117 52.9579 22.6681 174.9039 34 A 4.8927 9.0233 118.7320 52.7646 23.3726 176.8413 35 N 4.5005 8.7080 112.4734 51.1461 39.1852 177.0682 36 G 3.9062 8.9455 108.0358 48.2189 0.0000 175.4564 37 L 3.9744 8.0102 120.3897 57.9063 41.6949 179.2210 38 Q 3.8771 8.4031 118.6676 59.3308 29.0749 177.8415 39 A 3.9962 8.1671 121.2177 55.6167 18.2178 179.5351 40 L 3.9024 8.0432 117.0550 57.7699 41.7386 178.7941 41 D 4.3152 7.9342 118.0001 57.8410 41.1723 178.6714 42 I 3.6564 7.8376 119.9187 64.2680 37.0878 178.6710 43 V 3.5677 7.7380 118.9332 65.6656 31.0368 177.8250 44 T 4.1221 7.6513 114.7682 64.9804 68.8126 176.2271 45 K 4.2989 7.7657 118.3998 57.6388 33.2054 177.1961 46 E 4.2218 7.7243 116.9104 56.0442 32.8991 175.8162 47 R 3.8409 7.7073 115.9350 56.4650 27.5399 174.1421 48 P 4.5019 0.0000 0.0000 62.7028 32.8738 176.8836 49 D 4.6168 8.2409 117.7752 54.8789 42.5404 175.6336 50 L 5.4552 7.7204 120.9832 52.2250 44.9597 174.9512 51 V 4.6997 8.2748 126.0180 61.0692 34.6447 173.7705 52 L 5.0391 8.6277 128.3036 53.3994 43.5775 175.3525 53 L 4.8135 8.5882 124.5803 52.9831 43.7279 175.0696 54 D 4.8052 8.3056 123.3913 53.0299 42.0207 176.7353 55 M 4.3873 8.5264 125.6207 56.5815 32.1088 177.1118 56 K 4.4630 7.9602 117.8806 56.2629 32.2161 176.6743 57 I 4.8406 7.4374 119.8151 60.0880 37.6640 175.6640 58 P 4.6020 0.0000 0.0000 60.4881 29.3884 174.1005 59 G 4.0245 7.6019 118.0956 46.4511 0.0000 171.2831 60 M 4.7073 7.5760 115.6516 53.4750 34.4462 173.2735 61 D 4.7200 8.4580 118.4621 53.4203 42.1116 178.1084 62 G 3.7099 8.6225 109.3055 46.0171 0.0000 175.5181 63 I 3.6955 7.2247 122.5303 64.8400 37.2247 177.8107 64 E 3.9517 8.1408 118.3270 59.3449 29.1411 178.9468 65 I 3.6514 7.7208 118.2860 64.6046 37.4723 177.6478 66 L 4.0878 7.8832 119.1756 58.0485 41.5393 179.5452 67 K 3.8400 7.7294 118.1678 60.0240 31.7662 179.4314 68 R 3.9390 7.6683 116.9945 59.4725 30.3121 178.5041 69 M 4.1215 8.0638 118.7536 58.1510 31.8560 178.5813 70 K 3.9606 7.9823 118.0619 60.4779 32.3594 178.6206 71 V 3.5495 7.4402 118.2172 65.8028 31.3123 177.8719 72 I 4.0894 7.4886 118.1917 63.0029 36.9675 176.5418 73 D 4.4804 7.6139 122.0761 53.1717 43.7681 176.1861 74 E 4.1340 8.8790 125.1619 58.4389 29.7403 176.9277 75 N 4.7153 7.4205 115.4340 53.1922 37.8949 175.1260 76 I 4.3210 7.4708 119.3379 60.2208 40.4159 175.0534 77 R 4.0517 8.4055 130.3264 55.9659 31.1326 176.0986 78 V 4.6575 8.2024 124.6198 61.1529 34.2600 175.0104 79 I 4.6972 8.4495 129.4154 60.4740 39.5220 174.5462 80 I 4.8998 8.1778 116.1837 59.6580 41.5731 174.5686 81 M 5.1240 8.7443 121.3302 55.0884 35.6487 173.8542 82 T 4.6879 8.6884 120.4579 60.9324 71.1482 172.1123 83 A 4.2659 8.8171 121.5066 53.7011 18.6484 177.1967 84 Y 4.6418 8.6440 122.2602 57.2631 39.0769 176.0379 85 G 4.1709 7.7440 107.1326 44.6781 0.0000 172.4776 86 E 3.8666 8.6958 129.7616 55.6112 29.4367 177.9880 87 L 4.1541 8.1869 124.9270 54.8252 38.6099 175.8786 88 D 4.5019 8.1630 123.1462 53.1877 40.1234 175.7944 89 M 3.1438 8.3962 121.6634 56.2261 30.6742 178.1745 90 I 3.9948 7.2415 118.5766 63.5446 37.4389 177.8208 91 Q 3.9719 7.9202 119.9175 59.3262 28.9800 178.0292 92 E 3.9194 8.1239 119.1193 59.1578 29.6490 178.3668 93 S 3.9979 7.8186 113.4159 61.5968 62.3261 176.2533 94 K 4.4077 7.7642 121.6441 59.6982 31.9342 178.1037 95 E 3.8555 7.4061 118.9424 59.0262 29.4499 178.8760 96 L 4.2099 7.8070 117.5111 55.5202 43.2111 177.7514 97 G 4.3716 7.3130 104.5307 44.9403 0.0000 173.7591 98 A 5.0126 7.7060 121.6183 50.3151 21.2100 176.6752 99 L 3.4549 8.0263 120.1019 59.0496 41.9824 178.9812 100 T 4.5791 7.7061 113.9595 60.8319 72.5074 172.1469 101 H 4.7285 8.2653 121.4858 54.1289 31.4940 173.4238 102 F 4.0998 8.6765 125.9617 58.2136 40.6000 172.6125 103 A 5.4079 7.8719 119.0781 53.3725 21.5563 175.7946 104 K 4.7612 8.5990 115.4827 54.1109 35.4384 174.9326 105 P 4.2437 0.0000 0.0000 62.2893 32.1023 175.6205 106 F 4.9982 7.2499 115.9300 55.4137 40.5747 174.3088 107 D 5.0148 8.5825 118.8461 52.3669 43.5895 176.4754 108 I 3.7893 8.5901 127.4522 64.1741 37.0710 178.1984 109 D 4.3136 8.1556 119.7820 57.3615 40.9284 178.1186 110 E 4.1254 8.1944 119.1062 58.8895 29.6873 178.8516 111 I 3.1924 7.6932 120.4963 64.1521 37.3246 178.5260 112 R 4.1250 7.9140 116.4414 58.7514 29.2135 178.6684 113 D 4.2581 8.1361 120.1044 57.2295 41.0082 178.3655 114 A 3.7747 7.9927 121.1466 55.0936 18.4899 179.6709 115 V 3.7209 7.8731 116.7015 66.4223 31.3994 178.4746 116 K 4.1478 7.7894 116.3311 59.1659 31.9130 178.9409 117 K 4.1540 7.7979 117.3595 58.8224 32.1404 177.6084 118 Y 4.5489 7.7163 117.1625 58.1683 38.4921 174.7166 119 L 4.5192 7.9183 124.0752 53.2823 43.6237 175.0543 120 P 4.5816 0.0000 0.0000 62.4695 32.2642 175.2298 121 L 4.5760 8.0674 121.4700 52.7494 45.2532 175.4720 122 K 3.7666 8.5365 121.8876 57.3627 32.2266 176.2475 123 S 4.5942 7.9188 116.6434 57.1363 65.8886 173.2017 124 N 4.5829 8.7663 119.7778 53.8911 38.3163 174.4546 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 4.48 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.60 0.00 2 M 8.02 4.92 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.61 0.00 3 N 7.62 4.51 0.00 2.67 2.63 0.00 0.00 6.98 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 4 E 7.85 4.82 0.00 1.99 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 2.18 2.13 0.00 5 K 7.71 4.94 0.00 1.72 1.67 0.00 1.48 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.37 1.51 7.81 6 I 8.61 4.66 1.86 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.07 0.73 0.00 0.00 7 L 8.47 4.94 0.00 1.60 1.46 0.94 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.57 4.37 1.98 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.71 0.93 0.00 0.00 9 V 8.13 4.38 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 0.91 0.00 0.00 1.01 0.00 0.00 10 D 8.38 4.58 0.00 2.82 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 11 D 8.39 4.62 0.00 2.89 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 12 Q 7.38 4.27 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.02 0.00 0.00 0.00 0.00 0.00 2.61 2.36 0.00 13 Y 8.42 4.06 0.00 2.97 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 14 G 7.52 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 15 I 7.69 3.82 1.92 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 1.88 0.78 1.06 0.00 0.00 16 R 7.76 3.93 0.00 1.32 1.81 0.00 3.26 0.00 0.00 3.29 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 17 I 7.41 3.66 1.79 0.00 0.00 1.00 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 0.22 0.90 0.00 0.00 18 L 7.52 3.89 0.00 1.85 1.71 0.90 0.64 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 19 L 7.86 3.55 0.00 1.77 1.93 0.87 0.20 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 N 7.51 4.34 0.00 2.92 2.89 0.00 0.00 7.00 7.50 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 21 E 8.08 3.93 0.00 2.09 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 2.31 2.43 0.00 22 V 7.50 3.43 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 0.67 0.00 0.00 0.72 0.00 0.00 23 F 7.46 4.77 0.00 3.34 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 24 N 8.12 4.46 0.00 2.98 2.87 0.00 0.00 7.04 7.11 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 25 K 7.94 3.98 0.00 1.74 1.90 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.50 7.81 26 E 7.87 4.17 0.00 2.41 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.51 0.00 27 G 7.85 4.28 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 0.00 28 Y 8.34 4.58 0.00 3.09 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.79 4.62 0.00 2.24 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.87 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 30 T 8.16 4.95 4.34 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 1.26 0.00 0.00 31 F 8.97 4.99 0.00 2.97 3.11 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 0.00 0.00 0.00 32 Q 8.75 5.12 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.60 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 33 A 8.62 4.28 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 34 A 9.02 4.89 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 35 N 8.71 4.50 0.00 2.89 2.98 0.00 0.00 5.80 6.93 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 36 G 8.95 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 0.00 0.00 0.00 37 L 8.01 3.97 0.00 1.75 1.75 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.40 3.88 0.00 2.46 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 39 A 8.17 4.00 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 40 L 8.04 3.90 0.00 1.86 1.70 0.91 0.72 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 41 D 7.93 4.32 0.00 2.80 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 42 I 7.84 3.66 1.82 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.55 0.65 0.00 0.00 43 V 7.74 3.57 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 0.94 0.00 0.00 0.90 0.00 0.00 44 T 7.65 4.12 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 1.19 0.00 0.00 45 K 7.77 4.30 0.00 1.86 1.88 0.00 1.25 0.00 0.00 1.60 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.53 7.81 46 E 7.72 4.22 0.00 1.77 1.66 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 1.94 1.98 0.00 47 R 7.71 3.84 0.00 1.90 1.91 0.00 3.11 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.73 0.00 48 P 0.00 4.50 0.00 2.12 1.89 0.00 3.67 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.86 0.00 49 D 8.24 4.62 0.00 2.72 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 50 L 7.72 5.46 0.00 1.66 1.37 0.88 0.80 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 51 V 8.27 4.70 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 1.02 0.00 0.00 0.88 0.00 0.00 52 L 8.63 5.04 0.00 1.68 1.55 0.90 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.59 4.81 0.00 1.60 1.54 0.90 0.57 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 54 D 8.31 4.81 0.00 2.86 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 55 M 8.53 4.39 0.00 2.07 2.15 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 2.70 2.71 0.00 56 K 7.96 4.46 0.00 2.04 1.85 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.68 7.81 57 I 7.44 4.84 1.89 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 1.26 1.10 0.93 0.00 0.00 58 P 0.00 4.60 0.00 2.19 2.10 0.00 3.86 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 59 G 7.60 4.02 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 0.00 0.00 0.00 60 M 7.58 4.71 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.51 0.00 61 D 8.46 4.72 0.00 2.73 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.62 3.71 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 0.00 0.00 0.00 63 I 7.22 3.70 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 1.53 1.32 0.91 0.00 0.00 64 E 8.14 3.95 0.00 1.97 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 2.40 2.34 0.00 65 I 7.72 3.65 2.02 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 1.63 0.46 0.90 0.00 0.00 66 L 7.88 4.09 0.00 1.82 1.69 0.87 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 67 K 7.73 3.84 0.00 1.88 1.89 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.51 7.81 68 R 7.67 3.94 0.00 1.89 1.97 0.00 3.33 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.80 0.00 69 M 8.06 4.12 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.56 0.00 70 K 7.98 3.96 0.00 1.95 2.06 0.00 1.51 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.70 1.48 7.81 71 V 7.44 3.55 2.29 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 0.79 0.00 0.00 0.94 0.00 0.00 72 I 7.49 4.09 2.02 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 1.50 0.87 0.89 0.00 0.00 73 D 7.61 4.48 0.00 2.66 2.64 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 0.00 0.00 0.00 0.00 74 E 8.88 4.13 0.00 1.94 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 2.29 2.28 0.00 75 N 7.42 4.72 0.00 2.83 2.88 0.00 0.00 6.64 7.93 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 76 I 7.47 4.32 1.86 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 1.29 0.90 0.90 0.00 0.00 77 R 8.41 4.05 0.00 1.88 1.66 0.00 3.06 0.00 0.00 3.04 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 78 V 8.20 4.66 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 0.97 0.00 0.00 0.88 0.00 0.00 79 I 8.45 4.70 1.91 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 1.23 0.66 1.21 0.00 0.00 80 I 8.18 4.90 0.94 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.70 0.81 0.00 0.00 81 M 8.74 5.12 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.56 0.00 82 T 8.69 4.69 4.34 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 0.89 0.00 0.00 83 A 8.82 4.27 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 84 Y 8.64 4.64 0.00 3.04 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 85 G 7.74 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 86 E 8.70 3.87 0.00 2.09 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 2.32 2.39 0.00 87 L 8.19 4.15 0.00 1.65 1.70 0.98 1.08 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 88 D 8.16 4.50 0.00 2.67 2.57 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 89 M 8.40 3.14 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 90 I 7.24 3.99 1.88 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.88 0.93 0.00 0.00 91 Q 7.92 3.97 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.93 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 92 E 8.12 3.92 0.00 2.05 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 2.39 2.36 0.00 93 S 7.82 4.00 0.00 3.98 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.76 4.41 0.00 1.97 2.07 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.57 1.27 7.81 95 E 7.41 3.86 0.00 2.19 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 0.00 2.33 2.53 0.00 96 L 7.81 4.21 0.00 1.84 1.68 0.91 1.02 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 97 G 7.31 4.37 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 0.00 98 A 7.71 5.01 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 99 L 8.03 3.45 0.00 1.30 0.93 -0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 100 T 7.71 4.58 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 0.69 0.00 0.00 101 H 8.27 4.73 0.00 3.06 3.03 0.00 5.81 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 F 8.68 4.10 0.00 2.96 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 0.00 103 A 7.87 5.41 1.03 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 0.00 104 K 8.60 4.76 0.00 1.78 1.69 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.27 1.27 7.81 105 P 0.00 4.24 0.00 2.09 1.90 0.00 3.84 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 1.97 1.92 0.00 106 F 7.25 5.00 0.00 3.16 3.50 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 0.00 107 D 8.58 5.01 0.00 2.88 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 0.00 108 I 8.59 3.79 1.86 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.77 0.78 0.00 0.00 109 D 8.16 4.31 0.00 2.83 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 0.00 110 E 8.19 4.13 0.00 2.19 2.20 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 2.65 2.54 0.00 111 I 7.69 3.19 1.59 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.18 0.50 0.00 0.00 112 R 7.91 4.12 0.00 2.40 2.09 0.00 2.73 0.00 0.00 3.28 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.67 0.00 113 D 8.14 4.26 0.00 3.07 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 0.00 114 A 7.99 3.77 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 0.00 0.00 0.00 0.00 0.00 115 V 7.87 3.72 2.12 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 0.61 0.00 0.00 0.89 0.00 0.00 116 K 7.79 4.15 0.00 1.93 1.93 0.00 1.98 0.00 0.00 2.03 0.00 0.00 3.13 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.88 7.81 117 K 7.80 4.15 0.00 1.67 1.59 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.62 7.81 118 Y 7.72 4.55 0.00 3.18 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 L 7.92 4.52 0.00 1.68 1.69 0.95 1.25 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 0.00 120 P 0.00 4.58 0.00 2.23 2.06 0.00 3.83 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 121 L 8.07 4.58 0.00 1.65 1.40 0.66 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 122 K 8.54 3.77 0.00 1.72 1.76 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.70 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.42 7.81 123 S 7.92 4.59 0.00 3.93 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 0.00 124 N 8.77 4.58 0.00 2.92 2.80 0.00 0.00 6.80 7.58 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