NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 K 4.2411 8.3149 121.7876 56.1693 33.3906 175.1081 9 R 4.2108 8.2502 124.5765 52.6870 31.1511 174.0474 10 P 4.4582 0.0000 0.0000 62.5997 33.3896 176.7378 11 E 3.9779 8.5916 119.0602 57.8293 29.8926 176.2538 12 I 4.5372 6.9020 117.7697 59.6141 41.1606 173.6150 13 V 4.3643 7.6975 118.6799 60.2854 35.5287 175.7277 14 G 4.2131 8.6863 108.3742 44.3845 0.0000 171.7491 15 P 4.6082 0.0000 0.0000 62.0995 32.0805 176.5059 16 E 4.2327 8.9370 119.0541 58.6539 29.6371 177.7499 17 K 4.6610 7.7585 116.3132 53.8346 34.5480 176.0628 18 V 3.2833 7.9509 122.7971 63.1293 32.0709 175.2048 19 Q 4.7587 8.4887 127.5770 53.5635 31.6507 174.7256 20 S 4.6802 8.8079 117.2096 57.3297 63.1989 172.7683 21 P 4.2861 0.0000 0.0000 63.9796 31.3250 175.9762 22 Y 4.5760 7.0540 117.9023 56.8548 39.3798 173.1072 23 P 4.6042 0.0000 0.0000 62.9727 32.5789 175.7207 24 I 4.2948 8.6689 124.3952 60.0050 38.6622 174.6494 25 R 5.0328 8.1092 126.4655 54.7096 31.8396 175.7982 26 F 5.0314 8.5296 116.0627 56.4838 41.5463 172.2891 27 E 5.2458 9.0155 116.8415 55.1553 33.0389 174.4524 28 G 4.2483 8.7304 105.5831 45.7868 0.0000 172.7224 29 K 4.9801 8.4034 120.0456 55.4276 34.2999 176.4359 30 V 4.5489 8.6050 123.8419 62.6512 32.5545 175.4483 31 V 5.0290 8.6837 120.5279 59.6247 35.6714 175.2304 32 H 4.6596 8.9592 118.8292 55.9532 30.3377 177.0128 33 G 4.1349 7.9557 110.7053 45.8211 0.0000 174.6758 34 F 4.8055 8.8837 121.1991 56.9182 39.5779 174.6410 35 G 3.8139 8.4926 106.3055 46.2734 0.0000 176.0275 36 R 3.9293 8.1905 119.5689 59.0543 30.4469 178.2179 37 G 4.4109 8.5824 105.5198 46.4165 0.0000 175.7899 38 S 4.1232 8.5601 117.1129 61.2961 62.7823 175.4697 39 K 4.0112 7.9949 121.4263 59.2055 31.9612 178.9632 40 E 3.9905 8.1115 118.9625 59.2224 29.1734 178.7924 41 L 4.3147 7.7719 116.5274 55.5467 42.0477 177.8932 42 G 4.0045 8.4934 107.6837 45.1960 0.0000 174.1871 43 I 4.3708 6.9680 119.8601 57.8147 37.5681 172.3278 44 P 5.0611 0.0000 0.0000 62.4065 32.0364 176.1298 45 T 4.8909 8.3919 112.1073 59.8430 71.7424 172.8017 46 A 4.3912 9.3533 127.7839 50.7770 20.6978 175.9912 47 N 5.0009 8.6718 120.8674 53.1253 39.9405 174.6029 48 I 4.7572 8.5330 125.6320 60.1587 38.7762 176.1581 49 S 4.2821 8.8077 121.4615 58.5395 63.4677 175.0509 50 E 3.9607 9.2364 122.5885 59.7745 28.9693 178.9475 51 D 4.4230 8.2108 117.6651 55.1532 39.3879 177.1361 52 A 4.5750 7.7277 120.7446 52.1614 19.8035 177.0389 53 I 4.2667 7.7835 108.7235 59.7131 39.3770 177.2981 54 Q 3.9004 8.3229 120.5041 59.1670 28.5393 177.2802 55 E 4.2702 8.0185 117.3135 57.8610 30.4918 177.6331 56 L 3.9639 7.9388 119.5719 57.2864 42.3648 177.1852 57 L 4.4939 7.6753 115.7172 54.0295 42.4903 177.9218 58 R 3.8581 7.4396 119.2313 59.0002 29.8951 176.7965 59 Y 4.8179 7.8144 113.3067 57.6861 38.6452 175.2262 60 R 4.7163 7.4868 118.2149 54.0694 32.2863 176.3591 61 D 4.5534 8.5332 120.6817 54.7771 41.4133 176.8493 62 S 4.5141 8.5118 118.0266 58.4164 64.3603 174.8878 63 G 3.7509 7.6448 108.6198 44.6883 0.0000 171.8359 64 V 4.9309 8.3009 121.0028 61.5395 33.8184 175.9988 65 Y 5.2715 9.3646 124.6585 56.1253 42.3641 173.9692 66 F 5.3900 9.2983 114.5015 54.8029 41.8175 175.0661 67 G 3.9550 7.3377 105.2932 46.6436 0.0000 170.9299 68 Y 5.4594 8.1303 118.8846 56.3152 42.2040 174.9277 69 A 5.2737 8.9017 122.6321 50.5188 23.3446 174.6297 70 M 4.8752 9.1580 120.5289 53.6254 35.5098 174.7269 71 V 4.4408 8.3776 124.5412 61.8710 35.5139 174.5948 72 Q 3.1477 9.2397 125.6032 57.3535 26.0509 174.1688 73 K 3.8110 8.1350 111.2013 56.8813 30.5280 175.9081 74 R 4.3070 7.7032 118.2332 54.0746 32.7189 174.6935 75 V 4.2974 7.5193 121.5568 61.0089 33.3383 174.7041 76 F 5.1182 8.5367 124.4575 54.7592 43.4791 172.7225 77 P 5.1106 0.0000 0.0000 63.7000 32.8799 174.5878 78 M 5.1663 8.8815 116.9424 54.7095 35.1502 173.6547 79 V 5.0446 8.3561 112.5097 59.8559 35.7359 174.6295 80 M 5.3437 9.2485 123.3112 54.0867 35.7724 173.8351 81 S 5.2669 9.2231 122.6312 57.1092 65.2495 173.0832 82 V 4.5782 9.1774 125.6984 61.3827 33.5500 174.5327 83 G 4.1929 8.4559 115.2769 45.1986 0.0000 170.9226 84 W 5.4855 8.6049 119.1028 54.6281 32.7866 175.1957 85 N 4.6049 9.3740 122.4807 52.8242 38.6046 174.2003 86 P 4.2534 0.0000 0.0000 64.9065 31.5958 176.8702 87 Y 4.5315 7.7791 115.4640 58.0392 37.7261 174.7984 88 Y 4.7957 7.4419 116.9541 56.2002 42.1348 175.3072 89 K 4.0034 8.9127 125.7406 59.1804 32.6540 176.7505 90 N 4.2864 8.1126 117.6496 52.8454 38.9430 173.7409 91 K 3.6762 8.5830 125.7125 57.1235 32.0501 175.6999 92 L 4.8673 8.5555 126.5447 52.9257 44.3709 175.5051 93 R 4.2896 8.2664 126.9642 56.2715 30.8937 175.6397 94 S 4.9480 8.8249 119.1419 56.6461 67.0344 172.7233 95 A 5.1458 8.3361 121.8200 50.6978 22.6054 174.6718 96 E 5.0721 9.3943 122.1714 54.4513 33.0870 175.1183 97 V 4.8268 9.0479 124.7795 61.2907 34.4828 173.5063 98 H 5.1617 8.9366 127.8546 54.2539 31.7827 173.0935 99 L 4.2419 8.3754 126.6515 54.5594 42.1525 176.9121 100 I 3.8704 8.6673 125.8986 61.2725 38.0939 175.8780 101 E 3.7665 8.6855 124.6381 57.7138 27.0818 174.4973 102 R 4.3865 7.7998 116.5990 54.2993 32.3595 174.4084 103 Q 4.5431 9.6623 123.2498 52.9731 31.8030 175.4788 104 G 4.1542 8.2470 109.2266 44.1924 0.0000 171.4034 105 E 4.2561 7.9989 120.0788 55.5460 30.1199 176.5705 106 D 4.3636 8.2995 120.1733 54.7157 41.6580 176.1853 107 F 5.0418 6.8180 113.4538 56.0366 38.0873 174.4042 108 Y 4.3041 7.8341 117.6781 60.7947 38.2608 177.4602 109 E 4.0005 9.3907 120.8492 56.8467 28.9104 174.9497 110 E 4.4011 7.8326 118.2916 56.0783 31.2280 175.7112 111 I 4.6312 8.2187 122.7901 60.6871 38.5310 174.7822 112 M 4.7536 9.3288 127.7139 53.8801 34.5520 174.4912 113 R 4.9626 8.5274 125.0516 54.6125 32.6664 175.4693 114 V 4.9578 9.1097 123.3089 61.1995 35.4490 174.6586 115 I 4.9697 9.1275 126.6437 59.4984 40.6584 174.4685 116 V 4.2733 8.9531 128.9200 62.7586 32.0537 176.2833 117 L 4.3176 8.3109 126.9900 54.3133 43.5437 176.1517 118 G 2.8304 6.0163 104.6937 45.5708 0.0000 171.2067 119 Y 4.5466 7.7755 120.9397 56.3155 40.3805 175.3440 120 I 4.0498 7.9484 128.2717 62.1571 38.1014 175.9230 121 R 4.3689 6.2231 115.6161 54.4778 32.1557 171.8363 122 P 5.6454 0.0000 0.0000 61.1568 33.0385 175.5741 123 E 3.9146 8.8088 119.0045 57.2364 29.7525 176.8439 124 L 4.5659 8.2142 122.7838 52.4962 43.5168 175.0186 125 N 4.2086 8.8147 121.9804 53.6264 38.1792 172.9586 126 Y 4.3486 8.6196 126.2619 57.9747 38.9549 174.9792 127 A 4.5262 8.7040 130.3511 48.6258 19.6162 173.9081 128 G 3.9930 8.0646 108.1284 45.1705 0.0000 172.3716 129 L 4.5027 8.7554 126.6633 57.5596 41.9966 179.0787 130 D 4.3363 8.0674 118.6348 57.2330 41.0006 178.3011 131 K 3.9699 8.0691 119.6871 59.1964 32.1732 178.2607 132 L 3.8092 7.9351 120.3908 58.3907 41.9406 179.0479 133 I 3.5485 7.4961 119.0881 64.1669 36.9290 178.0753 134 E 3.8905 8.1438 120.0382 59.4549 29.5312 178.5546 135 D 4.3313 8.5559 119.1738 57.4936 40.8572 178.9867 136 I 3.9264 7.9382 121.9082 64.2320 37.1161 178.2272 137 H 4.2951 8.3225 117.1694 59.1572 28.4405 178.0388 138 T 3.8678 8.1276 117.6596 66.5463 67.7210 176.2868 139 D 4.2842 8.0788 120.8168 57.5935 40.8253 179.0537 140 I 3.7198 7.6979 120.0642 64.2828 37.1068 178.5181 141 R 3.7926 8.0051 119.4758 59.4104 29.8691 178.6824 142 V 4.0647 8.5722 119.4622 65.3139 31.4479 177.7468 143 A 3.3887 8.2477 120.7591 54.9869 18.0157 179.5440 144 L 3.8579 7.7042 116.1683 57.9606 41.9809 179.2862 145 N 4.3798 7.9850 116.1495 56.6033 38.3226 177.6803 146 S 3.7692 7.6452 115.0534 61.1410 62.9040 175.7639 147 M 4.4213 7.5385 119.1402 55.3363 31.7789 176.5070 148 D 4.7761 7.7491 117.6771 53.7084 41.7262 175.2653 149 R 4.6817 7.2823 118.2814 54.2919 32.3864 175.2184 150 P 4.2704 0.0000 0.0000 66.0181 31.2030 178.4046 151 S 4.1914 8.2759 109.7372 61.6322 62.4218 175.4889 152 Y 4.4707 8.3313 118.9465 61.1331 38.2586 177.8873 153 S 5.1336 8.6709 116.4213 60.8714 62.4489 176.3150 154 S 4.1369 8.2378 116.5900 61.3839 62.0090 175.1752 155 Y 4.1422 8.6770 119.0392 59.6202 37.5050 177.4204 156 K 3.4585 7.6381 119.8179 57.8662 32.0795 177.0990 157 K 4.5343 7.1096 116.9889 55.9589 32.7164 175.7078 158 D 4.4009 8.1584 119.7934 53.5771 41.7788 175.6792 159 P 4.3452 0.0000 0.0000 65.2717 31.6240 178.3662 160 F 4.3574 8.5326 120.1506 60.8657 39.2647 175.8461 161 F 4.6383 7.9708 117.3418 58.2654 39.1822 175.6858 162 K 4.1765 7.8591 125.4003 56.3970 32.2223 175.7785 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 8 K 8.31 4.24 0.00 1.70 1.77 0.00 1.61 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.52 7.81 9 R 8.25 4.21 0.00 1.89 1.79 0.00 3.23 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 1.57 1.66 0.00 10 P 0.00 4.46 0.00 2.35 2.14 0.00 3.65 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 2.02 1.96 0.00 11 E 8.59 3.98 0.00 1.96 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 0.00 2.36 2.20 0.00 12 I 6.90 4.54 1.75 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 1.13 0.46 0.84 0.00 0.00 13 V 7.70 4.36 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 0.66 0.00 0.00 0.86 0.00 0.00 14 G 8.69 4.21 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 0.00 15 P 0.00 4.61 0.00 2.39 2.17 0.00 4.01 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.12 0.00 16 E 8.94 4.23 0.00 2.07 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 2.37 2.34 0.00 17 K 7.76 4.66 0.00 1.77 1.73 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.45 7.81 18 V 7.95 3.28 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 0.50 0.00 0.00 0.19 0.00 0.00 19 Q 8.49 4.76 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 20 S 8.81 4.68 0.00 3.95 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 21 P 0.00 4.29 0.00 1.88 1.98 0.00 3.31 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.60 0.00 22 Y 7.05 4.58 0.00 3.08 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 23 P 0.00 4.60 0.00 1.95 1.49 0.00 3.74 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 1.99 2.19 0.00 24 I 8.67 4.29 1.95 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.71 0.93 0.00 0.00 25 R 8.11 5.03 0.00 1.11 0.66 0.00 2.79 0.00 0.00 2.48 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.38 0.00 26 F 8.53 5.03 0.00 3.13 3.09 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 0.00 0.00 0.00 27 E 9.02 5.25 0.00 2.06 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 2.36 2.43 0.00 28 G 8.73 4.25 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 0.00 29 K 8.40 4.98 0.00 1.82 1.79 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.43 7.81 30 V 8.61 4.55 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 1.15 0.00 0.00 31 V 8.68 5.03 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 0.81 0.00 0.00 1.03 0.00 0.00 32 H 8.96 4.66 0.00 2.96 3.12 0.00 5.88 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 7.96 4.13 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 0.00 0.00 0.00 34 F 8.88 4.81 0.00 3.11 3.03 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 35 G 8.49 3.81 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 0.00 0.00 0.00 36 R 8.19 3.93 0.00 1.89 2.03 0.00 3.26 0.00 0.00 3.26 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 37 G 8.58 4.41 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 0.00 38 S 8.56 4.12 0.00 4.27 4.14 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 39 K 7.99 4.01 0.00 1.82 1.89 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.51 7.81 40 E 8.11 3.99 0.00 2.19 2.01 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 2.34 2.36 0.00 41 L 7.77 4.31 0.00 1.73 1.66 0.97 0.86 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 42 G 8.49 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 43 I 6.97 4.37 1.74 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 1.28 0.55 0.48 0.00 0.00 44 P 0.00 5.06 0.00 2.01 2.02 0.00 3.30 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.80 0.00 45 T 8.39 4.89 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 1.26 0.00 0.00 46 A 9.35 4.39 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 47 N 8.67 5.00 0.00 3.07 2.79 0.00 0.00 7.12 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 48 I 8.53 4.76 1.97 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 1.59 1.00 1.12 0.00 0.00 49 S 8.81 4.28 0.00 4.13 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 50 E 9.24 3.96 0.00 2.37 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 0.00 2.39 2.39 0.00 51 D 8.21 4.42 0.00 2.86 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 52 A 7.73 4.58 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 7.78 4.27 1.56 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.67 0.42 0.00 0.00 54 Q 8.32 3.90 0.00 2.04 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.00 0.00 0.00 0.00 0.00 0.00 2.61 2.30 0.00 55 E 8.02 4.27 0.00 2.01 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 2.37 2.37 0.00 56 L 7.94 3.96 0.00 1.50 1.44 0.87 0.58 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 57 L 7.68 4.49 0.00 1.59 1.36 0.58 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 58 R 7.44 3.86 0.00 2.05 1.72 0.00 3.07 0.00 0.00 3.07 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.50 0.00 59 Y 7.81 4.82 0.00 2.98 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 R 7.49 4.72 0.00 1.84 1.89 0.00 3.30 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 1.53 1.59 0.00 61 D 8.53 4.55 0.00 2.31 2.50 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 62 S 8.51 4.51 0.00 3.98 4.07 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 63 G 7.64 3.75 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 0.00 0.00 0.00 64 V 8.30 4.93 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 0.90 0.00 0.00 0.93 0.00 0.00 65 Y 9.36 5.27 0.00 2.92 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 66 F 9.30 5.39 0.00 3.11 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 67 G 7.34 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 0.00 0.00 0.00 68 Y 8.13 5.46 0.00 3.50 2.93 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 0.00 0.00 0.00 69 A 8.90 5.27 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 70 M 9.16 4.88 0.00 1.76 0.74 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 2.13 2.38 0.00 71 V 8.38 4.44 1.48 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 0.41 0.00 0.00 0.58 0.00 0.00 72 Q 9.24 3.15 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.32 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 73 K 8.13 3.81 0.00 1.84 1.83 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.39 7.81 74 R 7.70 4.31 0.00 1.96 1.13 0.00 3.10 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.43 0.00 75 V 7.52 4.30 1.67 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 0.27 0.00 0.00 0.40 0.00 0.00 76 F 8.54 5.12 0.00 2.96 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 77 P 0.00 5.11 0.00 2.15 2.35 0.00 3.97 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.09 0.00 78 M 8.88 5.17 0.00 2.16 2.30 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.62 0.00 79 V 8.36 5.04 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 0.81 0.00 0.00 1.01 0.00 0.00 80 M 9.25 5.34 0.00 2.15 1.95 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.56 0.00 81 S 9.22 5.27 0.00 3.82 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 82 V 9.18 4.58 2.21 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 0.81 0.00 0.00 0.85 0.00 0.00 83 G 8.46 4.19 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 0.00 84 W 8.60 5.49 0.00 3.12 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 N 9.37 4.60 0.00 2.97 2.98 0.00 0.00 7.32 8.23 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 86 P 0.00 4.25 0.00 1.42 1.89 0.00 3.10 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.07 0.00 87 Y 7.78 4.53 0.00 2.80 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 Y 7.44 4.80 0.00 2.99 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 K 8.91 4.00 0.00 1.73 1.86 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.71 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.40 7.81 90 N 8.11 4.29 0.00 2.75 2.75 0.00 0.00 6.97 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.58 3.68 0.00 1.45 0.90 0.00 1.21 0.00 0.00 0.61 0.00 0.00 2.43 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.87 1.10 7.81 92 L 8.56 4.87 0.00 1.78 1.65 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.27 4.29 0.00 1.74 1.64 0.00 2.25 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.19 0.00 94 S 8.82 4.95 0.00 3.91 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.34 5.15 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 96 E 9.39 5.07 0.00 1.92 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 2.25 2.25 0.00 97 V 9.05 4.83 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 1.04 0.00 0.00 98 H 8.94 5.16 0.00 3.29 3.17 0.00 5.83 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.38 4.24 0.00 1.26 1.23 0.50 0.92 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 0.00 100 I 8.67 3.87 2.05 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 1.25 0.45 0.94 0.00 0.00 101 E 8.69 3.77 0.00 2.16 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 2.24 2.30 0.00 102 R 7.80 4.39 0.00 0.78 1.31 0.00 3.03 0.00 0.00 2.98 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 103 Q 9.66 4.54 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 104 G 8.25 4.15 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 0.00 105 E 8.00 4.26 0.00 2.02 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 2.34 2.30 0.00 106 D 8.30 4.36 0.00 2.71 2.37 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 0.00 107 F 6.82 5.04 0.00 3.14 3.28 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 0.00 108 Y 7.83 4.30 0.00 2.98 2.90 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 0.00 109 E 9.39 4.00 0.00 2.16 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 2.29 2.36 0.00 110 E 7.83 4.40 0.00 2.21 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 2.54 2.67 0.00 111 I 8.22 4.63 1.87 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 0.42 0.91 0.00 0.00 112 M 9.33 4.75 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 113 R 8.53 4.96 0.00 1.81 1.27 0.00 2.69 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.35 0.00 114 V 9.11 4.96 0.67 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 1.00 0.00 0.00 0.62 0.00 0.00 115 I 9.13 4.97 2.08 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.82 0.85 0.00 0.00 116 V 8.95 4.27 2.25 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 1.09 0.00 0.00 1.09 0.00 0.00 117 L 8.31 4.32 0.00 1.19 1.63 1.09 0.07 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 0.00 118 G 6.02 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 Y 7.78 4.55 0.00 2.89 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 0.00 120 I 7.95 4.05 1.77 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.95 0.81 0.00 0.00 121 R 6.22 4.37 0.00 1.72 1.81 0.00 2.89 0.00 0.00 3.31 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.41 0.00 122 P 0.00 5.65 0.00 2.20 2.30 0.00 3.41 0.00 0.00 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.93 0.00 123 E 8.81 3.91 0.00 2.04 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 2.37 2.43 0.00 124 L 8.21 4.57 0.00 1.62 1.60 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 125 N 8.81 4.21 0.00 2.69 2.84 0.00 0.00 7.04 7.54 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 0.00 126 Y 8.62 4.35 0.00 2.95 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 8.70 4.53 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 0.00 128 G 8.06 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 0.00 129 L 8.76 4.50 0.00 1.90 1.77 1.04 1.48 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 0.00 130 D 8.07 4.34 0.00 2.83 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 0.00 131 K 8.07 3.97 0.00 1.86 1.89 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.70 1.52 7.81 132 L 7.94 3.81 0.00 1.54 1.68 0.55 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 133 I 7.50 3.55 1.96 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 1.31 0.50 0.73 0.00 0.00 134 E 8.14 3.89 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 135 D 8.56 4.33 0.00 2.83 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 0.00 136 I 7.94 3.93 1.87 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.17 0.83 0.00 0.00 137 H 8.32 4.30 0.00 3.33 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 8.13 3.87 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 1.16 0.00 0.00 139 D 8.08 4.28 0.00 2.89 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 0.00 140 I 7.70 3.72 2.04 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 1.48 0.74 0.92 0.00 0.00 141 R 8.01 3.79 0.00 2.07 1.95 0.00 3.07 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 142 V 8.57 4.06 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 1.09 0.00 0.00 0.91 0.00 0.00 143 A 8.25 3.39 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 0.00 144 L 7.70 3.86 0.00 1.71 1.71 0.95 1.32 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 0.00 145 N 7.99 4.38 0.00 2.86 2.74 0.00 0.00 7.08 6.85 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 0.00 146 S 7.65 3.77 0.00 2.87 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 0.00 147 M 7.54 4.42 0.00 2.18 2.11 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 2.68 2.75 0.00 148 D 7.75 4.78 0.00 2.87 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 0.00 149 R 7.28 4.68 0.00 2.01 1.96 0.00 3.50 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 150 P 0.00 4.27 0.00 2.22 2.17 0.00 3.70 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 151 S 8.28 4.19 0.00 3.94 4.21 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 0.00 152 Y 8.33 4.47 0.00 3.38 3.21 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 0.00 153 S 8.67 5.13 0.00 4.19 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 0.00 154 S 8.24 4.14 0.00 4.08 4.07 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 0.00 155 Y 8.68 4.14 0.00 3.58 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 7.64 3.46 0.00 0.79 1.56 0.00 1.56 0.00 0.00 1.53 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.14 0.90 7.81 157 K 7.11 4.53 0.00 1.69 1.73 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.32 1.31 7.81 158 D 8.16 4.40 0.00 2.93 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 0.00 0.00 0.00 0.00 159 P 0.00 4.35 0.00 2.23 2.09 0.00 3.62 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 2.08 2.05 0.00 160 F 8.53 4.36 0.00 2.74 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 0.00 161 F 7.97 4.64 0.00 3.23 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 0.00 162 K 7.86 4.18 0.00 1.72 1.66 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.48 7.81