NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4138 8.2649 123.5839 52.6900 20.2498 175.8310 2 T 4.7464 8.1858 112.0487 63.4209 73.6907 172.7027 3 K 5.0906 8.3127 120.7143 54.5951 35.5844 175.2048 4 V 5.1491 8.9135 124.0032 61.4487 35.7808 174.1412 5 V 5.0561 8.7442 122.6686 60.5532 35.3593 173.1241 6 C 4.9345 9.3281 122.2383 57.8024 35.1866 172.6007 7 V 4.6456 8.3916 125.7954 61.3345 33.2007 174.1455 8 L 4.7110 8.8975 129.4999 54.0188 42.9891 176.2630 9 K 4.9129 8.9647 122.3625 55.3134 36.9675 176.4104 10 G 4.6706 8.0532 109.1275 45.1218 0.0000 171.9474 11 D 4.6706 8.8063 118.5789 54.6201 41.9680 176.8013 12 G 4.4049 7.5033 109.1328 44.2702 0.0000 171.6445 13 P 4.3892 0.0000 0.0000 63.6130 31.9077 176.3225 14 V 4.1661 7.5901 119.8177 62.8400 31.8568 175.0456 15 Q 4.8006 8.6364 124.9888 55.2358 32.5163 173.6978 16 G 4.3106 8.4808 106.4646 46.1059 0.0000 172.0113 17 I 5.1571 8.3467 120.0443 59.3700 41.0224 175.1019 18 I 4.7144 8.6544 126.6134 59.6357 40.6525 174.4258 19 N 5.0747 8.5785 124.6356 51.7016 41.0370 174.1177 20 F 5.4120 9.0578 119.5019 55.9182 43.3849 173.7889 21 E 5.4010 9.7266 122.9322 54.9352 33.2889 173.6501 22 Q 4.7544 9.2909 127.2807 54.7272 31.9439 175.8217 23 K 4.0756 9.1180 126.2578 58.7181 32.8691 177.0740 24 E 4.8223 7.7345 116.8981 53.8798 32.8820 176.7134 25 S 4.1409 8.7681 117.0453 61.4423 63.0009 176.1997 26 N 4.9946 8.0127 116.4224 52.0116 38.8121 173.4908 27 G 4.1844 7.8192 108.2001 42.9383 0.0000 171.3816 28 P 4.7191 0.0000 0.0000 62.3966 32.2710 175.9292 29 V 4.6250 9.0011 122.4405 61.3004 33.7211 174.6226 30 K 4.9398 9.3080 128.6103 55.7868 33.8509 176.1961 31 V 4.9229 9.1445 124.6180 59.6171 34.1589 174.6053 32 W 5.9237 7.7926 120.8576 55.0844 31.9691 175.3224 33 G 3.7895 7.8146 106.0628 46.5907 0.0000 171.1252 34 S 5.7429 7.5571 114.7915 57.3020 68.1468 173.5524 35 I 5.0811 8.2323 121.7204 59.6767 41.2078 174.7114 36 K 4.9956 9.1594 125.3830 55.3319 35.8311 177.2942 37 G 3.9882 8.9279 107.7560 45.7224 0.0000 173.9237 38 L 4.2825 7.3901 120.1323 53.9552 42.5666 176.3094 39 T 4.2257 8.1485 110.9420 60.6685 69.8237 174.3669 40 E 4.0093 8.6658 125.0849 57.1367 30.5301 175.3820 41 G 3.7638 8.2880 111.1846 44.0453 0.0000 172.2800 42 L 4.8979 8.1810 119.3239 54.5735 43.1055 176.4789 43 H 4.9672 9.0302 118.9407 53.6608 33.1930 173.2539 44 G 4.1798 9.0538 110.5592 47.2382 0.0000 172.5678 45 F 5.3779 8.9794 125.1187 57.2598 42.1963 172.7898 46 H 5.0943 8.7364 122.6813 54.0500 33.8773 172.8195 47 V 4.3560 8.9387 121.6349 62.6330 32.5708 175.2655 48 H 5.0266 9.6015 126.3399 54.4844 30.6923 175.9942 49 E 3.7170 8.7065 121.5506 58.5794 29.6991 176.9901 50 F 5.0107 8.1167 118.2501 54.8361 41.6173 176.9849 51 G 4.2880 8.3798 112.4076 44.6418 0.0000 173.9500 52 D 4.8629 7.9748 117.8565 52.5851 42.7870 175.0237 53 N 5.2573 8.4465 126.4513 53.0183 39.6003 176.3553 54 T 3.9553 8.5739 111.3194 63.8640 69.1806 174.3233 55 A 4.6597 7.6413 124.7520 51.3357 19.6556 176.8785 56 G 3.8870 7.9612 111.5715 46.6080 0.0000 175.2255 57 C 4.4431 8.6245 114.7112 60.1632 34.7988 175.8516 58 T 3.8493 7.9508 117.5873 66.4276 67.8607 175.6450 59 S 4.4922 7.6386 112.9930 59.3581 63.5380 175.4082 60 A 4.4759 7.6132 126.5001 54.1643 18.3642 178.7092 61 G 4.1949 8.1065 105.9672 44.4236 0.0000 170.5100 62 P 4.6989 0.0000 0.0000 61.7218 34.2898 174.9518 63 H 4.5403 8.2655 116.3419 55.7062 29.5794 175.5557 64 F 4.2352 9.2063 125.4009 58.3974 40.2080 174.7745 65 N 5.0829 8.0255 125.9966 51.6229 38.8029 172.7698 66 P 4.3985 0.0000 0.0000 63.9188 32.0026 177.6378 67 L 4.4618 7.5724 117.4639 53.8573 42.8350 176.2967 68 S 3.6104 7.8459 113.7923 60.0705 60.4459 170.4692 69 R 4.6359 8.5989 118.7125 54.1516 32.9322 176.0654 70 K 4.5252 8.0762 117.9086 56.1021 34.9045 175.6898 71 H 4.1161 8.3879 121.1546 56.6619 30.4957 174.9384 72 G 4.1662 8.0871 110.4913 46.5308 0.0000 172.5256 73 G 4.1635 9.4186 109.6629 43.2305 0.0000 173.1794 74 P 4.3776 0.0000 0.0000 65.3945 31.3722 178.4592 75 K 4.1578 7.9297 116.1175 58.5702 32.4338 177.1867 76 D 4.5375 7.6063 117.9853 54.4005 41.3672 176.0494 77 E 4.0190 8.5962 121.5160 58.4553 30.1955 176.2505 78 E 4.1968 7.9692 121.6281 55.7668 29.3095 174.9999 79 R 4.6549 7.6515 119.9439 56.2918 32.0704 174.3799 80 H 4.4852 8.3064 116.2180 55.2226 29.5727 176.8863 81 V 3.4592 8.1608 121.7430 65.9148 31.4730 177.1897 82 G 3.8860 8.1314 106.8088 45.9842 0.0000 173.1273 83 D 4.8467 7.7543 120.6132 53.8061 39.2554 175.6035 84 L 4.6005 8.4465 121.8493 54.0228 43.0841 179.0321 85 G 4.0327 8.0937 107.0230 46.4038 0.0000 173.0759 86 N 5.6706 8.6520 120.8124 51.5176 41.8854 174.1601 87 V 4.4152 8.3750 113.6066 59.8817 35.5660 174.7560 88 T 5.0628 8.2511 118.6627 61.8849 71.0472 173.0823 89 A 4.8235 9.1743 129.4044 50.6372 20.5315 176.9033 90 D 4.9468 9.0285 122.3843 51.5119 41.1464 177.4058 91 K 4.5145 8.5694 117.8559 59.9518 32.1367 177.5450 92 D 4.4365 8.2312 117.3483 55.0023 41.2588 176.8504 93 G 3.9153 9.7983 107.7566 46.7387 0.0000 172.3462 94 V 4.7086 8.4610 119.5237 60.5874 34.1497 174.1636 95 A 5.2004 8.7142 129.5396 49.6101 21.1330 175.2650 96 D 4.8634 8.6473 123.4994 53.5981 41.3944 176.5062 97 V 3.8593 8.3422 124.8106 62.3534 33.2444 175.4210 98 S 5.0168 8.1713 120.2298 58.1024 64.0366 173.6266 99 I 4.8060 9.2520 128.4582 59.3467 41.5103 174.1277 100 E 5.2208 8.8361 125.4176 54.5531 32.1517 174.5085 101 D 4.8796 9.2586 125.2745 52.8248 45.1179 175.5582 102 S 4.7868 8.8691 118.9173 58.5050 64.1125 175.6517 103 V 3.9304 8.0037 120.5089 64.7468 31.9640 176.3513 104 I 4.0359 7.8175 111.5452 61.4148 38.0717 174.3499 105 S 4.6252 8.2345 113.5616 57.8982 65.0233 173.9635 106 L 4.4150 8.5342 121.6164 53.9633 41.5025 176.1989 107 S 4.3451 7.8834 111.9596 58.5826 66.0637 174.9315 108 G 3.9101 8.4244 109.0539 44.7562 0.0000 173.6154 109 D 4.4409 8.7159 117.2005 57.4423 40.8277 177.0152 110 H 5.1005 8.0286 114.1764 55.5762 28.9735 174.5178 111 C 4.2099 7.8736 120.2826 60.2507 31.7445 173.5848 112 I 4.0327 8.1384 118.2593 60.2300 38.0317 175.5817 113 I 3.7357 7.2958 122.7470 62.9711 37.4836 176.3963 114 G 3.8259 9.2897 112.9592 45.5236 0.0000 173.1367 115 R 4.7926 7.4285 119.4627 54.7591 33.7291 174.4709 116 T 4.9626 7.9122 115.2166 62.2448 71.7683 173.2924 117 L 4.8245 8.5638 128.3990 53.8471 44.1308 175.2908 118 V 4.9028 8.6459 125.7348 60.9051 35.2347 174.2255 119 V 5.0022 8.6496 126.6595 60.4422 33.7870 174.9958 120 H 5.3106 9.0892 122.4083 54.2759 30.3894 175.0370 121 E 4.2021 9.2970 121.4247 59.0213 30.0508 176.1728 122 K 4.7979 8.4584 117.2035 53.8108 36.7538 175.5914 123 A 4.3213 8.4375 123.5784 52.3356 18.7332 176.8256 124 D 4.6551 9.6473 123.3764 54.0409 41.4159 175.9716 125 D 4.5506 9.5145 126.1432 53.3047 39.8044 176.8963 126 L 3.6185 9.5194 119.5829 56.0455 39.6081 175.2505 127 G 4.3515 8.6814 104.5705 46.7692 0.0000 174.9676 128 K 4.5340 8.1034 115.9085 55.8689 32.4065 177.5280 129 G 3.8006 7.9889 107.7005 45.2047 0.0000 175.4423 130 G 3.9122 9.4194 107.7607 45.3972 0.0000 172.5461 131 N 5.0123 7.5574 114.5312 49.7131 40.6497 174.4716 132 E 4.0255 8.8146 118.9894 59.4719 29.4475 178.5032 133 E 3.9339 8.1235 118.9886 59.2327 29.8224 178.5276 134 S 4.1316 8.3924 113.4806 61.1639 62.3958 175.3792 135 T 4.3225 7.7612 110.2505 62.3292 68.6654 175.3654 136 K 4.2672 7.6901 119.0393 57.9102 34.4193 177.2847 137 T 4.3233 8.0388 107.3645 60.2466 69.5742 175.1030 138 G 3.8559 8.0088 109.5861 46.0605 0.0000 173.6253 139 N 4.2918 7.8882 114.3943 53.9242 36.6700 175.9889 140 A 4.0267 7.7031 121.2635 52.7888 19.1830 180.0799 141 G 3.8711 7.3710 103.6805 44.9200 0.0000 173.6377 142 S 4.2565 8.4129 116.2500 59.3138 64.3533 174.7215 143 R 4.4290 8.4629 122.2422 55.3129 29.6475 176.3669 144 L 4.2776 8.6771 125.2290 57.4445 42.7804 177.3305 145 A 5.1862 7.7663 118.1636 51.1635 22.8993 173.8172 146 C 5.2900 9.2538 113.8604 54.9696 46.7623 172.7662 147 G 4.6650 8.5360 104.5690 45.9181 0.0000 172.6229 148 V 4.5042 8.2315 121.0791 62.1744 32.9994 175.4582 149 I 4.0735 8.5974 128.8253 60.4929 38.1081 175.2161 150 G 4.4275 8.7901 114.1676 43.8045 0.0000 171.6630 151 I 4.2874 8.3043 121.2158 61.1307 37.5485 175.8013 152 A 4.7244 8.6307 128.9737 49.7593 21.7211 176.5813 153 Q 4.0656 8.4514 118.7400 56.4732 29.2022 175.9794 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 A 8.26 4.41 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 2 T 8.19 4.75 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 1.31 0.00 0.00 3 K 8.31 5.09 0.00 1.72 1.74 0.00 1.88 0.00 0.00 1.87 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.47 7.81 4 V 8.91 5.15 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 0.83 0.00 0.00 0.89 0.00 0.00 5 V 8.74 5.06 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 0.58 0.00 0.00 0.93 0.00 0.00 6 C 9.33 4.93 0.00 3.04 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 7 V 8.39 4.65 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 8.90 4.71 0.00 1.85 1.59 0.97 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.96 4.91 0.00 1.66 1.62 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.38 7.81 10 G 8.05 4.67 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 0.00 0.00 0.00 11 D 8.81 4.67 0.00 2.68 2.72 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 0.00 0.00 0.00 0.00 12 G 7.50 4.40 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 0.00 13 P 0.00 4.39 0.00 2.05 2.10 0.00 3.68 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 2.02 2.06 0.00 14 V 7.59 4.17 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 0.78 0.00 0.00 0.97 0.00 0.00 15 Q 8.64 4.80 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.42 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 16 G 8.48 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 17 I 8.35 5.16 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.89 0.83 0.00 0.00 18 I 8.65 4.71 1.94 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 1.29 1.35 0.61 0.00 0.00 19 N 8.58 5.07 0.00 1.44 1.70 0.00 0.00 6.33 8.46 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 20 F 9.06 5.41 0.00 2.88 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 21 E 9.73 5.40 0.00 2.45 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 2.32 2.55 0.00 22 Q 9.29 4.75 0.00 2.20 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.61 0.00 0.00 0.00 0.00 0.00 2.41 2.55 0.00 23 K 9.12 4.08 0.00 1.81 1.86 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 E 7.73 4.82 0.00 2.00 1.81 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 2.29 2.26 0.00 25 S 8.77 4.14 0.00 3.98 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 26 N 8.01 4.99 0.00 2.70 2.82 0.00 0.00 6.73 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 27 G 7.82 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.72 0.00 2.12 2.10 0.00 3.37 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.82 0.00 29 V 9.00 4.62 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 1.30 0.00 0.00 1.04 0.00 0.00 30 K 9.31 4.94 0.00 1.90 1.79 0.00 1.51 0.00 0.00 1.49 0.00 0.00 2.81 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.42 1.41 7.81 31 V 9.14 4.92 1.79 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 0.90 0.00 0.00 0.66 0.00 0.00 32 W 7.79 5.92 0.00 3.51 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 33 G 7.81 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 34 S 7.56 5.74 0.00 3.75 3.68 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 35 I 8.23 5.08 1.82 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 1.34 0.66 0.97 0.00 0.00 36 K 9.16 5.00 0.00 1.63 1.68 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.34 7.81 37 G 8.93 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 0.00 0.00 0.00 38 L 7.39 4.28 0.00 1.80 1.53 0.70 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.15 4.23 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 1.24 0.00 0.00 40 E 8.67 4.01 0.00 2.09 1.92 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 2.30 2.32 0.00 41 G 8.29 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 42 L 8.18 4.90 0.00 1.50 1.59 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.03 4.97 0.00 3.05 3.32 0.00 5.64 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 44 G 9.05 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.98 5.38 0.00 2.99 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 46 H 8.74 5.09 0.00 3.11 2.98 0.00 5.68 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.94 4.36 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 0.92 0.00 0.00 0.93 0.00 0.00 48 H 9.60 5.03 0.00 3.14 3.36 0.00 5.69 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 49 E 8.71 3.72 0.00 1.73 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 1.47 2.10 0.00 50 F 8.12 5.01 0.00 3.11 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 51 G 8.38 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 0.00 0.00 0.00 0.00 52 D 7.97 4.86 0.00 2.61 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.45 5.26 0.00 2.70 2.75 0.00 0.00 7.19 7.54 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 54 T 8.57 3.96 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 1.25 0.00 0.00 55 A 7.64 4.66 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 56 G 7.96 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 57 C 8.62 4.44 0.00 2.96 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 58 T 7.95 3.85 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 59 S 7.64 4.49 0.00 4.13 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 60 A 7.61 4.48 1.44 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 0.00 0.00 0.00 61 G 8.11 4.19 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 0.00 0.00 0.00 62 P 0.00 4.70 0.00 2.01 2.17 0.00 3.50 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 1.94 1.98 0.00 63 H 8.27 4.54 0.00 2.75 3.17 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.21 4.24 0.00 2.90 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 65 N 8.03 5.08 0.00 2.55 2.46 0.00 0.00 6.91 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 66 P 0.00 4.40 0.00 2.11 2.04 0.00 3.03 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.19 0.00 67 L 7.57 4.46 0.00 1.54 1.65 0.93 0.91 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 68 S 7.85 3.61 0.00 3.97 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 69 R 8.60 4.64 0.00 1.82 1.91 0.00 2.99 0.00 0.00 4.01 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.49 0.00 70 K 8.08 4.53 0.00 1.75 1.92 0.00 1.29 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.41 7.81 71 H 8.39 4.12 0.00 3.29 3.22 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.09 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 0.00 0.00 0.00 0.00 73 G 9.42 4.16 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 0.00 74 P 0.00 4.38 0.00 2.10 2.19 0.00 3.96 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 2.07 2.19 0.00 75 K 7.93 4.16 0.00 1.75 1.87 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.41 7.81 76 D 7.61 4.54 0.00 2.81 2.58 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 77 E 8.60 4.02 0.00 1.91 1.95 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 2.25 2.28 0.00 78 E 7.97 4.20 0.00 2.06 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 79 R 7.65 4.65 0.00 1.79 1.76 0.00 2.70 0.00 0.00 2.64 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.58 0.00 80 H 8.31 4.49 0.00 3.35 3.35 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.16 3.46 1.52 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 0.66 0.00 0.00 0.34 0.00 0.00 82 G 8.13 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 83 D 7.75 4.85 0.00 2.81 2.72 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 0.00 0.00 0.00 0.00 84 L 8.45 4.60 0.00 2.06 1.96 1.01 0.94 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 85 G 8.09 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 0.00 0.00 0.00 86 N 8.65 5.67 0.00 2.60 2.72 0.00 0.00 6.56 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 87 V 8.38 4.42 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 -0.24 0.00 0.00 0.74 0.00 0.00 88 T 8.25 5.06 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 1.20 0.00 0.00 89 A 9.17 4.82 1.27 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 90 D 9.03 4.95 0.00 2.85 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 91 K 8.57 4.51 0.00 1.86 2.01 0.00 1.45 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.54 7.81 92 D 8.23 4.44 0.00 2.84 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 93 G 9.80 3.92 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 0.00 0.00 0.00 94 V 8.46 4.71 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 95 A 8.71 5.20 1.18 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 0.00 0.00 0.00 0.00 0.00 96 D 8.65 4.86 0.00 2.56 2.66 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 97 V 8.34 3.86 1.95 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 0.58 0.00 0.00 0.65 0.00 0.00 98 S 8.17 5.02 0.00 3.92 3.72 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 0.00 0.00 0.00 0.00 99 I 9.25 4.81 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.51 1.00 0.00 0.00 100 E 8.84 5.22 0.00 1.95 1.81 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 2.20 2.30 0.00 101 D 9.26 4.88 0.00 2.87 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 0.00 102 S 8.87 4.79 0.00 3.92 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 0.00 103 V 8.00 3.93 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 0.87 0.00 0.00 0.96 0.00 0.00 104 I 7.82 4.04 1.99 0.00 0.00 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 1.53 0.84 1.05 0.00 0.00 105 S 8.23 4.63 0.00 3.90 3.88 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 0.00 106 L 8.53 4.42 0.00 1.81 1.63 1.01 0.62 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 0.00 107 S 7.88 4.35 0.00 3.97 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 0.00 108 G 8.42 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 0.00 109 D 8.72 4.44 0.00 2.67 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 H 8.03 5.10 0.00 3.17 3.40 0.00 5.74 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 0.00 111 C 7.87 4.21 0.00 3.16 2.84 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 0.00 112 I 8.14 4.03 1.64 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.30 0.96 0.00 0.00 113 I 7.30 3.74 1.78 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.74 0.89 0.00 0.00 114 G 9.29 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 0.00 0.00 0.00 115 R 7.43 4.79 0.00 1.58 1.80 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.40 0.00 116 T 7.91 4.96 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 1.24 0.00 0.00 117 L 8.56 4.82 0.00 1.75 1.49 0.27 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.65 4.90 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 0.64 0.00 0.00 0.68 0.00 0.00 119 V 8.65 5.00 2.30 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 0.78 0.00 0.00 1.07 0.00 0.00 120 H 9.09 5.31 0.00 3.10 3.57 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.30 4.20 0.00 2.11 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 0.00 2.36 2.34 0.00 122 K 8.46 4.80 0.00 1.69 1.67 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.38 7.81 123 A 8.44 4.32 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 0.00 124 D 9.65 4.66 0.00 2.76 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 0.00 125 D 9.51 4.55 0.00 2.92 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 0.00 126 L 9.52 3.62 0.00 1.89 1.79 0.94 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.68 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 0.00 0.00 0.00 0.00 128 K 8.10 4.53 0.00 1.88 1.79 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.35 7.81 129 G 7.99 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 9.42 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 0.00 131 N 7.56 5.01 0.00 2.76 2.75 0.00 0.00 6.13 7.66 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 0.00 132 E 8.81 4.03 0.00 2.10 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 2.43 0.00 133 E 8.12 3.93 0.00 2.11 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 0.00 2.37 2.41 0.00 134 S 8.39 4.13 0.00 4.04 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 0.00 135 T 7.76 4.32 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 1.28 0.00 0.00 136 K 7.69 4.27 0.00 1.79 1.80 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.32 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.32 1.44 7.81 137 T 8.04 4.32 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 1.17 0.00 0.00 138 G 8.01 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 0.00 139 N 7.89 4.29 0.00 3.03 2.89 0.00 0.00 6.93 7.40 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 0.00 140 A 7.70 4.03 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 0.00 141 G 7.37 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 0.00 142 S 8.41 4.26 0.00 3.96 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 0.00 143 R 8.46 4.43 0.00 1.66 1.82 0.00 3.20 0.00 0.00 3.23 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.67 0.00 144 L 8.68 4.28 0.00 1.80 1.71 1.00 0.55 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 0.00 145 A 7.77 5.19 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 0.00 146 C 9.25 5.29 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 0.00 147 G 8.54 4.66 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 0.00 148 V 8.23 4.50 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 0.82 0.00 0.00 0.96 0.00 0.00 149 I 8.60 4.07 1.79 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.24 0.46 0.00 0.00 150 G 8.79 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 0.00 0.00 0.00 0.00 151 I 8.30 4.29 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.54 0.91 0.00 0.00 152 A 8.63 4.72 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 0.00 153 Q 8.45 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00