NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6559 8.1633 120.3582 55.4056 34.3015 177.4291 2 L 4.7780 8.3176 123.9019 51.5271 40.2960 174.4586 3 Q 4.3618 10.1866 130.4828 58.8871 34.3647 174.3183 4 P 3.8858 0.0000 0.0000 63.4460 27.5453 175.2253 5 K 3.7454 8.1580 113.1864 57.5707 31.6679 174.3142 6 R 3.6715 9.0618 119.6374 55.3351 28.5509 174.1963 7 T 3.4816 8.1533 119.6253 63.0115 68.5341 173.1473 8 K 3.8928 8.8126 127.5054 57.0893 33.0090 178.0441 9 F 3.9312 8.3779 129.6094 59.4318 41.6151 177.3466 10 R 4.4342 6.4172 113.7993 55.3585 31.0172 177.6940 11 K 3.9808 9.1288 124.9128 58.3798 31.7005 178.0403 12 M 3.0629 10.0412 111.8268 56.5714 30.4019 177.1286 13 H 3.8253 8.1254 116.9718 56.3685 27.0549 177.7409 14 K 4.4877 8.0897 122.0217 58.0978 32.8373 174.3027 15 G 4.0452 7.9485 114.1911 46.0555 0.0000 171.2696 16 R 4.2406 7.9006 117.7457 56.4766 34.0400 171.5725 17 N 3.9645 8.4725 107.8745 53.3663 39.1860 174.5312 18 R 4.1394 8.0349 118.8804 54.8915 30.1021 178.7924 19 G 3.9616 8.2223 104.6761 45.4841 0.0000 170.8723 20 L 5.0861 7.9609 118.2042 54.5953 45.6702 175.1254 21 A 4.3035 7.8622 129.6927 53.2267 24.9832 179.5352 22 Q 4.7296 8.9258 122.1422 56.7508 31.8339 175.8695 23 G 3.9448 7.8872 109.7109 45.1796 0.0000 175.5027 24 T 4.2684 8.1101 119.6239 62.1003 69.1279 171.4469 25 D 4.7386 8.2681 126.9369 52.4571 43.1387 175.0025 26 V 4.3852 8.1917 119.1861 62.2090 34.5735 175.7244 27 S 4.9968 7.9042 111.3450 58.4469 65.3197 175.4091 28 F 5.4760 8.8629 123.7530 57.9041 42.9541 175.7207 29 G 4.1532 9.2213 104.8537 45.3740 0.0000 174.6402 30 S 4.7896 5.8775 113.8237 55.3627 64.0629 173.0548 31 F 4.9386 7.3338 118.3758 58.6891 41.8233 170.6187 32 G 4.2435 6.7008 113.8756 45.3934 0.0000 175.3175 33 L 4.9467 8.0425 125.7526 54.5714 43.5218 168.8827 34 K 4.5684 8.1877 123.0663 55.2036 32.9896 176.1673 35 A 4.5483 8.4228 130.0326 51.8786 20.1070 175.9712 36 V 4.3356 8.9103 117.7193 61.2276 35.0839 172.9190 37 G 3.7384 8.4203 111.0926 45.0181 0.0000 173.0492 38 R 3.9767 7.4073 118.1536 56.2939 31.4177 177.8369 39 G 3.9767 7.2212 105.3269 46.7908 0.0000 174.8781 40 R 4.4915 8.6743 127.0475 54.3352 32.5450 175.4793 41 L 4.5154 8.4525 128.2016 53.4703 42.6274 178.2594 42 T 4.2079 8.7307 113.9030 61.3869 67.9091 175.4120 43 A 4.0063 8.1850 124.6754 53.6513 18.3805 179.6660 44 R 4.0446 8.2283 115.8698 57.6844 30.0283 178.4254 45 Q 4.1301 7.8178 121.1395 59.4049 29.1227 177.3150 46 I 3.6501 7.5902 119.4581 64.5437 37.4037 177.4932 47 E 4.1685 8.2012 118.5139 57.7965 29.4029 177.9613 48 A 3.9108 7.9225 121.7907 55.3830 18.4787 178.3449 49 A 4.5120 7.9087 116.7684 52.3731 18.3644 178.7138 50 R 4.2947 7.5874 120.6276 59.0863 30.6694 178.4486 51 R 3.9306 7.9771 121.0523 58.7889 29.8320 177.8903 52 A 4.3154 7.9912 120.8091 54.5746 19.2968 179.0048 53 M 4.1230 7.6727 113.7351 57.4407 32.9637 176.4897 54 T 4.7203 6.9094 109.1005 60.3450 69.5210 173.9307 55 R 3.9222 8.3352 126.0738 58.3363 29.3404 176.4711 56 A 4.3425 9.0530 120.9939 52.6271 20.1090 179.9057 57 V 3.9064 7.6421 116.0841 62.1106 29.1806 174.5145 58 K 4.0180 7.9971 121.9622 55.4395 32.9833 176.6132 59 R 4.1904 8.4483 122.5383 56.4182 28.7889 174.0365 60 Q 4.4736 8.1827 118.8013 54.6217 30.9900 176.9082 61 G 3.7900 9.4883 109.8493 44.9449 0.0000 172.3463 62 K 3.8853 7.6662 122.6947 55.6650 33.2323 174.4795 63 I 4.2125 7.4773 122.1865 59.4017 40.6016 174.8878 64 W 4.8471 7.8349 125.1404 56.6602 31.7476 173.8395 65 I 4.1111 7.8455 112.2883 59.8276 39.1877 177.6865 66 R 4.2583 8.0410 123.0286 54.1540 28.6384 175.3806 67 V 3.1766 6.1359 116.5334 60.3559 34.9538 174.7411 68 F 5.0034 7.9206 118.5950 55.2178 43.7024 174.6457 69 P 4.6517 0.0000 0.0000 64.2166 30.9218 176.7016 70 D 5.1054 8.9964 110.8731 53.6150 39.1131 177.2266 71 K 5.4483 8.0240 134.3364 56.8941 32.7703 172.7585 72 P 3.2028 0.0000 0.0000 62.8058 32.2798 175.1834 73 I 3.6769 7.0485 121.3860 58.8875 37.4482 175.0712 74 T 4.3293 7.3126 117.3166 63.7825 68.9982 171.3484 75 E 4.7613 8.2291 124.8816 54.3962 33.8257 174.7027 76 K 4.6292 8.1012 118.0248 54.5308 35.4421 174.5802 77 P 4.3392 0.0000 0.0000 64.1697 31.7585 178.4719 78 L 4.3970 7.1864 113.1659 53.7922 43.6872 174.5333 79 A 4.6012 7.9555 121.2190 50.6175 20.4030 177.6675 80 V 3.2557 7.2890 122.0655 63.9201 32.8817 176.4084 81 R 5.6203 7.4706 129.2034 57.0688 29.7815 175.2569 82 M 4.0519 7.5822 116.9472 57.2599 32.4111 177.4140 83 G 3.7067 7.1124 110.1947 41.5677 0.0000 179.1360 84 K 3.3497 9.1734 117.6526 54.6154 33.2360 174.6173 85 G 3.9764 9.4156 112.0003 46.2479 0.0000 175.9616 86 K 3.3712 8.8149 112.5861 59.2331 31.4168 178.5278 87 G 3.9131 8.9034 110.6535 46.7769 0.0000 172.9650 88 N 4.4999 8.6623 118.4015 54.5760 40.8205 176.2572 89 V 3.6917 7.9168 112.4367 61.8642 30.8263 172.8749 90 E 4.5262 7.9549 117.3402 54.6514 34.9755 174.7150 91 Y 3.5943 8.1787 118.4115 58.3416 35.3384 169.3594 92 W 4.6211 8.2553 119.6469 57.8838 29.4657 176.4303 93 V 4.4457 8.4198 116.5906 60.2308 33.4618 175.1249 94 A 4.9704 8.3189 124.0150 51.1669 20.5910 176.2852 95 L 4.0036 7.9536 118.2947 56.1604 42.9851 173.3474 96 I 4.7074 8.5271 118.0830 61.9008 41.7073 176.1055 97 Q 5.1897 7.4760 121.5266 54.7590 30.1327 172.6477 98 P 4.9206 0.0000 0.0000 60.7682 34.1939 175.7375 99 G 4.3700 8.3680 108.5695 45.8612 0.0000 174.0074 100 K 4.5216 7.7759 119.6005 54.4869 31.5823 175.7182 101 V 4.3683 8.0501 121.2559 62.9448 39.9640 172.8383 102 L 4.4796 7.9420 121.5582 54.0823 41.3239 174.0676 103 Y 4.5931 8.3239 116.3932 57.6785 41.2234 175.4272 104 E 4.2487 8.2718 124.0442 56.5993 30.2096 175.9350 105 M 4.9043 7.8585 119.5511 53.9701 34.5828 172.5818 106 D 4.8051 8.6215 116.7830 52.4636 44.3755 175.0942 107 G 3.7054 8.4136 105.4464 44.8966 0.0000 174.0925 108 V 3.6031 7.8393 111.1382 60.5030 30.3189 175.6507 109 P 3.3477 0.0000 0.0000 65.3341 31.7142 178.7174 110 E 3.8393 7.7554 116.7813 59.7448 29.3909 179.2728 111 E 4.0783 7.3713 114.0225 57.2795 29.5880 176.0212 112 L 4.4782 8.1155 115.7768 56.4345 44.2414 178.1052 113 A 4.9747 8.0066 121.2009 51.7547 18.4920 177.7472 114 R 4.8044 8.2176 118.5522 56.6175 33.2787 175.6599 115 E 4.2824 8.0580 114.5134 58.0952 29.6675 176.9099 116 A 4.6382 7.7963 121.1426 52.0717 21.0901 178.1843 117 F 4.3205 8.0805 118.7252 61.6686 39.1082 177.0139 118 K 3.4181 7.6990 115.3742 57.6911 32.0191 177.1754 119 L 4.5114 8.0833 117.4600 53.9526 42.2883 175.4017 120 A 4.7492 8.5463 123.2806 50.1738 20.9895 177.2820 121 A 4.0510 8.8154 124.8582 54.0791 19.0330 177.0312 122 A 4.6922 7.6135 116.7859 50.7723 21.6791 176.2409 123 K 4.5867 7.4606 114.2353 54.8311 36.0952 175.8751 124 L 4.3239 7.3098 116.9651 55.0456 42.4060 172.5060 125 P 4.7549 0.0000 0.0000 60.4136 33.9962 175.9339 126 I 3.5951 8.5290 115.8342 61.0709 36.4957 174.7427 127 K 4.4070 10.5995 121.2093 56.0633 32.6978 175.2025 128 T 4.5293 8.1762 115.5907 61.3264 70.6026 172.2771 129 T 4.6711 8.5427 125.7702 61.9575 69.0716 174.0425 130 F 4.5745 9.0086 120.5302 56.8332 38.1432 175.6048 131 V 3.9565 6.6521 114.6054 60.0180 32.9201 177.1154 132 T 4.2464 8.2304 124.0117 61.5653 66.4274 174.9969 133 K 4.6515 7.3582 121.5078 55.7602 32.7867 174.7739 134 T 4.4501 7.8439 110.4807 62.7310 71.0951 175.8289 135 V 4.2399 7.1328 114.2030 58.7175 32.2410 175.2341 136 M 3.4366 8.2758 121.9822 55.3867 31.2370 176.7925 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 4.66 0.00 2.14 1.36 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.68 0.00 2 L 8.32 4.78 0.00 1.79 0.98 0.95 0.54 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 3 Q 10.19 4.36 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.67 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 4 P 0.00 3.89 0.00 2.11 2.25 0.00 3.85 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 2.01 2.12 0.00 5 K 8.16 3.75 0.00 1.87 1.76 0.00 1.41 0.00 0.00 0.61 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.90 1.30 7.81 6 R 9.06 3.67 0.00 2.02 1.88 0.00 3.36 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 7 T 8.15 3.48 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 1.17 0.00 0.00 8 K 8.81 3.89 0.00 1.91 1.97 0.00 1.91 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.48 1.50 7.81 9 F 8.38 3.93 0.00 2.97 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 0.00 0.00 0.00 10 R 6.42 4.43 0.00 0.67 0.69 0.00 3.30 0.00 0.00 3.08 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.23 0.00 11 K 9.13 3.98 0.00 1.86 1.35 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.50 1.49 7.81 12 M 10.04 3.06 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.67 0.00 13 H 8.13 3.83 0.00 3.31 3.14 0.00 5.77 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.09 4.49 0.00 1.76 1.79 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.14 1.28 7.81 15 G 7.95 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 R 7.90 4.24 0.00 1.72 1.80 0.00 3.25 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.49 0.00 17 N 8.47 3.96 0.00 2.79 3.00 0.00 0.00 6.66 7.65 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 18 R 8.03 4.14 0.00 1.93 1.66 0.00 3.34 0.00 0.00 3.25 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 19 G 8.22 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 20 L 7.96 5.09 0.00 1.57 1.59 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.86 4.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 8.93 4.73 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 23 G 7.89 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.11 4.27 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 1.20 0.00 0.00 25 D 8.27 4.74 0.00 2.71 2.52 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 26 V 8.19 4.39 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 0.75 0.00 0.00 0.86 0.00 0.00 27 S 7.90 5.00 0.00 3.93 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 28 F 8.86 5.48 0.00 2.66 2.64 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 0.00 0.00 0.00 0.00 29 G 9.22 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 30 S 5.88 4.79 0.00 4.09 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 7.33 4.94 0.00 3.34 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 32 G 6.70 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 0.00 0.00 0.00 0.00 33 L 8.04 4.95 0.00 1.64 1.47 1.04 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.19 4.57 0.00 1.92 1.65 0.00 1.81 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.49 7.81 35 A 8.42 4.55 1.23 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 0.00 0.00 36 V 8.91 4.34 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 0.66 0.00 0.00 0.89 0.00 0.00 37 G 8.42 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 38 R 7.41 3.98 0.00 2.10 2.12 0.00 3.11 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 39 G 7.22 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 0.00 0.00 0.00 40 R 8.67 4.49 0.00 1.61 1.44 0.00 2.96 0.00 0.00 3.39 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.63 0.00 41 L 8.45 4.52 0.00 1.80 1.60 0.89 0.34 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 42 T 8.73 4.21 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 43 A 8.19 4.01 1.57 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 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.23 4.04 0.00 2.04 2.17 0.00 3.11 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.83 0.00 45 Q 7.82 4.13 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 46 I 7.59 3.65 1.96 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 1.41 0.79 0.89 0.00 0.00 47 E 8.20 4.17 0.00 2.10 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 2.38 2.45 0.00 48 A 7.92 3.91 1.36 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 0.00 0.00 49 A 7.91 4.51 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 50 R 7.59 4.29 0.00 2.03 2.04 0.00 3.19 0.00 0.00 3.19 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.61 0.00 51 R 7.98 3.93 0.00 1.85 2.03 0.00 3.27 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.93 0.00 52 A 7.99 4.32 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 M 7.67 4.12 0.00 2.07 2.23 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.65 0.00 54 T 6.91 4.72 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 1.28 0.00 0.00 55 R 8.34 3.92 0.00 1.95 1.73 0.00 3.23 0.00 0.00 3.24 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 56 A 9.05 4.34 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 57 V 7.64 3.91 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 0.92 0.00 0.00 0.97 0.00 0.00 58 K 8.00 4.02 0.00 1.79 1.76 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.52 7.81 59 R 8.45 4.19 0.00 1.78 1.94 0.00 3.22 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 60 Q 8.18 4.47 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.14 0.00 0.00 0.00 0.00 0.00 2.47 2.25 0.00 61 G 9.49 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 0.00 0.00 0.00 62 K 7.67 3.89 0.00 1.93 1.82 0.00 1.60 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.33 7.81 63 I 7.48 4.21 1.79 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.80 0.92 0.00 0.00 64 W 7.83 4.85 0.00 3.07 3.22 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 65 I 7.85 4.11 1.85 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 1.59 0.63 0.95 0.00 0.00 66 R 8.04 4.26 0.00 1.90 1.83 0.00 2.76 0.00 0.00 3.05 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.39 0.00 67 V 6.14 3.18 1.78 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 0.57 0.00 0.00 0.79 0.00 0.00 68 F 7.92 5.00 0.00 2.99 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 69 P 0.00 4.65 0.00 2.22 2.02 0.00 3.98 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 2.08 2.07 0.00 70 D 9.00 5.11 0.00 2.81 3.15 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 71 K 8.02 5.45 0.00 2.03 1.95 0.00 1.70 0.00 0.00 1.88 0.00 0.00 3.29 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.35 1.35 7.81 72 P 0.00 3.20 0.00 1.86 1.62 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.05 0.00 73 I 7.05 3.68 1.41 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 1.27 0.36 0.47 0.00 0.00 74 T 7.31 4.33 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 1.14 0.00 0.00 75 E 8.23 4.76 0.00 1.76 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 2.07 2.01 0.00 76 K 8.10 4.63 0.00 1.77 1.68 0.00 1.55 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.26 1.41 7.81 77 P 0.00 4.34 0.00 2.05 2.11 0.00 3.69 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 2.01 2.08 0.00 78 L 7.19 4.40 0.00 1.56 1.58 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 79 A 7.96 4.60 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 80 V 7.29 3.26 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 0.84 0.00 0.00 0.93 0.00 0.00 81 R 7.47 5.62 0.00 2.12 2.13 0.00 3.03 0.00 0.00 3.33 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.37 0.00 82 M 7.58 4.05 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 83 G 7.11 3.71 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 0.00 0.00 0.00 84 K 9.17 3.35 0.00 1.79 1.65 0.00 1.61 0.00 0.00 1.92 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.46 7.81 85 G 9.42 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 0.00 0.00 0.00 86 K 8.81 3.37 0.00 1.71 1.62 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.46 7.81 87 G 8.90 3.91 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 0.00 88 N 8.66 4.50 0.00 2.56 2.51 0.00 0.00 7.03 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 89 V 7.92 3.69 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 0.52 0.00 0.00 0.89 0.00 0.00 90 E 7.95 4.53 0.00 1.43 1.12 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 1.91 1.79 0.00 91 Y 8.18 3.59 0.00 3.13 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 92 W 8.26 4.62 0.00 3.29 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 93 V 8.42 4.45 2.43 0.00 0.00 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 1.04 0.00 0.00 94 A 8.32 4.97 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 95 L 7.95 4.00 0.00 1.64 1.71 0.88 0.56 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 96 I 8.53 4.71 1.85 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 1.41 0.59 0.90 0.00 0.00 97 Q 7.48 5.19 0.00 1.82 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.85 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 98 P 0.00 4.92 0.00 1.99 2.06 0.00 3.54 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 99 G 8.37 4.37 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 0.00 100 K 7.78 4.52 0.00 1.49 1.58 0.00 1.86 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.23 1.48 7.81 101 V 8.05 4.37 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 0.85 0.00 0.00 0.96 0.00 0.00 102 L 7.94 4.48 0.00 2.26 2.33 0.92 0.66 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 0.00 103 Y 8.32 4.59 0.00 3.56 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 0.00 104 E 8.27 4.25 0.00 2.11 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 0.00 1.47 1.66 0.00 105 M 7.86 4.90 0.00 1.97 2.20 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.58 0.00 106 D 8.62 4.81 0.00 2.59 2.48 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 0.00 0.00 0.00 0.00 107 G 8.41 3.71 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 0.00 0.00 0.00 108 V 7.84 3.60 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 0.74 0.00 0.00 0.90 0.00 0.00 109 P 0.00 3.35 0.00 1.13 1.30 0.00 3.41 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 110 E 7.76 3.84 0.00 2.01 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 0.00 2.66 2.26 0.00 111 E 7.37 4.08 0.00 1.97 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 2.28 2.26 0.00 112 L 8.12 4.48 0.00 1.45 1.45 0.58 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 113 A 8.01 4.97 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 0.00 0.00 0.00 0.00 0.00 114 R 8.22 4.80 0.00 2.10 1.97 0.00 3.39 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 115 E 8.06 4.28 0.00 2.15 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 2.36 2.32 0.00 116 A 7.80 4.64 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 0.00 117 F 8.08 4.32 0.00 2.99 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 0.00 118 K 7.70 3.42 0.00 1.36 1.62 0.00 1.00 0.00 0.00 1.43 0.00 0.00 2.92 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.21 1.40 7.81 119 L 8.08 4.51 0.00 1.84 1.68 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.55 4.75 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 0.00 121 A 8.82 4.05 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 0.00 122 A 7.61 4.69 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 0.00 123 K 7.46 4.59 0.00 1.83 1.51 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.33 7.81 124 L 7.31 4.32 0.00 1.44 1.44 0.94 -0.03 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 0.00 125 P 0.00 4.75 0.00 2.02 1.98 0.00 3.81 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.97 0.00 126 I 8.53 3.60 2.36 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.39 1.28 0.00 0.00 127 K 10.60 4.41 0.00 1.95 1.93 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.33 7.81 128 T 8.18 4.53 4.55 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 129 T 8.54 4.67 4.36 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 1.17 0.00 0.00 130 F 9.01 4.57 0.00 3.24 3.19 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 0.00 131 V 6.65 3.96 1.77 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 0.08 0.00 0.00 0.82 0.00 0.00 132 T 8.23 4.25 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 1.22 0.00 0.00 133 K 7.36 4.65 0.00 1.62 1.60 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.31 7.81 134 T 7.84 4.45 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 1.19 0.00 0.00 135 V 7.13 4.24 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.90 0.00 0.00 136 M 8.28 3.44 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00