NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3537 8.1627 120.6014 55.4528 33.9924 173.4891 2 V 4.3718 8.4033 126.5298 61.3073 32.8790 173.2176 3 I 4.5941 8.9116 130.0447 60.0554 39.3672 175.6871 4 T 5.0004 8.5737 115.9765 60.9096 70.8130 174.2003 5 K 4.9291 7.7211 120.1826 54.9502 36.2382 175.6468 6 I 4.0286 8.2610 123.2787 61.6957 37.6665 176.3227 7 V 4.2702 8.3003 116.4188 60.6628 32.8017 175.5523 8 G 4.0106 7.4842 106.8520 47.2173 0.0000 171.2112 9 H 5.2696 8.5255 118.1059 55.1037 32.9344 173.7848 10 I 4.0811 8.5142 127.8521 60.9124 36.5250 175.4108 11 D 4.5650 8.6643 126.4110 56.0050 41.6714 176.5343 12 D 4.5361 7.7488 118.2346 52.2987 42.9235 174.8815 13 L 4.1183 8.8308 130.3509 58.0903 42.3311 179.3347 14 S 4.2372 8.0549 112.0320 61.2357 62.9386 174.6869 15 H 4.4916 8.1745 115.6105 56.0712 28.8475 175.3476 16 Q 4.1447 7.9177 120.7977 55.8310 28.7615 176.0903 17 I 4.2048 8.3002 115.4254 60.8603 38.8579 175.5167 18 K 4.5824 7.5433 120.0546 54.5997 34.2334 176.3968 19 K 4.1370 8.4556 122.2743 56.5473 33.3139 176.1351 20 V 4.2474 8.1505 123.9556 61.3240 33.3200 174.8780 21 D 4.7087 8.9383 128.9126 52.2484 41.5708 174.7767 22 W 4.7444 8.5705 125.2364 56.4282 30.7810 175.1367 23 L 4.7677 9.3667 127.2343 53.5325 42.2527 174.1737 24 E 4.6787 8.6553 125.1413 55.9752 30.4940 176.3813 25 V 4.6197 8.7750 117.2480 59.3241 36.2034 174.9187 26 E 4.7171 9.8564 121.3588 55.1908 30.7231 177.8607 27 W 4.5539 9.0578 130.7237 60.9776 30.7126 178.2148 28 E 4.0282 8.2540 115.8335 59.1046 29.3828 177.8590 29 D 4.5571 8.3954 118.7091 56.2658 41.1934 176.6745 30 L 4.4391 7.6189 119.1585 55.8970 42.0225 177.3619 31 N 4.5214 9.4160 119.2147 53.9316 39.5845 174.6075 32 K 4.3956 7.6896 116.5676 57.1694 33.2620 177.4785 33 R 4.9624 8.7481 118.1964 55.8303 33.0212 175.7119 34 I 5.1535 7.3450 111.2218 59.0590 40.6125 174.6668 35 L 4.4296 8.4275 122.7850 54.5922 46.2679 173.0426 36 R 5.0623 8.5065 124.6526 54.8418 32.8578 173.7605 37 K 4.5456 8.9150 125.7574 55.6761 36.4168 173.8586 38 E 5.0718 8.5913 123.6157 55.4122 31.5457 176.6416 39 T 4.4051 8.5961 113.6972 60.8249 70.0543 175.3492 40 E 3.9792 8.9591 122.0125 59.9192 29.3908 178.4906 41 N 4.5892 8.8219 113.2564 53.4408 38.5150 175.8488 42 G 3.9937 8.5505 106.9330 45.4128 0.0000 173.4491 43 T 4.2500 8.0634 117.6429 62.3464 69.6893 173.7176 44 D 4.7207 8.7563 127.2149 54.3249 42.1449 175.1411 45 I 4.7162 8.7167 126.6900 59.3851 40.5638 174.3697 46 A 5.0250 9.0106 129.2123 50.3524 21.2326 174.8077 47 I 4.6268 9.2173 124.4810 60.8923 39.1990 176.1645 48 K 5.0979 9.1487 126.8370 54.4443 33.6008 174.3906 49 L 4.5175 8.8044 122.8420 54.9676 42.7602 177.4504 50 E 4.4524 8.8199 124.5599 57.0705 32.4025 176.0670 51 N 3.8655 8.4991 119.0110 56.0473 37.4687 175.0113 52 S 4.7109 8.6002 120.4132 58.7541 63.5526 174.7267 53 G 3.8888 7.4159 108.7343 46.7569 0.0000 173.5518 54 T 4.8143 8.0837 110.2971 59.4595 71.8862 173.5229 55 L 4.1028 9.2122 126.2442 55.7914 42.8341 176.5592 56 R 5.0944 9.0985 121.9035 53.9601 34.1663 174.7724 57 Y 4.2148 8.7919 123.0070 59.3581 39.4250 176.6615 58 G 4.0964 9.2490 116.1937 45.0603 0.0000 172.9089 59 D 4.9216 8.0505 120.7809 54.7072 42.0827 175.5952 60 V 4.3515 8.9014 123.9108 62.1591 32.4066 176.2951 61 L 4.4001 8.9426 128.0740 56.7039 43.0338 176.3258 62 Y 4.8705 7.5129 117.1576 56.5130 42.2970 173.0511 63 E 4.7014 7.6629 125.2906 54.5536 32.7053 174.5476 64 S 4.6578 8.4197 122.1375 56.1830 65.8701 173.3149 65 D 4.4300 8.7292 119.2018 57.1436 40.7198 176.9814 66 D 4.9940 8.0133 115.0846 53.1709 41.1677 175.6088 67 T 5.1555 8.0217 114.9394 62.2366 73.5795 172.7543 68 L 5.0346 8.6982 122.8311 53.0940 46.2557 175.4342 69 I 5.1780 9.0679 123.8664 58.9670 39.3664 174.7123 70 A 5.0887 8.0451 127.1260 50.2329 23.3719 174.3572 71 I 4.9351 8.6282 120.6468 60.6185 38.8722 175.5304 72 R 4.0612 8.4837 121.8707 54.6437 32.9140 174.5342 73 T 4.9710 8.2997 110.9309 60.7553 70.7336 174.4112 74 K 4.2476 8.6683 122.0053 56.6512 34.3119 175.6597 75 L 4.3820 8.3080 124.1713 54.7884 42.7253 175.5271 76 E 4.8408 9.2005 123.7323 54.0588 34.1143 174.4276 77 K 4.5136 8.4788 121.6314 56.7647 33.4616 176.0800 78 V 5.1634 8.8282 119.5239 60.6787 37.2048 172.6973 79 Y 5.3130 8.9544 118.8819 56.6848 40.7942 175.7411 80 V 4.4844 9.2746 125.4023 61.3620 32.5774 173.6541 81 I 4.4709 8.8062 128.9780 60.5581 38.5799 175.2996 82 K 4.6662 9.1384 127.1981 53.3156 32.6301 173.6860 83 P 4.5558 0.0000 0.0000 62.7593 32.1066 177.4014 84 Q 4.2721 8.7707 120.0112 57.1511 29.5401 175.9250 85 T 4.7617 7.3905 107.2542 59.2656 73.3772 174.4876 86 M 4.1062 8.4035 119.8964 58.4301 31.9176 178.8272 87 Q 3.9643 7.9828 119.4325 59.1051 29.2574 177.8979 88 E 3.9801 8.5328 120.0753 59.4723 29.4161 178.9272 89 M 4.1179 8.1767 118.4069 58.6120 32.3470 178.5413 90 G 3.6176 8.2352 105.8292 47.8405 0.0000 175.8941 91 K 4.0672 8.1542 121.2724 59.1988 32.0590 179.2893 92 M 4.0219 8.3834 118.4629 58.6262 32.1567 178.1018 93 A 4.0285 8.3468 121.2951 55.0473 18.4427 179.2800 94 F 3.9837 8.4104 119.1223 61.6530 39.3690 177.2817 95 E 3.9169 8.2818 117.7756 59.3936 29.2055 179.5032 96 I 3.7989 7.8527 120.1195 64.2035 37.0821 178.7009 97 G 3.5196 8.2324 106.8799 47.7908 0.0000 175.2952 98 N 4.0100 7.8951 118.5825 55.6205 38.9324 176.1286 99 R 4.1954 7.2117 117.1425 55.2013 30.6361 175.6895 100 H 4.1647 7.8823 115.1917 57.0045 26.9040 174.6790 101 T 4.3104 7.6209 115.8228 62.2529 69.2224 175.3890 102 M 3.1691 8.1311 126.5663 55.6608 32.3859 174.9082 103 C 5.1596 7.8484 115.2779 57.9371 33.0210 172.7805 104 I 4.8051 8.8875 119.2896 59.7435 40.4678 175.0171 105 I 4.8332 8.7304 128.3339 59.7694 38.1786 174.9792 106 E 4.5295 8.6300 126.4411 54.9065 32.3870 177.3554 107 D 4.4264 9.1323 126.7907 55.3678 40.3752 173.7368 108 D 4.9534 9.3640 110.7529 52.7211 40.2824 175.4184 109 E 4.9834 8.2301 118.9254 55.0294 33.3075 175.0318 110 I 4.6769 8.7967 123.3317 59.6629 40.0701 174.2047 111 L 5.0616 9.0032 130.5032 53.5198 43.8815 175.6761 112 V 5.1147 8.4241 118.2772 59.4720 36.4755 175.1944 113 R 4.5274 8.7686 121.3996 56.1739 30.9075 176.0837 114 Y 3.4259 8.4861 124.4331 57.8796 39.5080 175.6697 115 D 4.1987 7.8133 125.8472 52.0694 42.6068 175.1092 116 K 4.0066 8.7607 130.7880 58.9543 31.8718 178.0356 117 T 3.8962 7.9436 108.7851 63.8749 68.7216 175.5593 118 L 4.1457 8.0199 121.9749 56.4188 41.7452 178.5206 119 E 3.4605 7.9990 119.8012 59.1740 29.3395 179.3258 120 K 3.8794 7.9142 118.1563 59.9084 32.4932 178.7666 121 L 3.8664 7.6461 120.9180 57.9684 42.1203 178.8603 122 I 3.5736 7.7302 120.0805 64.3307 36.3715 178.2407 123 D 4.3561 8.2291 120.0740 57.1621 40.4205 178.1819 124 E 3.9285 8.1742 119.2806 59.5525 29.6901 178.9705 125 V 3.7771 7.8062 116.8747 63.5487 31.7626 175.8253 126 G 3.7818 8.1211 106.0604 45.6497 0.0000 173.2436 127 V 4.3733 7.5629 117.5376 60.5435 33.8004 175.0944 128 S 4.6222 8.4250 122.0971 58.9320 63.8826 172.7066 129 Y 5.4507 8.1407 120.8111 56.2953 41.0422 173.3415 130 E 4.6846 9.0159 116.5211 55.0159 33.4197 173.9426 131 Q 4.9632 8.7477 122.6184 56.3700 30.5057 174.8732 132 S 4.5586 8.5803 118.4508 57.9653 66.5476 172.0567 133 E 5.0996 8.6817 118.2296 54.9064 31.9466 175.8412 134 R 4.5941 8.8364 122.0332 54.7929 35.4407 173.8809 135 R 4.9645 7.9653 119.0188 53.6506 32.1860 176.3013 136 F 3.8016 8.6881 122.7176 57.2131 38.9388 175.4716 137 K 4.3964 8.3791 124.1516 55.9911 32.7018 176.0884 138 E 4.8949 7.8923 118.2123 53.4188 33.0347 173.7941 139 P 4.6118 0.0000 0.0000 62.6159 32.0924 175.7311 140 F 4.3253 8.4423 123.2402 57.5461 39.3537 175.3253 141 K 3.9951 7.8145 128.5859 55.5732 31.1662 177.0407 142 Y 3.9039 8.0049 122.9717 57.3888 36.1613 176.4940 143 R 4.0936 7.8256 121.9957 56.1861 30.2723 176.7525 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 8.16 4.35 0.00 2.00 1.83 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 2.38 2.44 0.00 2 V 8.40 4.37 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 0.82 0.00 0.00 0.92 0.00 0.00 3 I 8.91 4.59 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 1.28 0.89 0.96 0.00 0.00 4 T 8.57 5.00 4.35 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 1.22 0.00 0.00 5 K 7.72 4.93 0.00 1.73 1.71 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.47 7.81 6 I 8.26 4.03 1.91 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 1.45 0.91 1.07 0.00 0.00 7 V 8.30 4.27 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 0.73 0.00 0.00 0.94 0.00 0.00 8 G 7.48 4.01 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 9 H 8.53 5.27 0.00 3.15 3.19 0.00 5.92 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.51 4.08 1.94 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.70 1.04 0.00 0.00 11 D 8.66 4.56 0.00 2.70 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 12 D 7.75 4.54 0.00 2.60 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 13 L 8.83 4.12 0.00 1.94 1.78 1.17 1.12 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 14 S 8.05 4.24 0.00 4.07 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 15 H 8.17 4.49 0.00 3.31 3.42 0.00 5.85 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 7.92 4.14 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.75 0.00 0.00 0.00 0.00 0.00 2.61 2.42 0.00 17 I 8.30 4.20 1.85 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 1.39 0.57 0.90 0.00 0.00 18 K 7.54 4.58 0.00 1.57 1.73 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.39 7.81 19 K 8.46 4.14 0.00 1.75 1.68 0.00 1.51 0.00 0.00 1.55 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.41 7.81 20 V 8.15 4.25 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 0.59 0.00 0.00 21 D 8.94 4.71 0.00 2.74 2.49 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 0.00 22 W 8.57 4.74 0.00 3.43 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 9.37 4.77 0.00 1.76 1.63 1.02 1.00 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 24 E 8.66 4.68 0.00 1.93 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 2.28 2.39 0.00 25 V 8.78 4.62 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 0.88 0.00 0.00 1.01 0.00 0.00 26 E 9.86 4.72 0.00 2.15 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 0.00 2.36 2.43 0.00 27 W 9.06 4.55 0.00 3.23 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.25 4.03 0.00 2.00 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 2.28 2.29 0.00 29 D 8.40 4.56 0.00 2.96 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 30 L 7.62 4.44 0.00 1.96 1.78 1.26 1.30 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 31 N 9.42 4.52 0.00 2.87 3.04 0.00 0.00 7.19 6.61 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 32 K 7.69 4.40 0.00 2.12 1.75 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.45 7.81 33 R 8.75 4.96 0.00 1.73 1.93 0.00 3.07 0.00 0.00 3.40 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.60 0.00 34 I 7.35 5.15 1.88 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 1.24 0.67 0.92 0.00 0.00 35 L 8.43 4.43 0.00 1.71 1.50 0.96 0.65 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 36 R 8.51 5.06 0.00 1.80 1.74 0.00 3.33 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.78 0.00 37 K 8.91 4.55 0.00 1.87 1.60 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.42 7.81 38 E 8.59 5.07 0.00 1.97 1.85 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 2.36 2.30 0.00 39 T 8.60 4.41 4.54 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 40 E 8.96 3.98 0.00 2.17 2.14 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 2.45 2.76 0.00 41 N 8.82 4.59 0.00 2.93 2.85 0.00 0.00 7.23 7.21 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 42 G 8.55 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.06 4.25 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 1.14 0.00 0.00 44 D 8.76 4.72 0.00 2.66 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.72 4.72 2.01 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 1.35 1.10 0.92 0.00 0.00 46 A 9.01 5.02 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 47 I 9.22 4.63 1.97 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.63 0.99 0.00 0.00 48 K 9.15 5.10 0.00 1.62 1.67 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.41 7.81 49 L 8.80 4.52 0.00 1.55 1.63 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.82 4.45 0.00 2.05 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 2.30 2.41 0.00 51 N 8.50 3.87 0.00 2.82 2.61 0.00 0.00 6.56 7.57 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 52 S 8.60 4.71 0.00 3.94 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 53 G 7.42 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 54 T 8.08 4.81 4.32 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 1.26 0.00 0.00 55 L 9.21 4.10 0.00 1.64 1.75 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 56 R 9.10 5.09 0.00 2.22 1.94 0.00 3.17 0.00 0.00 3.14 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 57 Y 8.79 4.21 0.00 3.05 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 58 G 9.25 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 59 D 8.05 4.92 0.00 2.88 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 60 V 8.90 4.35 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 0.99 0.00 0.00 0.90 0.00 0.00 61 L 8.94 4.40 0.00 1.58 1.75 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 7.51 4.87 0.00 2.93 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 63 E 7.66 4.70 0.00 1.75 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 1.98 2.10 0.00 64 S 8.42 4.66 0.00 3.92 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.73 4.43 0.00 2.66 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 66 D 8.01 4.99 0.00 2.65 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.02 5.16 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 1.25 0.00 0.00 68 L 8.70 5.03 0.00 1.34 1.28 0.80 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 69 I 9.07 5.18 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.81 0.96 0.00 0.00 70 A 8.05 5.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 8.63 4.94 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.59 0.94 0.00 0.00 72 R 8.48 4.06 0.00 0.67 0.95 0.00 2.21 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.15 0.00 73 T 8.30 4.97 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 74 K 8.67 4.25 0.00 1.89 2.01 0.00 1.33 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.44 7.81 75 L 8.31 4.38 0.00 1.60 1.57 0.83 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 76 E 9.20 4.84 0.00 2.06 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 2.44 2.45 0.00 77 K 8.48 4.51 0.00 1.75 1.66 0.00 1.33 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.15 1.17 7.81 78 V 8.83 5.16 2.22 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 0.58 0.00 0.00 0.82 0.00 0.00 79 Y 8.95 5.31 0.00 2.92 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 80 V 9.27 4.48 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 0.97 0.00 0.00 0.91 0.00 0.00 81 I 8.81 4.47 1.99 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.57 0.92 0.00 0.00 82 K 9.14 4.67 0.00 1.56 1.73 0.00 1.84 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.37 7.81 83 P 0.00 4.56 0.00 2.38 2.07 0.00 4.00 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 2.12 2.01 0.00 84 Q 8.77 4.27 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 85 T 7.39 4.76 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 1.21 0.00 0.00 86 M 8.40 4.11 0.00 2.05 2.16 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 2.69 2.54 0.00 87 Q 7.98 3.96 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 88 E 8.53 3.98 0.00 2.20 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 2.34 2.32 0.00 89 M 8.18 4.12 0.00 2.30 2.07 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 2.63 2.63 0.00 90 G 8.24 3.62 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 0.00 0.00 0.00 91 K 8.15 4.07 0.00 1.92 1.89 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.49 7.81 92 M 8.38 4.02 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.58 0.00 93 A 8.35 4.03 1.47 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 0.00 0.00 94 F 8.41 3.98 0.00 3.29 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 95 E 8.28 3.92 0.00 2.22 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.55 0.00 96 I 7.85 3.80 2.01 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 1.43 0.77 0.93 0.00 0.00 97 G 8.23 3.52 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 0.00 98 N 7.90 4.01 0.00 2.08 2.73 0.00 0.00 7.24 7.61 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 99 R 7.21 4.20 0.00 1.93 1.88 0.00 3.33 0.00 0.00 3.17 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 100 H 7.88 4.16 0.00 3.28 3.36 0.00 5.64 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 T 7.62 4.31 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 1.20 0.00 0.00 102 M 8.13 3.17 0.00 0.69 1.51 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.81 0.00 103 C 7.85 5.16 0.00 3.20 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 0.00 104 I 8.89 4.81 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.18 0.96 0.00 0.00 105 I 8.73 4.83 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.88 0.95 0.00 0.00 106 E 8.63 4.53 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 107 D 9.13 4.43 0.00 2.81 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 0.00 0.00 0.00 0.00 108 D 9.36 4.95 0.00 2.79 2.70 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 0.00 109 E 8.23 4.98 0.00 1.90 1.84 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 2.21 2.23 0.00 110 I 8.80 4.68 1.90 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 1.15 0.87 0.96 0.00 0.00 111 L 9.00 5.06 0.00 1.60 1.53 0.72 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.42 5.11 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 0.75 0.00 0.00 1.12 0.00 0.00 113 R 8.77 4.53 0.00 1.78 1.95 0.00 3.27 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.59 0.00 114 Y 8.49 3.43 0.00 2.76 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 0.00 115 D 7.81 4.20 0.00 2.65 2.49 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 0.00 116 K 8.76 4.01 0.00 1.86 1.81 0.00 1.88 0.00 0.00 1.91 0.00 0.00 3.13 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.54 1.73 7.81 117 T 7.94 3.90 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 1.24 0.00 0.00 118 L 8.02 4.15 0.00 1.65 1.50 0.99 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.00 3.46 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 120 K 7.91 3.88 0.00 1.99 2.04 0.00 1.34 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.65 7.81 121 L 7.65 3.87 0.00 1.70 1.75 0.90 1.02 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 0.00 122 I 7.73 3.57 1.15 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.22 0.66 0.00 0.00 123 D 8.23 4.36 0.00 2.85 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 0.00 124 E 8.17 3.93 0.00 2.12 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 0.00 2.32 2.32 0.00 125 V 7.81 3.78 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 0.88 0.00 0.00 0.95 0.00 0.00 126 G 8.12 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 0.00 0.00 0.00 127 V 7.56 4.37 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 0.93 0.00 0.00 0.94 0.00 0.00 128 S 8.42 4.62 0.00 3.85 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 0.00 129 Y 8.14 5.45 0.00 3.02 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 E 9.02 4.68 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 2.22 2.31 0.00 131 Q 8.75 4.96 0.00 2.44 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.09 0.00 132 S 8.58 4.56 0.00 3.89 3.65 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 0.00 133 E 8.68 5.10 0.00 1.75 1.74 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 2.13 2.28 0.00 134 R 8.84 4.59 0.00 1.29 1.39 0.00 3.11 0.00 0.00 3.05 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 135 R 7.97 4.96 0.00 1.62 1.91 0.00 3.29 0.00 0.00 4.01 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.39 0.00 136 F 8.69 3.80 0.00 2.28 1.71 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 0.00 137 K 8.38 4.40 0.00 1.41 1.08 0.00 1.25 0.00 0.00 0.63 0.00 0.00 2.60 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.51 1.14 7.81 138 E 7.89 4.89 0.00 2.04 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 139 P 0.00 4.61 0.00 2.26 2.19 0.00 3.88 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 2.07 2.04 0.00 140 F 8.44 4.33 0.00 2.22 2.24 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 0.00 141 K 7.81 4.00 0.00 1.51 1.58 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.33 7.81 142 Y 8.00 3.90 0.00 2.83 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 0.00 143 R 7.83 4.09 0.00 1.72 1.79 0.00 3.15 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00