NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2149 8.1727 120.1313 56.8026 34.7965 174.0585 2 V 4.5138 8.0905 122.1011 60.9176 32.2083 174.7416 3 F 4.4540 10.0034 129.2162 57.3989 40.1225 175.1899 4 E 4.1830 8.9813 121.2529 56.1496 30.5983 177.5641 5 R 3.3644 9.0002 122.2409 60.4191 30.0517 179.6815 6 C 4.3388 8.0298 115.3264 59.5769 41.4177 175.4569 7 E 3.9038 8.1895 120.7209 59.3310 29.1429 178.5602 8 L 3.5254 8.1084 120.0829 57.7868 42.0580 178.6263 9 A 3.9257 7.8671 120.6944 55.4612 18.3215 179.9344 10 R 3.9073 8.0420 116.4063 59.4554 30.0056 179.4515 11 T 3.8448 7.9860 115.6482 66.6805 68.4770 176.6516 12 L 3.8474 8.0825 121.2186 57.4826 41.6101 179.5082 13 K 3.9008 8.1072 119.5558 59.7029 31.9812 179.1792 14 R 4.0155 7.9446 116.8794 58.6726 29.9689 178.0087 15 L 4.4067 7.3301 116.4344 54.3198 41.7023 177.2391 16 G 3.9029 7.8648 106.9550 46.3378 0.0000 174.9950 17 M 3.9339 7.8688 121.2986 56.7576 32.2285 175.7271 18 D 4.4151 8.0491 118.0424 55.6197 41.1142 175.7581 19 G 3.9418 9.3697 115.6029 45.4903 0.0000 171.4060 20 Y 4.2319 8.2820 122.0179 58.7101 39.0425 176.4250 21 R 3.6471 8.9837 127.4362 57.2808 27.7983 177.2267 22 G 3.8106 8.1862 103.3386 45.5422 0.0000 173.7725 23 I 4.0933 7.5362 121.9389 59.1682 38.0405 175.8039 24 S 4.6241 8.3094 120.9827 58.0472 64.8812 174.8955 25 L 4.2606 8.8277 123.4026 58.3458 41.3398 179.9324 26 A 4.1223 8.1162 120.0063 55.2214 18.3170 179.3077 27 N 4.3994 8.0437 115.2775 56.3239 38.5799 177.6469 28 W 4.3488 7.9307 119.9107 60.0029 29.0130 178.5244 29 M 4.1523 8.5139 118.8829 58.6075 31.4448 177.9429 30 C 3.3160 8.1452 118.7961 59.0920 43.5251 175.2759 31 L 3.9684 8.1850 121.7313 58.3296 41.7533 178.9126 32 A 4.1652 8.3555 120.7112 54.8652 18.2942 179.4149 33 K 2.8709 8.3354 118.4622 59.3882 32.0384 179.0610 34 W 4.2975 7.7938 117.2536 59.1128 29.1088 178.4637 35 E 4.3371 8.4602 118.8498 58.8252 29.1562 177.9306 36 S 4.5348 7.6090 107.7866 56.5052 64.8654 173.7853 37 G 3.5056 8.4488 108.9302 47.0224 0.0000 173.2672 38 Y 3.6646 7.7302 112.5350 58.7540 34.9888 168.8395 39 N 5.3067 7.9126 118.9141 51.9456 40.2340 175.4035 40 T 4.1778 8.9947 117.5513 63.6689 69.2044 175.9501 41 R 4.4316 8.1193 117.0181 55.7684 30.3781 176.3983 42 A 4.3339 7.7619 122.0930 52.9285 19.4084 176.6384 43 T 5.0402 8.2588 110.1642 60.3169 72.4584 173.0066 44 N 4.8731 8.7774 121.7060 52.3838 42.2782 172.5706 45 Y 4.6465 8.7889 128.0911 57.4859 40.7312 173.8968 46 N 4.7806 8.5893 124.7599 51.3245 38.7376 175.5553 47 A 3.5731 8.2367 127.7923 54.5320 18.9917 179.1504 48 G 3.7114 8.0322 104.5709 48.0061 0.0000 173.8911 49 D 4.7259 7.5303 115.1421 52.1825 40.1475 176.2259 50 R 4.0761 8.1624 116.5327 57.0522 28.2763 175.9606 51 S 4.9226 7.8373 113.5973 57.5226 65.8978 173.0167 52 T 5.1454 8.8067 115.8877 61.9796 72.7571 172.8201 53 D 5.4292 8.9983 125.3115 53.2817 43.2021 175.0511 54 Y 4.8472 9.1710 120.8451 57.5068 41.4952 177.1363 55 G 4.5846 9.2436 112.4197 46.4112 0.0000 173.4245 56 I 3.7930 8.1642 116.8206 62.8446 38.0159 177.4966 57 F 4.8005 8.0140 115.8573 56.4264 39.8355 175.1452 58 Q 3.6285 7.9899 119.1990 57.0897 26.6707 174.2277 59 I 4.3085 8.0807 118.5246 61.3052 39.0463 176.5411 60 N 5.5366 9.0405 125.2797 52.6224 40.2461 175.7462 61 S 4.5632 9.1994 120.1943 60.8739 63.3887 175.4238 62 R 4.0420 8.9607 122.4052 58.9955 30.4180 177.5244 63 Y 4.0578 8.0682 117.9241 57.0027 40.9996 176.3499 64 W 4.9980 8.0003 118.6011 57.1708 31.8096 173.5990 65 C 5.5696 8.1586 111.5340 53.6860 44.8713 172.9385 66 N 5.0062 9.0108 119.4574 52.2166 39.8738 174.8695 67 D 4.7994 8.8992 123.9975 52.4346 40.4663 177.2016 68 G 4.0668 8.5695 108.7070 45.7159 0.0000 174.5879 69 K 4.4908 8.0953 115.9404 56.5479 33.2018 175.7421 70 T 4.5183 7.7513 117.5844 61.1450 69.3111 172.1708 71 P 4.3511 0.0000 0.0000 63.8669 31.7661 176.6237 72 G 3.8185 8.8878 108.7555 45.9792 0.0000 173.2822 73 A 4.4479 7.5826 120.6287 51.7567 19.4681 177.4714 74 V 4.3067 8.2061 112.5942 59.3105 35.4889 176.0972 75 N 4.9083 7.7350 116.1023 52.6555 37.8421 174.6696 76 A 3.9695 8.6924 123.7395 54.5918 19.2177 178.7654 77 C 4.4469 8.8293 111.4773 56.4373 40.7594 173.6316 78 H 4.0302 7.8600 114.3861 56.3239 27.5092 174.2486 79 L 4.8182 8.0753 117.0223 53.3873 46.3413 176.7944 80 S 4.5558 8.4004 115.4842 58.3803 63.1596 176.0877 81 C 3.9857 8.7377 124.5504 59.7278 40.7431 176.2381 82 S 3.9403 7.9102 114.8951 61.5497 61.5889 176.1463 83 A 4.1910 7.8893 122.3264 54.5348 18.4489 177.9805 84 L 4.4297 7.8461 116.1503 55.1818 41.8106 177.6376 85 L 5.0189 7.8051 117.4334 54.5290 42.2873 176.7291 86 Q 4.3378 7.8845 117.6470 55.4343 29.5162 176.0174 87 D 4.4062 8.6014 120.5030 57.2709 41.1104 176.8875 88 N 4.5268 8.0631 118.1591 53.4111 39.2633 174.6122 89 I 4.2719 8.4297 118.7404 60.9611 37.9672 177.0492 90 A 3.9354 8.4123 124.9065 55.8999 18.1545 180.0943 91 D 4.2481 8.0692 116.5311 57.4123 40.9131 178.5950 92 A 4.0781 8.0228 120.8350 55.2191 18.3075 179.7162 93 V 3.3568 8.2880 116.8716 66.0045 31.6132 177.9738 94 A 3.8185 8.1282 120.7983 55.3974 18.0735 178.8672 95 C 4.2004 8.4271 116.7241 59.6644 40.0324 175.5404 96 A 3.9460 8.2654 122.8196 55.0664 17.8241 179.7215 97 K 3.7588 7.9765 117.1675 59.4474 31.8112 179.3471 98 R 3.9402 7.6518 117.7308 59.4940 30.3332 178.1600 99 V 2.7348 7.6178 118.0493 65.8855 31.5176 177.8856 100 V 3.9651 7.7718 109.7438 62.5107 31.4186 178.1095 101 R 4.2471 7.7203 117.4686 57.4311 30.4000 176.4810 102 D 4.7715 7.5539 119.1625 52.6999 41.9749 175.4475 103 P 4.2527 0.0000 0.0000 66.1430 31.6091 178.4538 104 Q 4.0423 8.1692 116.0136 56.5721 29.9628 177.5070 105 G 3.6573 7.9847 107.5757 46.9355 0.0000 176.1230 106 I 3.5353 7.7579 119.8942 63.4350 37.9506 177.8616 107 R 4.2469 7.3218 117.2415 57.6396 30.0035 177.3093 108 A 3.9063 7.7465 121.3622 54.3150 18.6985 177.7135 109 W 4.6998 8.1662 117.0414 55.3900 29.7572 177.3943 110 V 3.7349 8.7618 123.8229 66.1029 30.9058 177.6286 111 A 4.0061 8.2768 120.0887 54.7469 18.1371 179.2568 112 W 3.9449 8.2744 126.5327 60.6977 30.6096 178.3186 113 R 3.9757 8.2150 117.6451 58.8509 29.6047 178.3371 114 N 4.3922 8.1096 115.2740 55.3062 38.6975 176.7461 115 R 4.1049 7.6736 115.8945 55.7187 32.0512 175.8366 116 C 4.5161 7.1494 113.6845 57.7130 41.7950 174.2758 117 Q 3.1835 6.8464 121.0362 56.9268 28.8012 175.8013 118 N 4.0566 8.6156 120.6612 54.3647 36.1748 173.9541 119 R 4.5186 7.3081 114.9511 54.0868 33.1401 175.7916 120 D 4.5586 8.4736 119.4306 54.1286 40.5270 175.8316 121 V 4.6089 8.1719 119.0879 61.2194 32.3477 178.5568 122 R 4.0819 8.3932 123.0229 59.1737 29.7293 179.0689 123 Q 4.0362 8.1396 115.6420 59.1592 28.5881 178.2373 124 Y 4.1659 7.9158 115.4859 60.0821 38.2736 176.8696 125 V 4.3180 7.7150 110.7429 60.6460 32.7961 175.3800 126 Q 4.1510 7.5704 121.7359 57.4634 29.1060 176.6796 127 G 3.9792 8.9522 112.9443 45.9218 0.0000 174.3671 128 C 4.4443 8.0168 115.6694 56.7940 40.6453 174.2537 129 G 3.8692 8.2300 107.3541 46.3234 0.0000 174.0954 130 V 4.0004 7.8065 118.0317 61.0876 31.9871 175.7913 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 K 8.17 4.21 0.00 1.63 2.07 0.00 1.07 0.00 0.00 1.13 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.11 7.81 2 V 8.09 4.51 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 0.81 0.00 0.00 0.95 0.00 0.00 3 F 10.00 4.45 0.00 2.80 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.98 4.18 0.00 1.98 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 2.35 2.26 0.00 5 R 9.00 3.36 0.00 1.97 1.95 0.00 3.37 0.00 0.00 3.44 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.83 0.00 6 C 8.03 4.34 0.00 3.00 3.11 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 0.00 0.00 0.00 0.00 7 E 8.19 3.90 0.00 2.06 2.23 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 2.60 2.43 0.00 8 L 8.11 3.53 0.00 1.30 1.33 -0.14 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.87 3.93 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 10 R 8.04 3.91 0.00 1.88 1.99 0.00 3.14 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 11 T 7.99 3.84 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 1.21 0.00 0.00 12 L 8.08 3.85 0.00 1.73 1.58 0.89 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.11 3.90 0.00 1.92 1.91 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 7.94 4.02 0.00 1.95 1.97 0.00 3.20 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 15 L 7.33 4.41 0.00 1.60 1.56 0.88 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.86 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 0.00 0.00 0.00 17 M 7.87 3.93 0.00 1.33 1.98 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.22 0.00 18 D 8.05 4.42 0.00 2.68 2.67 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 19 G 9.37 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 20 Y 8.28 4.23 0.00 3.38 3.20 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 21 R 8.98 3.65 0.00 1.85 1.81 0.00 3.21 0.00 0.00 3.00 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.34 0.00 22 G 8.19 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 23 I 7.54 4.09 1.80 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.63 -0.29 0.00 0.00 24 S 8.31 4.62 0.00 4.10 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 25 L 8.83 4.26 0.00 1.83 1.88 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.12 4.12 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 27 N 8.04 4.40 0.00 2.73 2.72 0.00 0.00 7.09 7.55 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 28 W 7.93 4.35 0.00 3.53 3.10 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 29 M 8.51 4.15 0.00 2.16 2.34 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.91 0.00 30 C 8.15 3.32 0.00 2.47 3.11 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 0.00 0.00 0.00 0.00 31 L 8.19 3.97 0.00 1.86 1.90 0.48 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.36 4.17 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 33 K 8.34 2.87 0.00 1.69 1.61 0.00 0.61 0.00 0.00 0.96 0.00 0.00 2.69 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.10 0.51 7.81 34 W 7.79 4.30 0.00 3.33 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 35 E 8.46 4.34 0.00 2.06 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 2.60 2.51 0.00 36 S 7.61 4.53 0.00 4.07 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 37 G 8.45 3.51 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 0.00 38 Y 7.73 3.66 0.00 3.30 2.99 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 39 N 7.91 5.31 0.00 2.84 2.84 0.00 0.00 7.03 6.53 0.00 0.00 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 T 8.99 4.18 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 1.44 0.00 0.00 41 R 8.12 4.43 0.00 1.98 2.10 0.00 3.08 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.58 0.00 42 A 7.76 4.33 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 43 T 8.26 5.04 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 1.24 0.00 0.00 44 N 8.78 4.87 0.00 2.85 2.75 0.00 0.00 7.03 7.33 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 45 Y 8.79 4.65 0.00 3.04 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 46 N 8.59 4.78 0.00 2.66 2.60 0.00 0.00 7.03 7.30 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 47 A 8.24 3.57 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 48 G 8.03 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 49 D 7.53 4.73 0.00 2.73 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 50 R 8.16 4.08 0.00 2.08 2.25 0.00 3.17 0.00 0.00 3.23 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.56 0.00 51 S 7.84 4.92 0.00 4.01 4.02 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 52 T 8.81 5.15 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 0.70 0.00 0.00 53 D 9.00 5.43 0.00 2.72 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 54 Y 9.17 4.85 0.00 3.03 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 55 G 9.24 4.58 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 0.00 0.00 0.00 56 I 8.16 3.79 1.69 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.16 0.01 0.00 0.00 57 F 8.01 4.80 0.00 3.26 2.97 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 58 Q 7.99 3.63 0.00 2.56 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 7.19 0.00 0.00 0.00 0.00 0.00 2.54 2.72 0.00 59 I 8.08 4.31 2.13 0.00 0.00 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 1.33 1.13 1.09 0.00 0.00 60 N 9.04 5.54 0.00 3.05 2.93 0.00 0.00 7.04 7.84 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 61 S 9.20 4.56 0.00 4.09 4.38 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 0.00 0.00 0.00 0.00 62 R 8.96 4.04 0.00 1.96 2.11 0.00 3.04 0.00 0.00 3.10 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 63 Y 8.07 4.06 0.00 2.45 1.46 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 64 W 8.00 5.00 0.00 3.53 3.24 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 65 C 8.16 5.57 0.00 3.01 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 66 N 9.01 5.01 0.00 2.82 2.69 0.00 0.00 7.06 9.08 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 67 D 8.90 4.80 0.00 2.86 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 68 G 8.57 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 0.00 0.00 0.00 69 K 8.10 4.49 0.00 1.89 1.90 0.00 1.62 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.64 1.47 7.81 70 T 7.75 4.52 4.30 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 1.27 0.00 0.00 71 P 0.00 4.35 0.00 2.19 2.08 0.00 3.92 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 72 G 8.89 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.58 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 74 V 8.21 4.31 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 0.65 0.00 0.00 0.35 0.00 0.00 75 N 7.73 4.91 0.00 2.71 2.55 0.00 0.00 6.93 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.69 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 C 8.83 4.45 0.00 3.15 3.16 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 78 H 7.86 4.03 0.00 3.32 3.39 0.00 5.70 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 79 L 8.08 4.82 0.00 1.68 1.51 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.40 4.56 0.00 3.82 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 81 C 8.74 3.99 0.00 2.24 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 82 S 7.91 3.94 0.00 3.88 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 83 A 7.89 4.19 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.85 4.43 0.00 1.94 1.83 1.04 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.81 5.02 0.00 1.79 1.72 1.14 1.01 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 86 Q 7.88 4.34 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.46 7.08 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 87 D 8.60 4.41 0.00 2.62 2.67 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 88 N 8.06 4.53 0.00 2.69 2.75 0.00 0.00 6.94 7.95 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 89 I 8.43 4.27 1.77 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.99 1.01 0.00 0.00 90 A 8.41 3.94 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 91 D 8.07 4.25 0.00 2.71 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 92 A 8.02 4.08 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 93 V 8.29 3.36 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 0.89 0.00 0.00 94 A 8.13 3.82 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 95 C 8.43 4.20 0.00 3.10 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 96 A 8.27 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.98 3.76 0.00 1.67 1.38 0.00 1.25 0.00 0.00 0.72 0.00 0.00 2.26 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.95 7.81 98 R 7.65 3.94 0.00 1.84 2.19 0.00 3.50 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.03 0.00 99 V 7.62 2.73 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 -0.13 0.00 0.00 -0.60 0.00 0.00 100 V 7.77 3.97 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 1.16 0.00 0.00 1.45 0.00 0.00 101 R 7.72 4.25 0.00 2.05 2.08 0.00 3.25 0.00 0.00 3.40 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.13 0.00 102 D 7.55 4.77 0.00 3.14 2.65 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 0.00 103 P 0.00 4.25 0.00 2.02 2.12 0.00 3.69 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 2.03 2.13 0.00 104 Q 8.17 4.04 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 5.90 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 105 G 7.98 3.66 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 0.00 0.00 0.00 106 I 7.76 3.54 1.00 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.19 -0.36 -0.53 0.00 0.00 107 R 7.32 4.25 0.00 2.07 2.04 0.00 3.24 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.56 0.00 108 A 7.75 3.91 0.81 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 0.00 109 W 8.17 4.70 0.00 3.46 3.24 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 0.00 110 V 8.76 3.73 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 1.25 0.00 0.00 0.99 0.00 0.00 111 A 8.28 4.01 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 0.00 112 W 8.27 3.94 0.00 3.47 3.50 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 0.00 113 R 8.21 3.98 0.00 2.00 2.00 0.00 3.39 0.00 0.00 2.74 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.02 0.00 114 N 8.11 4.39 0.00 2.67 2.69 0.00 0.00 6.87 8.13 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 0.00 115 R 7.67 4.10 0.00 1.31 0.66 0.00 2.21 0.00 0.00 2.36 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.12 0.00 116 C 7.15 4.52 0.00 1.65 2.62 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 0.00 117 Q 6.85 3.18 0.00 0.93 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.34 0.00 0.00 0.00 0.00 0.00 2.16 2.17 0.00 118 N 8.62 4.06 0.00 2.79 2.82 0.00 0.00 6.82 7.59 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 0.00 119 R 7.31 4.52 0.00 1.79 1.77 0.00 3.18 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.50 0.00 120 D 8.47 4.56 0.00 2.64 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.17 4.61 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 1.12 0.00 0.00 1.04 0.00 0.00 122 R 8.39 4.08 0.00 2.02 2.02 0.00 3.16 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 123 Q 8.14 4.04 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.83 0.00 0.00 0.00 0.00 0.00 2.15 1.60 0.00 124 Y 7.92 4.17 0.00 3.26 3.16 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 0.00 125 V 7.71 4.32 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 1.04 0.00 0.00 126 Q 7.57 4.15 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.62 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 127 G 8.95 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 0.00 128 C 8.02 4.44 0.00 3.09 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 0.00 129 G 8.23 3.87 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 0.00 0.00 0.00 130 V 7.81 4.00 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 0.83 0.00 0.00 0.96 0.00 0.00