NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9639 8.3549 109.7379 45.4423 0.0000 172.6940 2 L 4.2405 8.0800 118.4808 51.4565 42.8476 175.8791 3 S 4.4747 9.6636 119.0742 57.8786 66.0755 175.0246 4 D 4.6478 8.7549 121.9040 57.6153 40.5768 179.1905 5 G 3.7508 8.1782 105.5457 47.9816 0.0000 175.2887 6 E 3.8934 8.3084 121.2176 58.9106 29.4281 179.3375 7 W 4.4670 8.2317 119.2540 60.0533 29.1389 178.3406 8 Q 4.0583 8.4697 119.3379 59.2375 28.4270 178.3156 9 Q 4.0296 8.2065 119.0576 58.9559 28.7839 178.7136 10 V 3.6968 8.0922 119.5011 66.4335 31.4569 178.1049 11 L 4.2674 8.4183 118.0735 57.0716 41.2154 179.0987 12 N 4.3478 8.0351 116.9287 56.7065 39.2897 176.4625 13 V 3.7203 8.1880 120.1103 66.0792 31.5247 177.7673 14 W 4.1854 8.5656 127.9444 60.2079 30.3302 177.8092 15 G 3.7791 7.9707 106.1019 47.9172 0.0000 175.6595 16 K 3.8094 7.6544 119.5365 59.1729 32.3572 179.2346 17 V 2.8274 6.9344 117.8166 65.7587 31.0885 177.7892 18 E 3.8341 7.4979 116.5666 58.8322 29.2751 178.8281 19 A 4.1779 7.3637 120.2732 53.9521 20.0848 177.6846 20 D 4.6608 7.7029 116.3761 52.2473 42.7923 175.1994 21 I 3.5835 7.8443 123.8004 63.7743 38.5042 176.5341 22 A 4.0689 8.0258 121.2557 55.0935 18.2394 179.7168 23 G 3.7745 8.3328 105.4255 47.7903 0.0000 175.6723 24 H 4.1205 8.2782 119.2924 58.2425 28.6941 178.0926 25 G 3.5582 8.3391 107.8349 47.8189 0.0000 175.0962 26 Q 3.8524 8.1261 122.8925 59.0779 28.9302 178.7069 27 E 3.9000 8.1283 119.1922 59.1396 29.3725 179.4403 28 V 3.5169 7.9589 118.6125 66.1448 31.5280 178.1958 29 L 3.4103 7.7519 118.5007 57.4347 41.2546 179.4424 30 I 3.5353 7.7731 120.1802 64.3057 37.0588 178.2370 31 R 3.7802 8.0728 119.7186 59.3212 29.8223 178.0925 32 L 3.9345 7.8310 119.9596 58.4435 41.8566 179.0905 33 F 4.5625 8.1630 118.2410 60.7596 38.6000 177.8961 34 T 4.0668 8.1697 109.1440 64.6540 68.8651 176.8826 35 G 3.6441 7.9280 107.5602 46.1755 0.0000 173.6562 36 H 4.7478 8.1072 117.6884 52.1165 29.5489 171.9634 37 P 4.4774 0.0000 0.0000 64.4231 31.3651 177.5107 38 E 4.0722 8.2768 116.4944 59.5140 29.3025 179.2018 39 T 3.8192 8.1804 111.3071 64.5075 68.7492 176.1892 40 L 3.4697 7.7748 123.2625 58.0119 41.7747 178.8686 41 E 4.0252 7.7543 117.3216 58.9163 29.4252 178.9789 42 K 4.4297 8.1030 117.5081 57.1178 32.5970 176.7990 43 F 4.6243 8.2718 119.1056 55.3445 38.7551 175.7087 44 D 4.4042 8.6310 127.3685 57.0868 40.8039 179.0314 45 K 3.8995 7.8426 115.5583 58.0297 33.1042 177.0688 46 F 5.0897 7.9992 117.5884 56.8579 40.4643 177.0327 47 K 3.9679 7.6354 120.3388 59.7936 32.2892 177.8786 48 H 4.2960 8.1300 113.3429 56.9647 28.7013 175.4783 49 L 4.1907 7.3895 120.8872 54.1783 40.1548 176.5774 50 K 4.2348 9.1597 124.8301 57.7606 32.8541 178.1545 51 T 4.7366 7.5417 108.1916 58.8189 73.2146 174.1378 52 E 3.8892 8.7371 121.8451 59.3131 29.6310 178.8693 53 A 3.9707 7.9827 120.3791 55.3166 18.2507 179.2630 54 E 3.9365 7.9959 115.5570 59.7243 29.8179 179.1672 55 M 4.1339 8.1093 118.6677 58.4656 31.8773 178.8164 56 K 3.9095 8.2658 118.2989 59.1164 32.4455 177.8692 57 A 4.4152 7.8453 118.5974 51.7521 18.8081 177.0308 58 S 4.3625 7.5654 114.0074 57.4327 62.7093 174.7602 59 E 4.0348 8.8279 128.4673 59.3504 29.2842 178.6642 60 D 4.4254 8.1574 117.9093 56.9966 41.3489 177.8673 61 L 3.7355 8.0419 121.1874 57.7484 42.0467 178.8496 62 K 3.8748 7.7872 119.5420 59.1851 32.1579 178.5211 63 K 3.8973 8.3439 120.2109 60.0113 32.0817 178.0400 64 H 4.3228 8.9576 118.8941 59.3299 29.7594 177.2559 65 G 3.6355 8.3396 107.5066 48.1843 0.0000 175.7212 66 T 3.8919 8.0267 118.1249 66.2706 68.4281 176.8513 67 V 3.5921 7.6907 120.0867 65.9488 31.5459 178.0701 68 V 3.6273 8.0433 118.2231 66.3480 31.4349 178.1191 69 L 4.2604 8.1867 118.5126 57.8728 41.4288 179.7169 70 T 4.0044 8.3109 115.9247 66.4876 68.4030 176.4889 71 A 3.9778 8.2035 122.7029 55.0919 18.3865 179.3070 72 L 3.6542 8.1107 119.0248 58.2412 42.0624 179.3837 73 G 3.0166 8.5574 106.0730 47.3438 0.0000 175.7045 74 G 3.6255 7.7521 107.0850 47.6765 0.0000 175.4931 75 I 3.8370 7.4815 122.5252 64.0097 37.1207 178.5209 76 L 3.9439 7.7801 120.0485 57.7372 41.2116 179.6083 77 K 3.9446 7.7291 116.5079 58.2392 32.2597 178.6316 78 K 3.9607 7.8326 118.4011 55.8298 32.4825 176.6301 79 K 2.0000 8.3235 118.0586 56.3206 29.7421 176.0216 80 G 3.9264 7.9330 106.7350 45.8002 0.0000 174.0671 81 H 4.5254 7.3973 118.9767 55.5561 27.6841 175.0051 82 H 5.3764 7.3690 110.6174 54.1949 29.7795 175.7029 83 E 3.8872 8.6628 121.8990 60.3039 28.9526 178.7468 84 A 3.9913 7.9306 118.3543 55.2210 18.6476 178.9993 85 E 4.0857 8.0705 116.6233 59.2858 29.6922 178.9846 86 L 4.0197 8.5151 120.6544 57.4991 42.1643 178.2805 87 K 3.8058 8.2527 120.2908 59.4004 31.9754 176.8308 88 P 4.2515 0.0000 0.0000 65.6540 31.1646 178.3474 89 L 3.9973 7.4868 115.8243 57.5956 41.6205 178.8996 90 A 4.0784 8.2825 121.1287 55.7089 18.2080 179.8229 91 Q 3.9416 8.4174 116.7424 59.0298 28.7061 179.0815 92 S 4.0602 8.4706 115.7465 61.6900 63.0740 176.3217 93 H 4.1244 8.6518 119.7563 58.2981 27.6634 177.7405 94 A 2.5800 7.8603 122.5273 54.8561 17.9685 179.7421 95 T 3.9379 7.5913 112.8413 65.5399 68.8347 176.6563 96 K 4.0784 7.4173 119.4293 59.0464 32.9839 177.8246 97 H 4.3266 7.9659 114.7459 55.5969 29.9091 175.3494 98 K 3.4806 6.8382 119.7332 57.2991 29.5642 176.6979 99 I 4.3225 7.9382 119.2996 58.7120 37.8104 174.9427 100 P 4.4440 0.0000 0.0000 62.4314 31.8543 177.2147 101 I 3.5227 8.6897 119.8329 64.3827 37.5572 177.8252 102 K 3.5894 7.9927 119.8654 59.8575 31.7155 178.0919 103 Y 4.2335 8.0447 117.0376 60.8554 37.7916 178.1532 104 L 4.1436 7.8795 119.7795 57.4699 41.7738 178.7921 105 E 3.9495 8.2373 119.3845 59.3587 29.5113 178.6371 106 F 4.5111 8.1569 118.0534 61.1013 38.9804 177.7378 107 I 3.8231 8.3165 117.9807 63.9080 37.8383 177.9769 108 S 4.2179 8.3312 116.3188 61.8285 62.7187 176.4092 109 D 4.4458 8.4080 121.1564 57.3412 40.5294 178.5851 110 A 4.0580 8.3734 121.5711 55.3113 18.2857 179.7248 111 I 3.6683 8.0879 118.2878 64.6402 37.2616 178.6519 112 I 3.8598 7.7674 120.3493 64.6613 36.8720 177.9702 113 H 4.1558 8.4813 118.9532 59.3679 29.7189 177.2818 114 V 3.5170 8.1765 120.4133 66.0336 31.2512 177.8625 115 L 3.8080 7.9901 118.5798 58.1787 41.1579 179.2114 116 H 4.3425 8.1328 115.9301 59.0127 28.4126 177.8963 117 S 4.1131 8.0047 114.2014 61.2679 62.3587 175.9695 118 K 4.0761 8.1554 119.8588 57.8769 33.0172 176.7359 119 H 4.9888 8.0630 116.3928 53.9151 29.4404 171.9625 120 P 4.5789 0.0000 0.0000 63.5930 31.9467 177.3765 121 G 3.9763 9.1555 110.4164 45.7191 0.0000 172.9354 122 D 4.9451 8.3736 117.6620 53.6320 41.6254 175.9458 123 F 4.9385 8.0196 120.0191 55.0839 39.5041 174.8416 124 G 3.8431 8.1275 113.2582 43.1399 0.0000 170.8917 125 A 3.8760 8.3667 121.5552 55.0713 18.2451 179.5586 126 D 4.2141 7.9909 116.8415 56.5020 39.4128 178.3117 127 A 3.9977 7.8871 121.9914 54.9000 18.3522 179.1176 128 Q 3.6501 7.7203 118.1894 59.0965 29.0299 178.6792 129 G 3.5736 7.9993 106.4209 47.7444 0.0000 175.5452 130 A 3.8422 8.0755 123.3152 55.0673 18.4339 179.2486 131 M 3.9953 8.3541 117.0771 59.1760 32.2160 178.5595 132 T 3.8893 8.2173 115.8638 66.6292 68.5977 176.5389 133 K 3.9584 8.0320 120.0900 59.6072 32.0746 179.1589 134 A 3.8548 8.0079 120.7843 55.1937 18.2512 179.7579 135 L 4.0847 8.2338 117.6847 57.8292 41.6863 179.5581 136 E 3.9789 8.6731 119.1003 59.2358 29.3451 178.9434 137 L 3.9479 8.1832 120.5928 58.2127 42.1319 178.5551 138 F 4.1429 8.3079 120.3752 61.5106 39.3114 176.8647 139 R 3.5506 8.2810 118.1014 59.5416 29.8832 178.0067 140 N 4.3200 8.7089 116.9635 56.7282 38.7857 176.6510 141 D 4.3436 8.3312 120.6333 57.1088 40.8194 178.7427 142 I 3.4025 7.5305 120.1588 64.2568 37.0318 178.0424 143 A 3.7617 8.0720 121.6635 55.1803 18.0841 179.4848 144 A 3.9356 8.0172 118.9250 55.4326 18.5041 180.0897 145 K 4.0249 7.8416 116.9648 59.7220 31.9899 179.2034 146 Y 4.2684 8.5792 117.5725 61.0241 37.8191 178.6440 147 K 3.9523 8.4046 120.5756 59.3866 32.1061 178.0909 148 E 3.9430 7.9877 118.4855 59.5993 29.6233 178.4987 149 L 4.3141 7.8961 115.3988 54.4397 41.9500 177.2097 150 G 3.8884 7.8506 106.8704 46.3074 0.0000 173.2727 151 F 4.3897 8.3717 122.4001 57.8927 40.0924 175.5412 152 Q 3.5214 7.9352 125.6519 56.0991 27.8872 173.2005 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 G 8.35 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 2 L 8.08 4.24 0.00 0.50 0.62 0.53 -0.57 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 3 S 9.66 4.47 0.00 4.03 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.75 4.65 0.00 2.77 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 5 G 8.18 3.75 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 0.00 0.00 0.00 6 E 8.31 3.89 0.00 2.04 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 2.22 2.27 0.00 7 W 8.23 4.47 0.00 3.51 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 8 Q 8.47 4.06 0.00 2.21 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 9 Q 8.21 4.03 0.00 2.34 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.52 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 10 V 8.09 3.70 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.85 0.00 0.00 11 L 8.42 4.27 0.00 1.83 1.79 0.92 0.68 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 12 N 8.04 4.35 0.00 2.88 3.05 0.00 0.00 7.10 7.06 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 13 V 8.19 3.72 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.15 0.00 0.00 14 W 8.57 4.19 0.00 3.63 3.25 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 15 G 7.97 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.65 3.81 0.00 1.55 1.50 0.00 1.47 0.00 0.00 1.04 0.00 0.00 3.04 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.25 1.29 7.81 17 V 6.93 2.83 0.67 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 0.09 0.00 0.00 0.23 0.00 0.00 18 E 7.50 3.83 0.00 1.97 1.94 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 2.26 2.09 0.00 19 A 7.36 4.18 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 20 D 7.70 4.66 0.00 2.72 2.53 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 21 I 7.84 3.58 1.78 0.00 0.00 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 1.56 1.34 0.89 0.00 0.00 22 A 8.03 4.07 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 23 G 8.33 3.77 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 0.00 0.00 0.00 24 H 8.28 4.12 0.00 3.17 3.22 0.00 5.83 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.34 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.13 3.85 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 27 E 8.13 3.90 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 28 V 7.96 3.52 2.15 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 1.09 0.00 0.00 0.94 0.00 0.00 29 L 7.75 3.41 0.00 1.44 0.71 0.79 0.45 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 30 I 7.77 3.54 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.65 0.86 0.00 0.00 31 R 8.07 3.78 0.00 1.92 2.11 0.00 3.04 0.00 0.00 2.94 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 32 L 7.83 3.93 0.00 1.79 1.52 1.08 1.15 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 33 F 8.16 4.56 0.00 2.98 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 34 T 8.17 4.07 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 1.23 0.00 0.00 35 G 7.93 3.64 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 0.00 0.00 0.00 36 H 8.11 4.75 0.00 2.99 2.88 0.00 5.63 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.48 0.00 2.15 2.09 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.98 0.00 38 E 8.28 4.07 0.00 2.29 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 0.00 2.27 2.57 0.00 39 T 8.18 3.82 4.45 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 0.68 0.00 0.00 40 L 7.77 3.47 0.00 1.37 1.72 -0.13 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.75 4.03 0.00 2.19 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 0.00 2.38 2.54 0.00 42 K 8.10 4.43 0.00 1.87 1.74 0.00 1.92 0.00 0.00 1.79 0.00 0.00 3.22 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.77 1.98 7.81 43 F 8.27 4.62 0.00 3.23 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 44 D 8.63 4.40 0.00 2.67 2.71 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 45 K 7.84 3.90 0.00 1.60 1.73 0.00 1.36 0.00 0.00 1.49 0.00 0.00 2.71 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.85 0.21 7.81 46 F 8.00 5.09 0.00 2.80 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 47 K 7.64 3.97 0.00 1.69 1.98 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.67 1.42 7.81 48 H 8.13 4.30 0.00 3.28 3.50 0.00 5.72 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.39 4.19 0.00 1.63 1.62 0.80 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.16 4.23 0.00 1.86 1.86 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.52 7.81 51 T 7.54 4.74 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 1.21 0.00 0.00 52 E 8.74 3.89 0.00 2.04 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 2.35 2.36 0.00 53 A 7.98 3.97 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 54 E 8.00 3.94 0.00 2.14 2.04 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 2.37 2.36 0.00 55 M 8.11 4.13 0.00 2.03 2.24 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 2.84 2.55 0.00 56 K 8.27 3.91 0.00 1.73 1.96 0.00 1.63 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.47 7.81 57 A 7.85 4.42 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.57 4.36 0.00 4.03 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 59 E 8.83 4.03 0.00 2.06 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 2.42 2.32 0.00 60 D 8.16 4.43 0.00 2.92 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 61 L 8.04 3.74 0.00 1.41 1.64 0.71 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.79 3.87 0.00 1.82 1.95 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.42 7.81 63 K 8.34 3.90 0.00 2.01 2.12 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.51 7.81 64 H 8.96 4.32 0.00 3.70 3.69 0.00 5.84 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.34 3.64 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 0.00 0.00 0.00 66 T 8.03 3.89 4.42 0.00 0.00 0.00 0.00 0.00 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 67 V 7.69 3.59 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 1.05 0.00 0.00 0.99 0.00 0.00 68 V 8.04 3.63 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 1.06 0.00 0.00 0.97 0.00 0.00 69 L 8.19 4.26 0.00 1.86 1.82 0.83 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.31 4.00 4.47 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 1.26 0.00 0.00 71 A 8.20 3.98 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 72 L 8.11 3.65 0.00 1.60 1.80 -0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.56 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 0.00 0.00 0.00 74 G 7.75 3.63 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 0.00 0.00 0.00 75 I 7.48 3.84 1.87 0.00 0.00 1.00 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 0.70 0.96 0.00 0.00 76 L 7.78 3.94 0.00 1.19 1.49 0.01 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.73 3.94 0.00 1.60 1.77 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.18 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.45 7.81 78 K 7.83 3.96 0.00 1.86 1.78 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.57 1.73 7.81 79 K 8.32 2.00 0.00 1.17 0.74 0.00 1.36 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.52 1.02 7.81 80 G 7.93 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 81 H 7.40 4.53 0.00 3.17 3.23 0.00 5.79 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 82 H 7.37 5.38 0.00 3.27 3.42 0.00 5.67 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.66 3.89 0.00 2.12 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 0.00 2.40 2.48 0.00 84 A 7.93 3.99 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 85 E 8.07 4.09 0.00 2.23 2.02 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 2.39 2.43 0.00 86 L 8.52 4.02 0.00 1.68 1.72 0.70 0.47 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 87 K 8.25 3.81 0.00 1.96 1.83 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.49 7.81 88 P 0.00 4.25 0.00 2.33 2.31 0.00 3.71 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 2.23 2.13 0.00 89 L 7.49 4.00 0.00 1.99 1.76 1.04 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.28 4.08 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 91 Q 8.42 3.94 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.59 0.00 92 S 8.47 4.06 0.00 3.93 4.12 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 0.00 0.00 0.00 93 H 8.65 4.12 0.00 3.49 3.58 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.86 2.58 0.38 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 95 T 7.59 3.94 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 1.11 0.00 0.00 96 K 7.42 4.08 0.00 1.55 1.54 0.00 1.67 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.22 1.40 7.81 97 H 7.97 4.33 0.00 3.01 3.14 0.00 5.86 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 6.84 3.48 0.00 2.12 1.98 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.53 7.81 99 I 7.94 4.32 2.10 0.00 0.00 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 1.52 0.93 1.19 0.00 0.00 100 P 0.00 4.44 0.00 1.85 1.88 0.00 3.03 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 0.49 1.38 0.00 101 I 8.69 3.52 1.82 0.00 0.00 0.49 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 1.07 0.87 0.00 0.00 102 K 7.99 3.59 0.00 1.68 1.58 0.00 1.68 0.00 0.00 1.81 0.00 0.00 3.10 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.84 0.78 7.81 103 Y 8.04 4.23 0.00 3.21 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 0.00 104 L 7.88 4.14 0.00 1.79 1.76 0.68 1.02 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 0.00 105 E 8.24 3.95 0.00 1.98 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 2.39 2.39 0.00 106 F 8.16 4.51 0.00 3.29 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 0.00 107 I 8.32 3.82 2.05 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 1.15 0.00 0.00 108 S 8.33 4.22 0.00 4.21 4.01 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 0.00 109 D 8.41 4.45 0.00 3.03 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 0.00 110 A 8.37 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 0.00 111 I 8.09 3.67 2.12 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.75 0.99 0.00 0.00 112 I 7.77 3.86 2.16 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.30 1.15 0.00 0.00 113 H 8.48 4.16 0.00 3.32 3.51 0.00 5.80 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 0.00 114 V 8.18 3.52 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 0.96 0.00 0.00 1.00 0.00 0.00 115 L 7.99 3.81 0.00 1.22 0.50 0.48 0.77 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 0.00 116 H 8.13 4.34 0.00 3.42 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.00 4.11 0.00 3.72 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 0.00 118 K 8.16 4.08 0.00 1.52 1.47 0.00 1.64 0.00 0.00 1.26 0.00 0.00 2.55 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.28 1.41 7.81 119 H 8.06 4.99 0.00 3.23 3.19 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.58 0.00 2.19 2.08 0.00 3.40 0.00 0.00 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.92 0.00 121 G 9.16 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 0.00 122 D 8.37 4.95 0.00 2.63 2.79 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 0.00 123 F 8.02 4.94 0.00 2.77 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 0.00 124 G 8.13 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 0.00 0.00 0.00 125 A 8.37 3.88 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 0.00 126 D 7.99 4.21 0.00 3.10 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 0.00 127 A 7.89 4.00 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 0.00 0.00 128 Q 7.72 3.65 0.00 1.21 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 129 G 8.00 3.57 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 0.00 130 A 8.08 3.84 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 M 8.35 4.00 0.00 2.40 2.35 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.80 0.00 132 T 8.22 3.89 4.42 0.00 0.00 0.00 0.00 0.00 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 0.00 133 K 8.03 3.96 0.00 1.91 1.67 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.40 7.81 134 A 8.01 3.85 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 0.00 135 L 8.23 4.08 0.00 1.91 1.83 1.01 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.67 3.98 0.00 2.14 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 2.35 2.50 0.00 137 L 8.18 3.95 0.00 1.87 1.99 1.06 1.44 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 0.00 138 F 8.31 4.14 0.00 3.14 3.26 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 0.00 139 R 8.28 3.55 0.00 2.12 2.05 0.00 3.21 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 140 N 8.71 4.32 0.00 2.93 2.78 0.00 0.00 7.29 8.37 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 0.00 141 D 8.33 4.34 0.00 2.74 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 0.00 142 I 7.53 3.40 1.45 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.18 0.13 0.00 0.00 143 A 8.07 3.76 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 0.00 144 A 8.02 3.94 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 0.00 145 K 7.84 4.02 0.00 1.94 1.95 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.64 1.62 7.81 146 Y 8.58 4.27 0.00 3.13 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 0.00 147 K 8.40 3.95 0.00 1.86 1.98 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.46 7.81 148 E 7.99 3.94 0.00 2.04 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 0.00 2.35 2.39 0.00 149 L 7.90 4.31 0.00 1.82 1.68 0.86 0.94 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 0.00 150 G 7.85 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 0.00 151 F 8.37 4.39 0.00 2.69 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 0.00 152 Q 7.94 3.52 0.00 1.45 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.42 0.00 0.00 0.00 0.00 0.00 1.55 1.98 0.00