NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3111 8.3049 120.6005 55.6512 33.5027 175.3075 2 N 4.5276 8.6493 124.4273 49.5830 38.9120 172.2850 3 T 4.6939 8.3625 114.8426 59.3374 73.3658 173.4555 4 P 4.1315 0.0000 0.0000 65.8001 31.3740 178.5774 5 E 3.8884 8.1681 116.8364 59.8675 29.3925 178.9484 6 H 4.1116 7.8804 117.4308 59.5733 29.9761 177.3086 7 M 3.4914 7.6962 120.4228 58.3647 31.7009 178.9428 8 T 3.8272 8.1075 116.1368 66.3564 68.5910 176.7796 9 A 3.9783 7.9275 122.8796 54.8979 18.3724 179.9138 10 V 3.5310 7.8015 116.9863 66.0421 31.6499 178.3946 11 V 3.2001 7.6439 117.9975 66.0631 31.2349 178.0761 12 Q 3.9357 7.8388 117.4503 58.9972 28.4778 178.9944 13 R 3.9824 8.1108 119.1997 58.9688 30.0411 178.5038 14 Y 4.0313 8.0694 119.5746 60.7565 38.9119 178.1392 15 V 3.3994 7.8855 118.9234 65.8735 31.3039 177.8487 16 A 3.9449 7.9954 120.2826 55.1354 18.2501 179.5151 17 A 3.8992 8.3596 119.7908 55.0270 18.2517 179.6357 18 L 3.7767 7.8012 118.9316 58.3632 41.9857 178.8837 19 N 4.6374 8.0803 114.3363 54.8916 38.4985 175.5484 20 A 4.5372 7.2706 121.3137 50.8463 19.5753 176.3130 21 G 3.8867 7.6515 104.1441 46.9250 0.0000 175.0686 22 D 4.5768 7.7899 120.6649 52.4589 40.6255 175.4839 23 L 3.9736 8.1438 128.5440 58.0059 42.5403 177.9537 24 D 4.5928 8.1943 118.2499 56.6822 40.6711 178.8663 25 G 3.6866 8.3618 107.7370 47.0608 0.0000 175.6745 26 I 3.8773 7.5933 121.8722 64.3504 37.0958 178.8475 27 V 3.8445 7.7427 118.2232 65.8107 31.0802 177.7761 28 A 4.1463 7.8012 119.2611 54.6639 18.4338 179.1774 29 L 3.9967 7.9349 117.4353 56.4632 41.6804 177.3817 30 F 4.7969 7.3772 116.2153 56.1982 40.1858 175.4813 31 A 4.3390 8.8966 126.6464 51.7556 19.2732 178.8392 32 D 4.5742 9.0138 119.5353 56.3399 41.0642 177.9429 33 D 4.6475 7.9198 115.6430 52.7558 39.9374 176.1084 34 A 5.1559 8.2071 122.7249 52.3655 19.8530 176.9498 35 T 5.0644 8.3514 108.1288 59.8780 73.0073 172.9589 36 V 4.6040 8.5792 121.8366 61.2544 35.1102 173.7418 37 E 4.6845 9.0867 128.8751 54.1413 31.2487 173.2731 38 N 5.1579 8.0905 123.6227 51.0064 41.6998 171.7923 39 P 4.7117 0.0000 0.0000 61.1615 34.0558 175.2497 40 V 3.8252 7.8544 120.6918 64.3885 31.1250 175.8926 41 G 3.9554 9.0588 115.7371 45.4124 0.0000 173.6560 42 S 4.5737 7.4228 114.2379 56.2164 65.0092 173.4754 43 E 4.0751 8.3443 120.3689 55.4168 29.5658 175.4991 44 P 4.5001 0.0000 0.0000 62.8372 32.3165 175.9215 45 R 4.3983 8.8622 123.1526 55.1444 31.8610 175.3806 46 S 4.8294 8.6781 117.7167 57.6099 65.2113 174.3958 47 G 4.4084 9.3989 113.0852 45.9257 0.0000 174.1205 48 T 3.8358 8.7446 117.6147 66.7904 68.5046 176.6102 49 A 3.9942 8.0005 121.5007 55.1630 18.5868 179.3521 50 A 4.0488 7.8982 118.6907 54.9399 18.5333 179.8757 51 I 3.6232 7.7889 118.6901 64.3682 37.1232 178.4981 52 R 3.9637 8.1269 119.5940 59.4932 29.9564 178.0412 53 E 3.9358 8.0392 118.5983 59.2700 29.6606 178.6012 54 F 3.9786 8.1171 120.2072 61.6445 39.5276 176.8409 55 Y 3.9625 8.3450 116.0278 60.5555 37.3726 178.1327 56 A 4.0218 8.2266 121.9189 55.2134 18.6472 179.1042 57 N 4.3404 8.0234 115.0399 56.4608 38.3195 177.9113 58 S 3.9196 7.2943 115.6321 61.1859 62.9066 175.7939 59 L 4.3570 7.5773 118.6965 54.8640 41.3278 178.2541 60 K 3.9635 7.5284 122.4527 58.0437 32.5142 176.7814 61 L 4.7408 7.0608 117.2567 51.8065 43.6689 174.3103 62 P 4.4186 0.0000 0.0000 62.7903 31.9255 175.4937 63 L 5.1473 8.4359 121.4286 52.8174 44.9313 175.8473 64 A 4.9548 9.0327 124.2509 50.3482 21.1734 175.3258 65 V 5.6643 9.5035 121.9234 59.8763 34.1752 175.3425 66 E 4.8781 8.6654 119.8741 54.6439 33.1263 174.5910 67 L 4.6913 8.7844 122.7352 55.2766 42.3119 177.0601 68 T 4.5520 8.5665 111.2941 61.7496 69.8731 173.5931 69 Q 4.6120 7.6822 119.6546 54.3550 32.9462 173.5883 70 E 4.1001 8.5327 117.2277 56.6405 29.9715 176.7719 71 V 3.9603 8.1300 120.6558 62.9075 32.7446 175.3175 72 R 4.6216 9.0155 126.8315 54.8749 31.5478 175.1837 73 A 5.2611 8.2469 125.7780 50.1230 21.9132 175.4523 74 V 4.0062 9.4142 118.8440 62.1519 34.9576 172.7603 75 A 3.9018 9.6405 124.0214 53.8293 15.8238 176.3580 76 N 4.3635 7.9762 113.6611 53.6212 37.0029 174.1914 77 E 5.5630 8.3304 116.4292 54.8811 34.3556 174.5584 78 A 5.3760 9.2981 122.4368 50.6171 23.2455 175.0881 79 A 5.4035 9.3787 122.4141 50.3729 23.0493 175.1612 80 F 5.2826 8.8172 114.6639 55.4390 42.1548 172.9411 81 A 5.4772 8.6917 121.7310 50.5886 21.3374 175.5679 82 F 5.2957 8.3679 115.5035 56.2872 42.1556 172.6315 83 I 4.5836 8.7997 111.6009 58.9766 41.1606 174.8301 84 V 4.8696 8.5025 123.3203 61.6148 34.0382 174.3284 85 S 5.3901 9.2504 124.8922 57.1248 65.9233 173.3271 86 F 5.1040 7.9125 116.4900 56.4332 41.6810 172.3310 87 E 5.0063 8.9955 118.2739 54.9897 32.1228 175.7026 88 Y 4.6288 9.0830 127.0381 56.6564 39.0047 173.7779 89 Q 3.1750 8.5623 127.5933 56.5755 24.9101 174.8653 90 G 3.8648 7.9365 102.5783 45.7873 0.0000 171.1580 91 R 4.4661 7.5071 120.7256 54.2267 31.6700 175.4070 92 K 4.6242 8.5075 128.0466 56.9292 34.0265 175.5290 93 T 4.8831 8.1854 120.4253 62.1568 73.6219 172.9305 94 V 4.5157 9.2458 125.9278 61.1560 34.6552 174.0988 95 V 4.5324 8.5980 128.1297 61.2082 33.5747 174.3611 96 A 5.0593 9.1775 130.7295 48.8170 19.2172 173.6425 97 P 4.9689 0.0000 0.0000 61.8652 35.1770 174.0645 98 I 4.8490 8.4879 119.8862 59.7256 39.9051 174.9596 99 D 5.3290 8.3590 126.8899 52.9681 43.6091 175.0310 100 H 5.3610 9.2572 121.2937 54.7125 32.6903 172.3780 101 F 5.4235 9.6651 124.8393 55.9313 42.0868 174.8495 102 R 5.0712 8.3026 121.1061 54.9182 33.0477 174.4436 103 F 5.3248 9.5971 125.5848 56.1689 41.8171 174.0836 104 N 5.0157 8.8088 117.6620 50.7003 40.1583 175.5063 105 G 3.7597 9.0219 106.7878 48.9787 0.0000 174.5242 106 A 4.0421 7.9014 119.9361 52.8474 18.5662 178.1254 107 G 4.4997 8.6085 104.7214 45.1395 0.0000 173.8501 108 K 4.4650 7.5924 118.7657 54.6671 34.0810 175.5810 109 V 3.6627 7.8148 121.7252 62.9230 31.9282 176.7645 110 V 4.4824 8.6895 120.6940 61.6735 33.9648 175.5802 111 S 5.1598 7.4402 115.2723 57.1543 66.0010 172.6564 112 M 5.4772 8.8513 123.4156 53.7163 34.7789 174.3126 113 R 5.1639 9.2634 119.9587 54.4807 34.6536 173.8546 114 A 5.3374 8.8136 125.9402 49.8079 21.1902 175.5608 115 L 4.8627 8.7667 124.3251 54.0544 43.2869 176.1085 116 F 5.0651 7.8561 115.8946 56.3545 40.3557 173.5009 117 G 4.2804 9.3966 111.1245 43.1326 0.0000 173.0558 118 E 4.0463 8.8795 115.7797 59.5781 29.1193 178.9886 119 K 4.2698 8.0433 115.6105 57.7365 32.5139 176.7166 120 N 4.8756 8.6706 116.9121 52.8036 39.9933 173.8018 121 I 4.6380 7.4545 120.1598 59.8109 39.3349 174.9627 122 H 4.8784 9.3469 125.3124 53.6257 30.9044 173.5328 123 A 3.8336 8.6704 125.4240 52.8736 18.6986 174.5661 124 G 3.8449 9.6410 109.3409 46.2746 0.0000 174.0971 125 A 4.1120 7.7970 127.3061 51.6833 18.3010 177.3785 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 4.31 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 2 N 8.65 4.53 0.00 2.94 2.54 0.00 0.00 7.16 6.46 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 3 T 8.36 4.69 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 1.17 0.00 0.00 4 P 0.00 4.13 0.00 2.14 2.11 0.00 3.57 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 2.08 2.14 0.00 5 E 8.17 3.89 0.00 2.02 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 2.38 2.42 0.00 6 H 7.88 4.11 0.00 3.18 3.32 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 M 7.70 3.49 0.00 1.66 1.81 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 0.86 0.00 8 T 8.11 3.83 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 1.15 0.00 0.00 9 A 7.93 3.98 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 10 V 7.80 3.53 2.42 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 1.10 0.00 0.00 0.91 0.00 0.00 11 V 7.64 3.20 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 -0.27 0.00 0.00 0.40 0.00 0.00 12 Q 7.84 3.94 0.00 2.28 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.54 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 13 R 8.11 3.98 0.00 2.01 1.98 0.00 3.12 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 14 Y 8.07 4.03 0.00 3.15 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 15 V 7.89 3.40 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 0.99 0.00 0.00 0.87 0.00 0.00 16 A 8.00 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.36 3.90 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 18 L 7.80 3.78 0.00 1.79 1.63 0.77 0.16 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 19 N 8.08 4.64 0.00 2.98 2.86 0.00 0.00 6.90 7.03 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 20 A 7.27 4.54 1.29 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 0.00 0.00 21 G 7.65 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 22 D 7.79 4.58 0.00 2.80 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 23 L 8.14 3.97 0.00 1.80 1.65 0.98 1.26 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 24 D 8.19 4.59 0.00 2.81 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 25 G 8.36 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 26 I 7.59 3.88 1.89 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.99 0.46 0.00 0.00 27 V 7.74 3.84 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 1.07 0.00 0.00 1.08 0.00 0.00 28 A 7.80 4.15 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.93 4.00 0.00 1.94 1.21 0.92 1.09 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 30 F 7.38 4.80 0.00 2.90 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 31 A 8.90 4.34 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 9.01 4.57 0.00 2.81 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 33 D 7.92 4.65 0.00 2.77 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 34 A 8.21 5.16 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.35 5.06 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 1.21 0.00 0.00 36 V 8.58 4.60 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 0.19 0.00 0.00 0.64 0.00 0.00 37 E 9.09 4.68 0.00 1.99 1.73 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 2.26 2.23 0.00 38 N 8.09 5.16 0.00 2.56 2.30 0.00 0.00 7.59 8.11 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 39 P 0.00 4.71 0.00 1.60 1.47 0.00 3.73 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 1.88 1.78 0.00 40 V 7.85 3.83 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 0.68 0.00 0.00 0.95 0.00 0.00 41 G 9.06 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 42 S 7.42 4.57 0.00 3.95 3.83 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 43 E 8.34 4.08 0.00 1.91 1.90 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 2.28 2.35 0.00 44 P 0.00 4.50 0.00 1.87 1.91 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.06 0.00 45 R 8.86 4.40 0.00 1.44 1.70 0.00 3.17 0.00 0.00 3.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.24 0.00 46 S 8.68 4.83 0.00 3.77 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 47 G 9.40 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 48 T 8.74 3.84 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 1.23 0.00 0.00 49 A 8.00 3.99 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 50 A 7.90 4.05 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 7.79 3.62 1.75 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.52 0.58 0.00 0.00 52 R 8.13 3.96 0.00 2.01 1.96 0.00 3.13 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 53 E 8.04 3.94 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 54 F 8.12 3.98 0.00 3.15 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 55 Y 8.35 3.96 0.00 3.13 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 56 A 8.23 4.02 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 57 N 8.02 4.34 0.00 2.70 2.68 0.00 0.00 7.13 8.07 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 58 S 7.29 3.92 0.00 3.85 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.58 4.36 0.00 1.62 1.68 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.53 3.96 0.00 1.89 1.78 0.00 1.63 0.00 0.00 1.65 0.00 0.00 3.17 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.42 1.51 7.81 61 L 7.06 4.74 0.00 1.55 1.60 0.81 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.42 0.00 2.22 2.09 0.00 3.78 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 2.06 2.03 0.00 63 L 8.44 5.15 0.00 1.56 1.67 0.93 0.68 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 64 A 9.03 4.95 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 65 V 9.50 5.66 2.32 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 0.92 0.00 0.00 1.16 0.00 0.00 66 E 8.67 4.88 0.00 2.07 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 0.00 2.33 2.43 0.00 67 L 8.78 4.69 0.00 1.71 1.72 0.85 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.57 4.55 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 1.33 0.00 0.00 69 Q 7.68 4.61 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.03 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 70 E 8.53 4.10 0.00 2.09 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 2.31 2.34 0.00 71 V 8.13 3.96 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 0.75 0.00 0.00 0.83 0.00 0.00 72 R 9.02 4.62 0.00 2.09 1.89 0.00 3.20 0.00 0.00 3.23 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 73 A 8.25 5.26 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 74 V 9.41 4.01 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 0.67 0.00 0.00 0.94 0.00 0.00 75 A 9.64 3.90 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 76 N 7.98 4.36 0.00 3.00 3.17 0.00 0.00 6.76 7.68 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 77 E 8.33 5.56 0.00 2.13 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 2.35 2.54 0.00 78 A 9.30 5.38 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 9.38 5.40 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 80 F 8.82 5.28 0.00 3.08 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 81 A 8.69 5.48 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 82 F 8.37 5.30 0.00 3.35 3.31 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 83 I 8.80 4.58 1.84 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 1.14 0.87 0.88 0.00 0.00 84 V 8.50 4.87 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.08 0.00 0.00 85 S 9.25 5.39 0.00 3.76 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 86 F 7.91 5.10 0.00 3.12 3.14 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 87 E 9.00 5.01 0.00 1.89 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 2.17 2.28 0.00 88 Y 9.08 4.63 0.00 3.08 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 89 Q 8.56 3.17 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 5.81 0.00 0.00 0.00 0.00 0.00 1.16 1.77 0.00 90 G 7.94 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.51 4.47 0.00 1.86 2.01 0.00 3.23 0.00 0.00 3.09 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 92 K 8.51 4.62 0.00 1.82 1.58 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.77 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.35 7.81 93 T 8.19 4.88 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 94 V 9.25 4.52 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 0.92 0.00 0.00 0.87 0.00 0.00 95 V 8.60 4.53 1.83 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 0.15 0.00 0.00 0.91 0.00 0.00 96 A 9.18 5.06 1.16 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 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.97 0.00 2.20 2.38 0.00 2.32 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.46 0.00 98 I 8.49 4.85 1.88 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 0.84 0.93 0.00 0.00 99 D 8.36 5.33 0.00 1.58 2.26 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 0.00 100 H 9.26 5.36 0.00 3.18 3.19 0.00 5.57 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 F 9.67 5.42 0.00 2.94 2.33 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 0.00 102 R 8.30 5.07 0.00 1.76 1.65 0.00 3.07 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 103 F 9.60 5.32 0.00 2.83 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 N 8.81 5.02 0.00 2.80 2.95 0.00 0.00 7.38 6.54 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 0.00 105 G 9.02 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 7.90 4.04 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.61 4.50 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 0.00 108 K 7.59 4.47 0.00 1.83 1.78 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.44 7.81 109 V 7.81 3.66 0.96 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 -0.24 0.00 0.00 -0.19 0.00 0.00 110 V 8.69 4.48 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 0.70 0.00 0.00 0.98 0.00 0.00 111 S 7.44 5.16 0.00 3.82 3.58 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 0.00 112 M 8.85 5.48 0.00 1.94 2.12 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.86 0.00 113 R 9.26 5.16 0.00 1.81 1.84 0.00 3.13 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 114 A 8.81 5.34 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.77 4.86 0.00 1.83 1.64 0.93 0.82 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 0.00 116 F 7.86 5.07 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 0.00 117 G 9.40 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 0.00 118 E 8.88 4.05 0.00 2.18 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 0.00 2.38 2.38 0.00 119 K 8.04 4.27 0.00 1.79 1.93 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.47 7.81 120 N 8.67 4.88 0.00 2.84 3.01 0.00 0.00 6.76 7.64 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 0.00 121 I 7.45 4.64 2.03 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 1.23 0.84 0.91 0.00 0.00 122 H 9.35 4.88 0.00 3.10 3.17 0.00 5.81 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.67 3.83 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 0.00 124 G 9.64 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 0.00 125 A 7.80 4.11 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