NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5609 8.3049 120.2810 55.3432 33.3278 174.3904 2 I 4.2527 8.4880 125.4629 57.9462 38.8174 173.5578 3 Q 4.5159 9.6335 123.1396 54.1167 32.3531 173.6477 4 P 3.8446 0.0000 0.0000 66.0214 31.7626 176.8828 5 Q 4.2783 7.7940 119.2984 56.8879 29.7609 176.3381 6 T 4.1004 8.1346 115.6637 65.0758 69.4068 172.9877 7 Y 4.5648 8.8085 124.1093 57.5284 39.2605 174.8722 8 L 5.0147 8.4851 122.8524 52.8153 45.6701 175.9533 9 E 4.6050 9.3303 124.0507 56.0328 31.4074 175.1782 10 V 4.6057 7.8523 123.3469 61.3155 32.1518 175.6269 11 A 3.7438 8.2334 131.7374 53.7784 18.9432 176.9354 12 D 4.4625 7.4102 114.7057 52.4223 41.6128 175.5122 13 N 5.0163 7.8477 112.9469 53.2957 37.2179 176.8127 14 T 3.9821 7.9759 115.7345 65.7087 68.7309 175.4207 15 G 3.6858 8.2766 110.2957 45.3142 0.0000 174.1444 16 A 4.4194 7.5237 120.7819 52.2888 19.3856 176.5544 17 R 4.5939 8.7083 118.1515 57.1636 33.3198 176.4302 18 K 5.1411 7.7869 116.4754 54.6243 37.0789 175.6143 19 I 4.8491 8.3420 116.4799 58.3100 41.0087 174.0406 20 M 4.3385 8.0708 127.0061 54.9492 33.2388 175.0919 21 C 4.4327 9.2167 126.9172 60.2369 32.0457 172.9029 22 I 4.4263 8.3143 122.6883 62.4973 39.6753 176.2881 23 R 4.5025 7.4598 117.8898 55.2701 33.3209 173.9143 24 V 4.2186 8.4363 125.8560 60.8634 32.5833 175.2628 25 L 4.2720 8.2912 128.6005 53.7646 42.0948 175.1089 26 K 4.1667 8.3675 133.8934 56.0691 36.9128 177.0081 27 G 3.9233 8.5152 108.7303 44.8370 0.0000 173.5849 28 S 3.9354 8.4995 113.6383 60.9571 63.1767 174.9426 29 N 4.9112 7.4619 118.3685 50.9045 37.0504 174.6275 30 A 4.1385 7.9122 120.2644 53.5911 19.6196 177.8321 31 K 4.0189 8.5750 119.4210 57.7603 33.2801 175.7265 32 Y 5.1548 7.3838 112.3682 56.6530 42.3792 174.8637 33 A 4.4754 8.4836 120.8582 52.3145 22.3021 176.5040 34 T 4.5084 8.4701 118.3072 60.8256 70.3464 173.7659 35 V 3.6071 8.3571 121.1829 64.9189 31.6115 176.4038 36 G 4.0407 8.6023 114.1259 45.1631 0.0000 173.2438 37 D 4.8478 7.6495 119.6612 53.6390 42.8342 176.2173 38 V 4.8164 8.2648 114.7867 60.4651 34.2419 174.9391 39 I 4.9695 8.9163 115.8739 59.5065 41.4711 174.1775 40 V 4.3725 8.6522 124.1294 63.0372 32.9270 174.7163 41 A 4.9204 9.1165 126.9316 50.9906 23.1076 175.1794 42 S 4.6310 8.6149 117.0323 57.3377 64.3390 173.3872 43 V 3.8107 8.0508 126.3534 62.9984 31.6532 176.3269 44 K 4.5135 8.4052 127.6308 57.0924 33.1911 176.3419 45 E 5.0300 7.7765 115.5255 55.9666 32.2373 174.2488 46 A 4.8561 8.2388 120.4369 50.8513 21.7661 176.0372 47 I 3.8581 8.7052 120.6290 60.1859 39.3722 173.9259 48 P 4.2537 0.0000 0.0000 64.3895 31.6507 176.2755 49 R 3.6691 8.7247 116.8646 56.8238 28.4323 176.4697 50 G 3.8374 7.4074 106.3623 46.0813 0.0000 174.1454 51 A 4.1251 8.4390 121.2068 54.0925 18.5863 178.2116 52 V 4.4060 7.2252 113.8722 61.0302 34.7388 174.7865 53 K 4.5849 9.1499 125.5181 53.9971 34.6275 175.5502 54 E 4.2516 8.3948 119.3979 58.0980 29.6965 178.1623 55 G 3.9426 8.9873 110.7285 45.8241 0.0000 173.2300 56 D 4.4150 7.6179 118.6991 54.3573 41.2612 176.0665 57 V 4.0177 8.2352 124.2545 63.2129 32.2979 175.5234 58 V 4.6072 9.0000 119.9048 59.8412 36.7539 173.9867 59 K 4.9846 8.5536 121.5731 55.4955 34.1605 175.6145 60 A 5.1189 9.1809 125.3153 50.6082 23.8363 174.9222 61 V 4.6653 8.3043 117.7309 59.5668 34.6107 175.8411 62 V 4.1043 8.5354 124.6853 63.6622 32.3534 176.6553 63 V 4.3978 8.7824 116.2138 61.2360 35.2564 175.5428 64 R 4.5605 7.5999 117.8034 54.6697 34.8018 174.2384 65 T 4.9010 8.8676 110.7387 60.1352 72.0824 174.7849 66 K 3.9890 8.5228 123.4553 59.0296 32.5420 177.6237 67 K 4.1648 7.9180 120.4015 55.3778 32.5809 175.9662 68 E 4.2676 8.6877 124.8218 56.7451 30.4001 176.1810 69 V 4.3007 8.4993 122.4999 61.2200 33.4162 175.1019 70 K 4.2595 8.6937 127.6489 56.5237 32.7030 176.5124 71 R 4.7143 8.7331 123.9867 53.7229 31.8130 175.0789 72 P 4.3651 0.0000 0.0000 65.8481 31.7271 177.1757 73 D 4.3823 8.0517 117.6329 53.4442 39.3742 178.1248 74 G 4.0264 8.0754 112.0251 46.7558 0.0000 174.5821 75 S 4.4031 7.7180 113.9676 58.9754 63.7494 172.5304 76 A 5.0051 7.9602 122.1677 51.8722 22.2003 175.1654 77 I 4.1969 7.8923 116.2409 60.3764 41.3318 173.0555 78 R 4.6101 8.0206 127.3369 55.1740 33.1594 174.3094 79 F 4.8613 8.3228 124.5859 56.4491 41.0374 175.1488 80 D 4.6819 8.9573 117.8852 56.0531 41.2987 176.0008 81 D 4.7697 7.7203 116.2839 52.3342 42.7873 174.3105 82 N 5.1246 8.7204 116.5243 52.2378 40.1659 174.3444 83 A 5.2379 8.6346 124.3328 50.6846 23.6120 173.9408 84 A 4.8335 8.4848 119.6173 51.1710 23.8418 175.2514 85 V 4.4832 8.2184 118.1912 60.9470 34.6176 175.0643 86 I 4.4113 8.3498 129.5397 61.4261 38.0105 175.1660 87 I 5.0323 8.5721 119.6070 58.8916 40.7455 174.8183 88 N 4.6627 9.2288 122.1520 52.9635 39.5355 175.8240 89 N 4.4896 8.5162 118.4053 55.4243 38.6817 175.9549 90 Q 4.1478 8.1871 117.6565 55.8758 29.3632 175.0177 91 L 3.8967 8.4194 115.7705 56.9436 39.6726 174.1017 92 E 4.8390 7.8487 116.0533 53.3217 33.2232 173.9177 93 P 5.0888 0.0000 0.0000 62.4973 31.6410 177.6469 94 R 3.8938 8.7538 121.4819 57.8350 30.2133 176.0957 95 G 4.3316 7.3106 105.5650 43.7330 0.0000 174.3595 96 T 4.4419 8.1002 110.7640 61.0833 67.8165 177.9962 97 R 3.8915 9.2794 126.4934 57.1316 31.0002 173.9811 98 V 4.3750 8.3690 127.5567 59.6687 31.6817 175.7238 99 F 4.4258 8.2026 122.3351 57.3500 38.8864 174.5380 100 G 3.9962 8.7830 111.0975 44.9991 0.0000 171.7314 101 P 4.7244 0.0000 0.0000 63.0308 32.6633 175.1842 102 V 4.6210 8.4932 112.8761 59.9384 36.6195 174.7331 103 A 5.0373 8.0884 122.4750 50.7491 19.9803 179.2047 104 R 4.0989 8.6859 117.7987 58.8746 29.9883 179.2379 105 E 4.0200 8.2907 118.4169 59.3202 29.3103 178.9205 106 L 4.1904 7.7234 117.5096 57.4204 41.4238 179.5926 107 R 3.9828 8.1258 119.2858 59.3244 29.8652 177.5731 108 E 4.4545 7.6846 114.4866 56.7304 29.4240 177.2984 109 K 4.3666 7.7125 117.6907 55.6351 33.6163 176.7724 110 G 3.6722 8.2300 106.4420 46.7162 0.0000 174.3472 111 F 4.9973 7.5615 117.1048 56.7610 40.3940 177.4235 112 M 4.3701 8.1760 118.5860 58.2314 31.0842 176.9948 113 K 3.9920 8.1227 120.5696 59.2572 32.3186 178.7023 114 I 3.8629 8.3485 120.5741 64.5278 37.0150 178.7650 115 V 3.7877 7.8172 111.4399 64.1386 31.4057 178.4078 116 S 4.2853 7.9751 113.5020 61.6898 62.9704 176.4680 117 L 4.1805 7.4108 120.1657 55.6121 41.5610 177.8021 118 A 4.1178 7.9852 123.0957 51.4963 18.8469 175.5086 119 P 4.2767 0.0000 0.0000 65.4987 31.9341 176.7149 120 E 4.3514 7.8682 125.5002 53.3442 29.6257 175.3707 121 V 4.1206 7.6389 131.6586 61.5668 29.3693 175.1901 122 L 4.2798 7.8737 128.1962 55.4375 42.1082 177.3078 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 4.56 0.00 1.87 2.10 0.00 0.00 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 2 I 8.49 4.25 2.09 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.68 0.93 0.00 0.00 3 Q 9.63 4.52 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.51 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 4 P 0.00 3.84 0.00 2.09 2.04 0.00 3.88 0.00 0.00 3.54 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 5 Q 7.79 4.28 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 6 T 8.13 4.10 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 1.27 0.00 0.00 7 Y 8.81 4.56 0.00 2.75 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 8 L 8.49 5.01 0.00 1.55 1.46 0.93 0.64 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 9 E 9.33 4.61 0.00 2.04 1.75 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 2.30 2.29 0.00 10 V 7.85 4.61 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 0.80 0.00 0.00 0.87 0.00 0.00 11 A 8.23 3.74 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 7.41 4.46 0.00 2.71 2.58 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 13 N 7.85 5.02 0.00 3.07 3.29 0.00 0.00 7.44 7.10 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 14 T 7.98 3.98 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 1.19 0.00 0.00 15 G 8.28 3.69 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 0.00 16 A 7.52 4.42 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 17 R 8.71 4.59 0.00 1.78 2.00 0.00 3.28 0.00 0.00 3.21 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 18 K 7.79 5.14 0.00 1.66 1.60 0.00 1.77 0.00 0.00 2.16 0.00 0.00 3.17 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.63 1.47 7.81 19 I 8.34 4.85 1.82 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.85 0.82 0.00 0.00 20 M 8.07 4.34 0.00 1.91 1.50 0.00 0.00 0.00 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.51 0.00 21 C 9.22 4.43 0.00 2.97 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 22 I 8.31 4.43 1.87 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 1.07 1.04 0.89 0.00 0.00 23 R 7.46 4.50 0.00 1.86 1.68 0.00 3.19 0.00 0.00 3.37 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 24 V 8.44 4.22 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 0.70 0.00 0.00 1.01 0.00 0.00 25 L 8.29 4.27 0.00 1.70 1.74 0.93 0.69 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 26 K 8.37 4.17 0.00 1.70 1.00 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 1.35 7.81 27 G 8.52 3.92 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 0.00 0.00 0.00 28 S 8.50 3.94 0.00 3.98 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 29 N 7.46 4.91 0.00 2.73 2.83 0.00 0.00 6.93 7.14 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 30 A 7.91 4.14 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 31 K 8.57 4.02 0.00 1.58 0.77 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.09 1.30 7.81 32 Y 7.38 5.15 0.00 2.79 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.48 4.48 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 34 T 8.47 4.51 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 35 V 8.36 3.61 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 0.89 0.00 0.00 1.05 0.00 0.00 36 G 8.60 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 0.00 0.00 0.00 37 D 7.65 4.85 0.00 2.71 2.61 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 0.00 38 V 8.26 4.82 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.98 0.00 0.00 39 I 8.92 4.97 2.00 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 0.86 0.90 0.00 0.00 40 V 8.65 4.37 2.06 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 0.75 0.00 0.00 0.92 0.00 0.00 41 A 9.12 4.92 1.14 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 0.00 0.00 42 S 8.61 4.63 0.00 3.90 3.66 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 43 V 8.05 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 0.94 0.00 0.00 0.94 0.00 0.00 44 K 8.41 4.51 0.00 1.43 1.83 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.05 7.81 45 E 7.78 5.03 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 46 A 8.24 4.86 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 I 8.71 3.86 1.97 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 1.24 1.21 0.92 0.00 0.00 48 P 0.00 4.25 0.00 2.08 1.99 0.00 3.88 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 2.04 2.10 0.00 49 R 8.72 3.67 0.00 1.99 2.03 0.00 3.04 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 50 G 7.41 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 51 A 8.44 4.13 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 52 V 7.23 4.41 2.06 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 0.91 0.00 0.00 0.92 0.00 0.00 53 K 9.15 4.58 0.00 1.81 1.69 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.41 7.81 54 E 8.39 4.25 0.00 1.95 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 55 G 8.99 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 56 D 7.62 4.41 0.00 2.76 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 57 V 8.24 4.02 2.06 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 0.75 0.00 0.00 0.98 0.00 0.00 58 V 9.00 4.61 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 0.67 0.00 0.00 0.94 0.00 0.00 59 K 8.55 4.98 0.00 1.70 1.70 0.00 1.64 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.42 7.81 60 A 9.18 5.12 1.11 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 0.00 0.00 61 V 8.30 4.67 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 0.26 0.00 0.00 0.50 0.00 0.00 62 V 8.54 4.10 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 0.89 0.00 0.00 0.96 0.00 0.00 63 V 8.78 4.40 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 0.62 0.00 0.00 0.76 0.00 0.00 64 R 7.60 4.56 0.00 1.29 0.93 0.00 2.36 0.00 0.00 2.45 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 65 T 8.87 4.90 4.31 0.00 0.00 0.00 0.00 0.00 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 66 K 8.52 3.99 0.00 2.03 1.90 0.00 1.87 0.00 0.00 1.79 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.44 7.81 67 K 7.92 4.16 0.00 1.72 1.76 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.36 1.45 7.81 68 E 8.69 4.27 0.00 2.04 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 69 V 8.50 4.30 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 0.97 0.00 0.00 0.98 0.00 0.00 70 K 8.69 4.26 0.00 1.67 1.71 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.45 7.81 71 R 8.73 4.71 0.00 1.82 1.88 0.00 3.33 0.00 0.00 3.30 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 72 P 0.00 4.37 0.00 2.21 2.31 0.00 3.69 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 2.07 1.96 0.00 73 D 8.05 4.38 0.00 2.92 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 74 G 8.08 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 75 S 7.72 4.40 0.00 3.91 3.96 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 76 A 7.96 5.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 I 7.89 4.20 1.75 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.40 0.77 0.00 0.00 78 R 8.02 4.61 0.00 1.71 1.61 0.00 3.33 0.00 0.00 3.45 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.79 0.00 79 F 8.32 4.86 0.00 3.14 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 80 D 8.96 4.68 0.00 2.73 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 81 D 7.72 4.77 0.00 2.65 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 82 N 8.72 5.12 0.00 2.76 2.79 0.00 0.00 6.42 7.38 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 83 A 8.63 5.24 1.07 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 0.00 0.00 84 A 8.48 4.83 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.22 4.48 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 1.00 0.00 0.00 0.78 0.00 0.00 86 I 8.35 4.41 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.66 0.93 0.00 0.00 87 I 8.57 5.03 1.90 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.74 0.91 0.00 0.00 88 N 9.23 4.66 0.00 2.81 2.74 0.00 0.00 7.52 7.36 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 89 N 8.52 4.49 0.00 2.74 2.87 0.00 0.00 6.89 7.69 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 90 Q 8.19 4.15 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 91 L 8.42 3.90 0.00 1.83 1.90 1.16 1.10 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 92 E 7.85 4.84 0.00 2.00 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 2.32 2.45 0.00 93 P 0.00 5.09 0.00 2.40 2.17 0.00 3.90 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 94 R 8.75 3.89 0.00 1.81 2.03 0.00 3.13 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 95 G 7.31 4.33 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 0.00 96 T 8.10 4.44 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 97 R 9.28 3.89 0.00 1.97 2.00 0.00 3.18 0.00 0.00 3.45 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.76 0.00 98 V 8.37 4.38 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 0.78 0.00 0.00 0.77 0.00 0.00 99 F 8.20 4.43 0.00 3.20 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.78 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.72 0.00 2.08 2.21 0.00 3.64 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 102 V 8.49 4.62 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.95 0.00 0.00 103 A 8.09 5.04 1.52 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 0.00 0.00 104 R 8.69 4.10 0.00 1.90 2.02 0.00 3.16 0.00 0.00 3.36 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.74 0.00 105 E 8.29 4.02 0.00 2.11 2.06 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 2.44 2.50 0.00 106 L 7.72 4.19 0.00 1.85 1.86 1.03 0.67 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 0.00 107 R 8.13 3.98 0.00 1.96 2.01 0.00 3.11 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 108 E 7.68 4.45 0.00 1.99 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 2.36 2.37 0.00 109 K 7.71 4.37 0.00 2.11 2.01 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.65 1.66 7.81 110 G 8.23 3.67 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 0.00 0.00 0.00 111 F 7.56 5.00 0.00 3.15 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 0.00 112 M 8.18 4.37 0.00 2.25 2.35 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 2.60 0.00 113 K 8.12 3.99 0.00 1.87 1.90 0.00 1.75 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.50 7.81 114 I 8.35 3.86 2.10 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 1.60 0.73 0.87 0.00 0.00 115 V 7.82 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 0.85 0.00 0.00 1.02 0.00 0.00 116 S 7.98 4.29 0.00 4.05 4.06 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 0.00 117 L 7.41 4.18 0.00 1.86 1.79 0.98 0.83 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 0.00 118 A 7.99 4.12 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.28 0.00 2.23 2.23 0.00 3.77 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 2.02 0.00 120 E 7.87 4.35 0.00 2.14 1.93 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 2.35 2.40 0.00 121 V 7.64 4.12 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 0.83 0.00 0.00 1.02 0.00 0.00 122 L 7.87 4.28 0.00 2.01 1.60 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00