NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 S 4.4262 8.3193 115.4084 58.7948 64.5199 171.6039 0 S 4.3497 8.1183 113.2469 56.4070 65.9064 172.9035 1 Y 4.0014 8.6000 122.6131 61.0276 39.2790 179.1030 2 T 3.9016 7.5878 107.9452 63.5389 69.1363 175.3389 3 S 4.4953 7.5867 115.3143 58.4395 64.1741 174.5867 4 I 3.9305 7.3371 114.3107 60.7790 38.3308 176.0985 5 T 3.9120 8.5585 120.1200 64.2548 69.5536 172.6780 6 K 4.9500 8.4307 126.9010 54.5216 33.7962 175.5163 7 L 4.5957 8.7688 129.2637 55.0202 41.7691 177.1946 8 T 4.5861 9.0545 112.4537 60.6894 70.2683 173.6328 9 N 4.9700 7.5567 119.0458 50.9371 41.2852 175.0863 10 L 4.1993 8.4650 121.2958 58.1645 41.7837 179.7869 11 T 3.8992 8.0049 115.3556 66.6120 68.4750 176.0007 12 E 3.9207 9.0650 121.5207 59.1803 29.7861 178.3510 13 F 4.2085 8.3745 120.5979 61.6600 39.3699 177.3079 14 R 3.4849 8.3539 117.6206 59.2987 29.8904 178.9667 15 N 4.3568 8.1567 116.2748 55.9824 38.6227 177.3599 16 L 4.0876 7.9898 121.9179 57.9453 42.1504 178.8680 17 I 3.6856 7.4135 119.6237 64.5822 36.8677 178.5771 18 K 4.1152 7.4890 117.1910 59.3774 31.9071 178.9699 19 Q 4.1592 7.8671 116.8255 56.3913 29.4339 175.4963 20 N 5.1494 7.3075 116.9397 51.3510 41.1611 175.4248 21 D 4.6396 8.7789 121.9844 55.1352 41.4922 176.1713 22 K 5.0311 7.8068 118.6010 54.6487 36.5225 175.0592 23 L 5.0685 8.9080 126.1813 53.3498 46.2736 174.8112 24 V 4.7182 8.7071 125.1878 61.1605 34.5815 173.9847 25 I 4.7348 8.9645 129.6304 59.7583 39.2764 174.6271 26 D 4.7038 9.1596 129.2595 53.1718 42.0260 175.2090 27 F 5.0811 9.1793 127.4037 56.8810 40.1464 174.8328 28 Y 5.1182 8.9092 121.5836 55.1423 42.4683 173.7795 29 A 4.6310 8.0031 119.5970 49.9155 21.8470 177.6151 30 T 3.9545 8.5921 111.3885 63.9789 69.1164 175.3843 31 W 4.4601 7.1828 116.8155 57.0395 29.1236 176.9490 32 C 4.5956 7.4098 120.7897 55.3963 43.7964 173.6446 33 G 3.6191 8.7712 115.5236 47.7495 0.0000 172.9546 34 P 4.2558 0.0000 0.0000 65.2751 31.0221 179.4708 35 C 4.2574 7.9442 114.0671 59.9182 36.5970 175.6010 36 K 3.8313 7.8203 120.0026 59.7079 31.4277 178.8131 37 M 3.9746 7.9758 117.2653 59.1550 32.3506 177.8490 38 M 4.3151 7.9165 117.2133 57.1793 32.1021 178.5365 39 Q 3.5512 7.5755 119.1393 58.5112 28.9692 177.0512 40 P 4.1800 0.0000 0.0000 65.7388 31.2736 178.4091 41 H 4.1037 8.0144 114.5770 58.7011 28.7301 177.3447 42 L 3.8553 8.2351 122.4326 58.5104 42.0395 178.9324 43 T 3.8063 8.0384 115.7141 66.7748 68.3706 176.6591 44 K 3.9657 7.8972 119.8032 59.3985 32.0705 179.4968 45 L 4.1876 8.0842 119.4364 57.7441 41.2996 179.4207 46 I 2.9135 7.3534 119.1503 64.4671 37.0838 178.2247 47 Q 4.0857 7.6324 116.6269 58.6287 28.6248 178.1485 48 A 4.0135 8.0437 121.0242 53.4379 19.9988 177.2175 49 Y 4.7972 7.9145 114.9383 55.8852 37.9993 174.6421 50 P 4.4658 0.0000 0.0000 64.8390 32.2701 178.0726 51 D 4.5479 8.1890 117.1269 54.3459 39.8534 175.7431 52 V 4.3338 7.7223 120.9281 61.1364 33.5672 174.7742 53 R 4.4108 8.8793 129.1015 55.7778 31.2080 174.7050 54 F 5.2929 9.1044 125.1582 56.0990 41.0568 175.3017 55 V 4.8865 9.0745 116.1531 59.5006 36.4265 174.2096 56 K 5.1569 8.9018 119.3166 55.8553 36.5443 175.1268 57 C 4.7170 9.2741 121.5575 58.0167 35.2983 172.2495 58 D 3.8642 8.4840 126.4961 53.1276 41.3296 176.7731 59 V 3.6295 8.4051 128.0919 66.0410 32.1095 178.1417 60 D 4.5236 8.1939 120.0681 56.9807 41.0163 177.3998 61 E 4.0925 8.3572 118.7525 58.4178 30.6198 176.8009 62 S 4.7733 8.2662 114.3180 55.8271 63.1726 172.9876 63 P 4.4989 0.0000 0.0000 64.9260 31.6042 178.4093 64 D 4.2855 7.9983 119.0777 56.5245 39.4075 178.5141 65 I 3.3858 7.5930 120.5313 63.6574 37.1219 177.9754 66 A 3.4575 7.7428 121.2276 54.8789 18.1151 179.6279 67 K 3.7476 8.0468 118.1579 59.5513 32.0510 178.4938 68 E 3.8804 7.8923 118.5457 59.0897 29.5122 177.6709 69 C 4.3894 7.4136 113.1402 58.1507 29.2329 173.2696 70 E 3.6719 7.8819 119.7483 57.1453 27.2242 175.6789 71 V 3.6731 7.7033 117.8454 62.7475 32.4827 173.8960 72 T 4.3095 8.4043 115.0057 63.1183 70.5919 174.3946 73 A 4.3495 7.6813 124.8798 50.8630 19.5385 176.2176 74 M 4.6534 8.2340 119.9160 52.5627 34.6611 174.4231 75 P 4.6255 0.0000 0.0000 62.9979 33.5016 175.1186 76 T 4.8077 8.3974 117.3045 61.8872 71.9304 172.9321 77 F 5.2702 9.2846 126.3416 56.2176 40.8681 174.9473 78 V 4.8201 9.0418 125.2156 61.3417 33.3603 174.4303 79 L 5.1518 9.2030 128.5386 53.2771 44.0791 175.8269 80 G 4.4999 9.0964 109.4519 44.4069 0.0000 171.5336 81 K 4.9540 8.7102 123.0821 55.0321 35.9229 175.9920 82 D 4.1969 9.8022 128.0660 55.6869 38.7907 174.5738 83 G 4.4144 9.1984 102.9518 45.5495 0.0000 173.3429 84 Q 4.5487 7.5549 116.0976 54.1760 31.6635 173.9180 85 L 4.6306 8.2853 119.7096 54.7057 42.4737 176.8436 86 I 4.4099 8.2463 115.4259 61.5091 40.1760 175.0973 87 G 4.0830 7.3118 107.7089 45.8969 0.0000 172.1285 88 K 5.3898 8.7746 118.1328 54.5017 35.9958 176.2093 89 I 4.5911 9.0586 123.8274 59.7303 39.9687 174.4689 90 I 4.6302 8.7985 127.9510 60.7330 38.9745 176.5413 91 G 3.9632 9.1746 112.2481 45.1593 0.0000 174.1418 92 A 4.4545 8.0530 122.4019 51.1849 16.8011 177.6780 93 N 4.8741 7.5794 120.0881 49.5841 39.7522 172.6674 94 P 4.1431 0.0000 0.0000 65.1101 31.6160 178.1209 95 T 3.8140 7.7427 113.9259 66.6922 68.5511 176.5844 96 A 4.0116 8.1568 122.6365 54.8113 18.3250 179.5331 97 L 3.7342 7.9320 119.0162 58.2514 42.1325 178.7615 98 E 3.7642 8.1761 119.3467 58.9962 29.4710 178.5149 99 K 3.9288 8.1276 119.8017 59.5496 32.0172 178.8877 100 G 3.5866 7.7425 104.5097 47.9094 0.0000 175.3386 101 I 3.6762 7.6843 122.3032 64.0021 36.8317 178.7388 102 K 4.0100 7.8005 118.2375 59.2863 31.9305 178.5008 103 D 4.5497 7.5589 116.9148 55.5753 40.9722 176.3975 104 L 4.1393 7.5518 124.5041 54.9419 41.6003 176.6873 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 S 8.32 4.43 0.00 3.97 3.97 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 0 S 8.12 4.35 0.00 3.97 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 1 Y 8.60 4.00 0.00 3.01 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 2 T 7.59 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 1.31 0.00 0.00 3 S 7.59 4.50 0.00 3.97 3.98 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 4 I 7.34 3.93 2.08 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 1.43 0.39 0.96 0.00 0.00 5 T 8.56 3.91 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 1.21 0.00 0.00 6 K 8.43 4.95 0.00 1.74 1.69 0.00 1.87 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.63 7.81 7 L 8.77 4.60 0.00 1.54 1.66 1.04 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 8 T 9.05 4.59 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 1.26 0.00 0.00 9 N 7.56 4.97 0.00 2.99 2.92 0.00 0.00 6.24 6.67 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 10 L 8.46 4.20 0.00 1.77 1.87 0.98 0.69 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 11 T 8.00 3.90 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 12 E 9.07 3.92 0.00 2.10 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 0.00 2.35 2.34 0.00 13 F 8.37 4.21 0.00 3.19 3.34 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 14 R 8.35 3.48 0.00 1.88 1.90 0.00 3.21 0.00 0.00 3.42 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.11 0.00 15 N 8.16 4.36 0.00 2.91 2.84 0.00 0.00 6.69 6.90 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 16 L 7.99 4.09 0.00 1.88 1.64 0.93 0.77 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 17 I 7.41 3.69 1.78 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.38 0.80 0.00 0.00 18 K 7.49 4.12 0.00 1.81 1.84 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.51 7.81 19 Q 7.87 4.16 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 20 N 7.31 5.15 0.00 2.71 2.64 0.00 0.00 6.57 7.96 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 21 D 8.78 4.64 0.00 2.74 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 22 K 7.81 5.03 0.00 1.76 1.61 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.76 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.40 7.81 23 L 8.91 5.07 0.00 1.64 1.36 0.95 0.48 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 24 V 8.71 4.72 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 1.17 0.00 0.00 0.38 0.00 0.00 25 I 8.96 4.73 1.95 0.00 0.00 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 1.13 0.69 0.29 0.00 0.00 26 D 9.16 4.70 0.00 3.14 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 27 F 9.18 5.08 0.00 3.09 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Y 8.91 5.12 0.00 2.93 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 29 A 8.00 4.63 0.27 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 0.00 0.00 0.00 0.00 0.00 30 T 8.59 3.95 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31 W 7.18 4.46 0.00 3.55 3.27 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 0.00 0.00 0.00 32 C 7.41 4.60 0.00 1.71 2.51 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 33 G 8.77 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 34 P 0.00 4.26 0.00 2.17 2.15 0.00 3.61 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 35 C 7.94 4.26 0.00 2.99 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 36 K 7.82 3.83 0.00 1.94 1.80 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.40 1.53 7.81 37 M 7.98 3.97 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.77 0.00 38 M 7.92 4.32 0.00 2.30 2.32 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 2.87 2.94 0.00 39 Q 7.58 3.55 0.00 1.86 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.80 0.00 0.00 0.00 0.00 0.00 1.16 2.05 0.00 40 P 0.00 4.18 0.00 2.00 2.01 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 41 H 8.01 4.10 0.00 3.38 3.31 0.00 5.82 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.24 3.86 0.00 1.94 1.86 1.17 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.04 3.81 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 1.17 0.00 0.00 44 K 7.90 3.97 0.00 1.97 1.83 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.53 7.81 45 L 8.08 4.19 0.00 1.68 1.87 0.88 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.35 2.91 1.74 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 0.70 -0.36 0.81 0.00 0.00 47 Q 7.63 4.09 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.02 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 48 A 8.04 4.01 1.09 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 0.00 0.00 49 Y 7.91 4.80 0.00 3.51 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 50 P 0.00 4.47 0.00 2.20 2.20 0.00 3.75 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 2.00 1.94 0.00 51 D 8.19 4.55 0.00 2.85 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 V 7.72 4.33 2.31 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 0.17 0.00 0.00 0.94 0.00 0.00 53 R 8.88 4.41 0.00 2.03 1.87 0.00 3.23 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 1.60 1.66 0.00 54 F 9.10 5.29 0.00 2.91 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 55 V 9.07 4.89 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 0.81 0.00 0.00 0.97 0.00 0.00 56 K 8.90 5.16 0.00 1.92 1.82 0.00 0.62 0.00 0.00 0.70 0.00 0.00 2.65 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.37 1.46 7.81 57 C 9.27 4.72 0.00 2.50 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 0.00 0.00 0.00 58 D 8.48 3.86 0.00 2.40 2.36 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 0.00 0.00 0.00 0.00 59 V 8.41 3.63 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 0.86 0.00 0.00 0.98 0.00 0.00 60 D 8.19 4.52 0.00 2.91 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 61 E 8.36 4.09 0.00 1.91 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 2.28 2.33 0.00 62 S 8.27 4.77 0.00 3.90 3.70 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 63 P 0.00 4.50 0.00 2.23 2.29 0.00 3.85 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.87 0.00 64 D 8.00 4.29 0.00 2.85 2.94 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 65 I 7.59 3.39 1.83 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 1.40 0.80 0.37 0.00 0.00 66 A 7.74 3.46 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.05 3.75 0.00 1.90 1.90 0.00 1.48 0.00 0.00 1.52 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.44 7.81 68 E 7.89 3.88 0.00 2.01 1.87 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 2.58 2.46 0.00 69 C 7.41 4.39 0.00 2.35 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 70 E 7.88 3.67 0.00 1.98 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 2.21 2.33 0.00 71 V 7.70 3.67 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 0.64 0.00 0.00 0.06 0.00 0.00 72 T 8.40 4.31 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 1.18 0.00 0.00 73 A 7.68 4.35 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 74 M 8.23 4.65 0.00 1.77 1.88 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 2.21 2.42 0.00 75 P 0.00 4.63 0.00 1.40 2.03 0.00 3.65 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.11 0.00 76 T 8.40 4.81 4.20 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 1.21 0.00 0.00 77 F 9.28 5.27 0.00 3.11 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 78 V 9.04 4.82 2.38 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 1.15 0.00 0.00 1.20 0.00 0.00 79 L 9.20 5.15 0.00 1.59 1.51 0.87 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 80 G 9.10 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 81 K 8.71 4.95 0.00 1.76 1.58 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.31 1.39 7.81 82 D 9.80 4.20 0.00 2.78 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 83 G 9.20 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 84 Q 7.55 4.55 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.96 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 85 L 8.29 4.63 0.00 1.69 1.68 1.09 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.25 4.41 1.87 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 1.25 0.67 0.95 0.00 0.00 87 G 7.31 4.08 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 0.00 0.00 0.00 88 K 8.77 5.39 0.00 1.63 1.73 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.46 7.81 89 I 9.06 4.59 2.05 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 1.26 0.89 0.98 0.00 0.00 90 I 8.80 4.63 1.91 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 1.30 0.61 0.93 0.00 0.00 91 G 9.17 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 92 A 8.05 4.45 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 93 N 7.58 4.87 0.00 2.71 2.69 0.00 0.00 7.06 7.71 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 94 P 0.00 4.14 0.00 2.08 1.84 0.00 3.58 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 1.91 1.76 0.00 95 T 7.74 3.81 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 1.20 0.00 0.00 96 A 8.16 4.01 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 97 L 7.93 3.73 0.00 1.52 1.63 0.60 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.18 3.76 0.00 2.13 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 2.34 2.30 0.00 99 K 8.13 3.93 0.00 1.86 1.93 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.45 7.81 100 G 7.74 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 I 7.68 3.68 1.53 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 1.26 0.46 0.22 0.00 0.00 102 K 7.80 4.01 0.00 1.87 1.89 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.64 1.63 7.81 103 D 7.56 4.55 0.00 2.76 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 0.00 104 L 7.55 4.14 0.00 1.70 1.53 0.78 0.84 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