NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3520 8.3044 118.1964 54.8861 32.1117 177.9522 2 D 4.5148 8.8286 121.8630 50.6852 42.4403 171.7745 3 I 4.2146 7.9460 116.6060 59.8697 41.0580 172.8131 4 D 4.8680 8.2748 122.7736 51.6500 42.9503 174.7592 5 P 4.1975 0.0000 0.0000 66.0545 31.4910 177.8482 6 Y 4.4769 7.8121 114.8009 59.6441 37.4505 178.4710 7 K 4.1085 8.1921 120.9222 59.1943 32.1018 178.2861 8 E 3.9908 7.7418 115.9611 57.6892 29.3737 176.9152 9 F 4.7436 7.4672 114.4571 57.1760 40.8913 174.1422 10 G 3.8724 8.8364 113.0282 44.9181 0.0000 173.1011 11 A 4.3180 7.9215 123.7348 52.1994 22.9082 175.8996 12 T 4.9463 7.6626 114.1181 59.6922 70.3801 175.6496 13 V 3.9997 8.3433 124.1453 64.7940 31.8760 178.2393 14 E 4.1559 8.3532 120.5167 59.7430 29.1838 178.2519 15 L 3.6842 7.6711 116.7085 59.3978 42.0380 178.9320 16 L 4.2233 7.7114 118.0678 57.8091 41.6996 179.0341 17 S 4.3703 7.8313 109.4979 59.5239 62.2162 174.5170 18 F 4.4914 8.1973 120.9554 58.4770 40.4557 175.0562 19 L 4.9748 8.1082 116.3441 57.9788 42.1558 175.2453 20 P 3.9269 0.0000 0.0000 62.7000 31.9079 178.5798 21 S 3.1858 9.5329 115.0137 57.3883 64.4738 174.8319 22 D 4.2370 7.7292 126.9931 55.9480 42.0016 177.7858 23 F 4.3903 12.0000 120.8422 60.3290 39.6386 175.3368 24 F 3.0633 7.1703 119.7581 56.8832 38.7155 173.8190 25 P 4.3108 0.0000 0.0000 62.4441 31.7483 176.1150 26 S 4.3852 8.5122 113.9795 58.0814 62.8269 173.8598 27 V 2.7561 8.0034 110.7507 63.9336 31.4867 179.2707 28 R 3.2664 7.4916 116.4219 58.6493 32.2071 178.6748 29 D 4.5756 7.9183 116.2411 58.1408 41.1656 178.9222 30 L 4.0052 7.4903 117.6077 58.5051 41.7860 179.6558 31 L 3.3381 8.5587 114.8112 58.4255 41.5380 180.4962 32 D 4.1264 8.0742 116.2630 57.3524 41.4541 180.3017 33 T 3.6839 7.8570 115.7539 66.1628 68.8341 175.4977 34 A 3.7372 8.8711 119.4478 56.2520 18.3277 178.8635 35 A 3.7888 8.4172 117.7326 54.6659 18.7741 179.3617 36 A 4.1779 8.5386 117.4985 53.9623 18.4241 177.8664 37 L 4.3217 8.9614 117.4044 55.4555 44.5584 176.6704 38 Y 4.5859 7.4489 113.5858 58.7134 38.0291 178.8226 39 R 3.5895 7.4555 118.0923 59.1345 32.1610 177.2511 40 D 4.4207 8.2174 116.4285 57.4009 41.4106 178.6623 41 A 4.0561 8.1902 120.0939 55.3291 18.0093 178.0982 42 L 4.0966 8.4105 117.8110 57.7424 42.1468 178.9877 43 E 4.3529 8.0213 115.7530 56.8502 29.2527 177.2475 44 S 4.3385 8.4313 115.1824 57.3463 62.9111 173.2018 45 P 4.4159 0.0000 0.0000 63.5969 30.9554 175.7359 46 E 4.7784 7.9166 118.4121 54.9044 31.9159 175.3491 47 H 4.7919 9.0299 116.5197 58.9158 28.9360 179.3911 48 A 3.5188 6.7100 120.9041 54.2438 20.7747 177.8579 49 S 4.5740 7.6714 105.6632 57.1106 65.5333 173.9494 50 P 3.6944 0.0000 0.0000 66.3719 32.1660 179.9789 51 H 3.3132 7.3128 112.9908 57.9440 29.5353 176.2399 52 H 3.8414 7.8353 114.8436 60.2063 28.2794 177.3517 53 T 3.7341 8.9032 115.4239 67.2773 68.5351 175.9453 54 A 3.8679 7.8986 120.7881 55.6981 18.6744 178.7995 55 L 3.6344 8.6610 117.3383 58.7035 42.1224 179.5045 56 R 3.8971 8.8610 117.8363 59.9567 30.0206 178.6440 57 Q 3.9704 8.5232 117.5737 58.6561 28.6274 178.4320 58 A 3.6811 8.0355 121.3131 55.5120 18.1473 179.5607 59 I 3.6211 7.9779 118.2453 64.4108 37.2867 177.7473 60 L 3.7994 9.2655 118.0819 58.2562 41.4420 179.6841 61 A 3.9752 6.5005 119.6402 54.9713 19.5477 179.0095 62 W 4.1095 8.9140 127.4162 60.6239 30.8304 178.0617 63 G 4.3147 11.2436 105.5668 48.2177 0.0000 174.7536 64 D 4.5768 8.8330 120.8346 56.5211 40.4124 178.7888 65 L 3.8372 8.3107 120.1381 58.1090 41.3512 179.3304 66 M 4.4390 8.3493 117.7453 58.3303 30.5623 178.0291 67 T 4.1720 7.4913 114.4954 65.5299 68.7529 176.2877 68 L 4.3150 7.9790 121.9966 56.9940 42.2873 178.1863 69 A 4.0590 9.0790 120.4080 55.5147 18.4236 179.2859 70 T 3.9793 7.3368 105.3454 64.9441 69.1740 175.8957 71 W 4.4251 7.8460 130.7969 59.1840 31.1215 175.4066 72 V 3.5720 7.7207 118.2318 63.0252 29.4386 174.0798 73 G 3.4457 7.3607 112.4881 44.7704 0.0000 172.3541 74 T 4.1806 7.3217 116.1510 64.9224 69.6938 175.2898 75 N 4.5049 7.2106 114.7650 52.7504 38.4899 175.2021 76 L 4.0190 6.8369 121.6082 53.4675 42.7166 173.4745 77 E 4.0444 8.6114 125.4954 56.8957 29.4694 176.6926 78 D 5.0340 8.1716 123.0443 51.3928 44.8676 176.8495 79 P 4.6554 0.0000 0.0000 61.9140 30.8485 178.7031 80 A 4.4450 8.4140 122.2181 52.4155 17.1286 178.3865 81 S 4.6291 7.3700 111.1436 58.0677 64.4730 176.4273 82 R 4.5744 8.2434 115.4145 55.9736 30.6544 175.3579 83 D 4.7996 7.9803 115.5181 53.3839 42.7215 176.0726 84 L 4.4531 7.8479 119.2562 55.4568 42.5893 177.4982 85 V 3.9324 7.4961 111.7757 64.8003 31.7968 178.1880 86 V 3.6235 7.7528 117.2715 65.6564 31.4753 177.3504 87 S 4.1587 8.1403 112.9399 61.9162 60.7101 175.3418 88 Y 4.2235 8.0022 121.5319 60.5528 38.7635 177.4609 89 V 3.2177 7.5556 119.1322 66.8711 31.1037 177.5398 90 N 4.3317 8.1094 115.6906 56.0414 38.4590 177.3974 91 T 3.8627 7.6741 108.2318 65.2838 68.4996 174.6776 92 N 4.3684 8.4762 123.5501 55.4605 39.8860 173.6957 93 V 3.7230 6.6937 118.8979 62.0642 33.4062 178.4082 94 G 3.9271 7.9231 106.4949 47.4709 0.0000 174.0610 95 L 3.6521 7.7153 120.1867 58.1589 41.8958 179.6937 96 K 4.2978 7.9777 116.6826 60.1054 32.2171 178.0610 97 F 4.5804 8.7254 118.1948 59.6037 38.7755 178.4995 98 R 3.8631 8.8023 117.6949 59.7463 29.7654 178.0608 99 Q 4.3020 7.9873 118.4615 57.5933 28.0345 178.1776 100 L 4.3732 8.1637 120.4137 58.7259 41.0865 178.6903 101 L 3.7734 10.3284 118.6211 57.4335 41.5421 178.3979 102 W 4.4224 8.8210 127.2431 62.5100 31.0907 178.4762 103 F 2.3000 9.7741 117.1412 59.8408 39.8918 177.2146 104 H 2.5800 8.6565 113.2409 58.5406 28.4491 179.2202 105 I 3.1570 6.9231 123.7240 64.4635 37.7770 177.2730 106 S 3.6031 8.1212 112.7393 62.0079 62.5500 176.5134 107 A 4.0117 7.4563 122.1757 55.7738 18.3452 179.6390 108 L 4.1051 7.1753 112.3184 56.0230 41.5360 178.3444 109 T 4.5234 8.0729 105.6331 62.4096 72.3120 173.9494 110 F 4.4508 8.0436 118.4050 56.1797 41.5055 173.2110 111 G 3.7859 8.7730 112.2545 46.6834 0.0000 175.4438 112 R 3.7159 7.9403 122.9442 58.7772 30.7053 177.2231 113 E 3.6048 8.9375 117.0290 59.1798 29.1782 179.2491 114 T 3.9156 8.2678 110.9639 65.5234 69.3805 175.8280 115 V 3.5665 7.7113 121.1701 66.3604 31.4722 177.2347 116 L 3.9521 8.3206 118.1076 58.2450 41.4084 179.1828 117 E 4.0350 8.2443 118.2250 60.5123 29.5586 177.9238 118 Y 4.2263 8.3353 119.6453 60.3131 38.5184 177.4971 119 L 4.3123 8.5266 121.2911 59.3381 40.5809 178.7968 120 V 3.5865 8.0527 118.8472 64.4170 32.0602 177.6079 121 S 4.0852 7.8829 115.2253 62.0804 63.4856 176.3647 122 F 4.4086 8.6177 123.3843 61.6335 38.9656 176.6577 123 G 3.5268 8.3783 104.7587 48.3565 0.0000 175.2366 124 V 3.6400 7.3370 120.6327 65.8625 31.8688 177.5020 125 W 3.9276 8.0778 125.0372 61.6391 30.1461 177.3232 126 I 4.0189 8.2973 120.3399 64.4078 37.8568 177.9980 127 R 4.4858 7.8278 114.9829 56.0035 30.0305 176.7033 128 T 4.2966 7.0121 117.1450 61.6214 69.2177 171.5235 129 P 3.7951 0.0000 0.0000 59.2898 31.4524 174.0463 130 P 3.5048 0.0000 0.0000 65.7728 31.7059 177.4230 131 A 3.7505 7.8387 128.3105 55.2961 19.0375 178.5033 132 Y 4.4589 7.0004 111.7505 59.1931 39.1816 176.7463 133 R 3.5595 8.4137 120.8047 56.1205 30.5746 173.8623 134 P 4.1882 0.0000 0.0000 61.7252 32.0706 174.8904 135 P 4.6544 0.0000 0.0000 63.4313 31.0711 175.9860 136 N 4.6821 8.1060 115.9166 52.0751 39.6496 174.0648 137 A 3.3846 8.3894 127.6408 50.2015 18.9705 175.0871 138 P 4.3715 0.0000 0.0000 63.3471 31.6714 175.6041 139 I 5.7129 7.8731 119.0317 58.4121 41.6002 176.0897 140 L 3.9335 7.6822 122.0859 54.5551 39.5882 178.0935 141 S 4.3590 7.5960 112.9054 58.1713 64.1455 174.7053 142 T 4.0362 8.4135 118.9727 63.6439 68.2730 173.5982 143 L 4.0900 8.1140 121.5758 57.1743 42.1337 176.0231 144 P 4.4412 0.0000 0.0000 63.0451 31.1547 176.1951 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 4.35 0.00 2.15 1.55 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 2 D 8.83 4.51 0.00 2.67 2.60 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 3 I 7.95 4.21 1.86 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 1.30 0.33 0.91 0.00 0.00 4 D 8.27 4.87 0.00 2.69 2.57 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 5 P 0.00 4.20 0.00 1.43 1.87 0.00 3.18 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 1.81 1.97 0.00 6 Y 7.81 4.48 0.00 3.15 2.77 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 7 K 8.19 4.11 0.00 2.00 1.87 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.58 7.81 8 E 7.74 3.99 0.00 1.85 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 1.98 0.00 9 F 7.47 4.74 0.00 3.11 3.13 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 10 G 8.84 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 11 A 7.92 4.32 1.22 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 0.00 0.00 12 T 7.66 4.95 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 1.25 0.00 0.00 13 V 8.34 4.00 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 0.82 0.00 0.00 1.04 0.00 0.00 14 E 8.35 4.16 0.00 2.05 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 2.39 2.37 0.00 15 L 7.67 3.68 0.00 1.76 1.70 0.88 0.51 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 16 L 7.71 4.22 0.00 1.69 1.96 0.10 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.83 4.37 0.00 4.05 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 18 F 8.20 4.49 0.00 3.25 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 19 L 8.11 4.97 0.00 1.77 1.86 1.32 1.40 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 20 P 0.00 3.93 0.00 2.10 1.98 0.00 3.70 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 1.99 2.17 0.00 21 S 9.53 3.19 0.00 4.04 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 22 D 7.73 4.24 0.00 2.88 3.01 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 0.00 0.00 0.00 23 F 12.00 4.39 0.00 2.64 2.59 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 24 F 7.17 3.06 0.00 3.00 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 25 P 0.00 4.31 0.00 1.97 1.98 0.00 3.20 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.03 0.00 26 S 8.51 4.39 0.00 3.87 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 27 V 8.00 2.76 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 0.92 0.00 0.00 1.09 0.00 0.00 28 R 7.49 3.27 0.00 1.94 1.76 0.00 3.35 0.00 0.00 3.52 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 29 D 7.92 4.58 0.00 2.91 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 30 L 7.49 4.01 0.00 1.69 1.68 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.56 3.34 0.00 1.72 1.51 0.73 0.77 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 32 D 8.07 4.13 0.00 2.83 2.59 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 33 T 7.86 3.68 4.46 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 1.31 0.00 0.00 34 A 8.87 3.74 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 35 A 8.42 3.79 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 36 A 8.54 4.18 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 37 L 8.96 4.32 0.00 1.21 1.52 0.55 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.45 4.59 0.00 2.99 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 39 R 7.46 3.59 0.00 1.99 1.83 0.00 3.32 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 40 D 8.22 4.42 0.00 2.75 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 41 A 8.19 4.06 1.41 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 42 L 8.41 4.10 0.00 1.79 1.60 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.02 4.35 0.00 2.02 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 0.00 2.34 2.25 0.00 44 S 8.43 4.34 0.00 3.90 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 45 P 0.00 4.42 0.00 2.08 2.08 0.00 3.67 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 46 E 7.92 4.78 0.00 1.91 1.76 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 2.21 2.31 0.00 47 H 9.03 4.79 0.00 3.29 3.38 0.00 5.54 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 48 A 6.71 3.52 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 49 S 7.67 4.57 0.00 3.97 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 50 P 0.00 3.69 0.00 2.32 2.12 0.00 3.99 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 2.06 2.12 0.00 51 H 7.31 3.31 0.00 2.98 2.92 0.00 5.86 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 H 7.84 3.84 0.00 3.17 3.21 0.00 5.66 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.90 3.73 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 1.20 0.00 0.00 54 A 7.90 3.87 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 55 L 8.66 3.63 0.00 1.55 1.83 0.79 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 56 R 8.86 3.90 0.00 1.94 1.97 0.00 3.18 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 2.00 0.00 57 Q 8.52 3.97 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.66 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 58 A 8.04 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 7.98 3.62 2.04 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.95 0.92 0.00 0.00 60 L 9.27 3.80 0.00 1.72 1.68 1.05 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 61 A 6.50 3.98 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 62 W 8.91 4.11 0.00 3.83 3.30 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 63 G 11.24 4.31 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 0.00 64 D 8.83 4.58 0.00 2.82 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 65 L 8.31 3.84 0.00 1.18 1.38 0.75 0.90 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 66 M 8.35 4.44 0.00 2.12 1.91 0.00 0.00 0.00 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.65 0.00 67 T 7.49 4.17 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 1.22 0.00 0.00 68 L 7.98 4.31 0.00 1.58 1.79 0.42 1.09 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 69 A 9.08 4.06 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 70 T 7.34 3.98 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 1.32 0.00 0.00 71 W 7.85 4.43 0.00 3.59 3.40 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 72 V 7.72 3.57 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 0.93 0.00 0.00 1.42 0.00 0.00 73 G 7.36 3.45 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 0.00 74 T 7.32 4.18 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 1.15 0.00 0.00 75 N 7.21 4.50 0.00 1.90 2.71 0.00 0.00 6.60 7.85 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 76 L 6.84 4.02 0.00 1.30 0.97 0.87 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.61 4.04 0.00 1.92 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 2.28 2.36 0.00 78 D 8.17 5.03 0.00 2.51 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 79 P 0.00 4.66 0.00 2.02 1.85 0.00 3.65 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 2.07 0.00 80 A 8.41 4.44 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 81 S 7.37 4.63 0.00 3.81 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 82 R 8.24 4.57 0.00 1.82 2.08 0.00 2.95 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.58 0.00 83 D 7.98 4.80 0.00 2.63 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 84 L 7.85 4.45 0.00 1.61 1.67 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.50 3.93 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 0.82 0.00 0.00 0.95 0.00 0.00 86 V 7.75 3.62 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 1.04 0.00 0.00 0.94 0.00 0.00 87 S 8.14 4.16 0.00 3.96 4.04 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 88 Y 8.00 4.22 0.00 3.07 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 89 V 7.56 3.22 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 0.85 0.00 0.00 0.94 0.00 0.00 90 N 8.11 4.33 0.00 2.81 2.83 0.00 0.00 6.89 6.93 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 91 T 7.67 3.86 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 1.22 0.00 0.00 92 N 8.48 4.37 0.00 2.78 2.78 0.00 0.00 6.83 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 93 V 6.69 3.72 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 0.29 0.00 0.00 0.43 0.00 0.00 94 G 7.92 3.93 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 0.00 0.00 0.00 95 L 7.72 3.65 0.00 1.66 1.49 0.82 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.98 4.30 0.00 1.93 1.98 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.49 7.81 97 F 8.73 4.58 0.00 3.37 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 98 R 8.80 3.86 0.00 1.84 1.97 0.00 3.43 0.00 0.00 3.29 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.93 0.00 99 Q 7.99 4.30 0.00 2.26 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.63 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 100 L 8.16 4.37 0.00 2.25 2.47 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 101 L 10.33 3.77 0.00 1.81 1.88 0.79 0.82 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 0.00 102 W 8.82 4.42 0.00 3.36 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 0.00 103 F 9.77 2.30 0.00 2.81 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 0.00 104 H 8.66 2.58 0.00 3.01 2.77 0.00 5.69 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 6.92 3.16 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.57 0.96 0.00 0.00 106 S 8.12 3.60 0.00 3.39 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 0.00 107 A 7.46 4.01 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 0.00 108 L 7.18 4.11 0.00 1.75 1.63 0.69 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 109 T 8.07 4.52 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 1.26 0.00 0.00 110 F 8.04 4.45 0.00 2.88 3.07 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 0.00 111 G 8.77 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 0.00 112 R 7.94 3.72 0.00 2.11 2.10 0.00 3.23 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 113 E 8.94 3.60 0.00 2.04 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 2.47 2.39 0.00 114 T 8.27 3.92 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 1.28 0.00 0.00 115 V 7.71 3.57 2.28 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 0.85 0.00 0.00 0.98 0.00 0.00 116 L 8.32 3.95 0.00 1.81 1.71 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.24 4.04 0.00 2.38 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 0.00 2.38 2.41 0.00 118 Y 8.34 4.23 0.00 3.10 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 0.00 119 L 8.53 4.31 0.00 2.26 2.39 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.05 3.59 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 0.91 0.00 0.00 1.03 0.00 0.00 121 S 7.88 4.09 0.00 3.93 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 0.00 122 F 8.62 4.41 0.00 2.53 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 0.00 123 G 8.38 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.34 3.64 2.24 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 0.82 0.00 0.00 0.92 0.00 0.00 125 W 8.08 3.93 0.00 3.50 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 0.00 126 I 8.30 4.02 1.99 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 1.80 1.29 0.80 0.00 0.00 127 R 7.83 4.49 0.00 2.03 1.97 0.00 3.17 0.00 0.00 3.03 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.15 0.00 128 T 7.01 4.30 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 1.09 0.00 0.00 129 P 0.00 3.80 0.00 2.35 2.03 0.00 3.59 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 130 P 0.00 3.50 0.00 2.05 1.83 0.00 3.56 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 131 A 7.84 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 Y 7.00 4.46 0.00 3.02 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 0.00 133 R 8.41 3.56 0.00 1.59 1.49 0.00 2.21 0.00 0.00 2.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.65 0.00 134 P 0.00 4.19 0.00 2.43 2.08 0.00 3.26 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 2.15 2.13 0.00 135 P 0.00 4.65 0.00 2.23 2.19 0.00 3.87 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 136 N 8.11 4.68 0.00 2.86 2.87 0.00 0.00 6.84 7.50 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 0.00 137 A 8.39 3.38 0.07 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 0.00 138 P 0.00 4.37 0.00 2.18 2.13 0.00 3.42 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 1.75 2.05 0.00 139 I 7.87 5.71 1.89 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.28 0.85 0.00 0.00 140 L 7.68 3.93 0.00 1.18 0.61 0.69 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 141 S 7.60 4.36 0.00 4.04 3.93 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 0.00 142 T 8.41 4.04 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 1.11 0.00 0.00 143 L 8.11 4.09 0.00 1.67 1.71 1.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 144 P 0.00 4.44 0.00 2.05 2.02 0.00 3.73 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 2.05 2.15 0.00