NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5804 8.1633 118.3535 54.8500 33.8737 173.8889 2 I 4.4827 8.1312 119.9373 61.0609 38.2697 170.6426 3 V 4.9641 9.5018 119.2346 59.9392 36.9881 174.0984 4 T 5.1418 8.9585 116.1082 60.8758 70.8240 172.8522 5 S 5.3241 9.4241 124.0933 56.6526 67.2203 172.9617 6 G 4.5548 9.5052 109.1126 44.5823 0.0000 172.6700 7 V 4.5051 8.9687 125.8748 61.3003 33.4913 174.0436 8 L 5.2008 8.7033 130.6342 53.2833 44.5616 175.1496 9 V 5.1994 8.6468 125.5045 61.1432 34.1900 174.3717 10 E 4.5587 9.5681 126.3764 55.8800 33.1464 175.3963 11 N 4.1369 9.7942 121.8041 54.5670 36.2650 174.9515 12 G 3.9877 8.5482 101.8333 45.8008 0.0000 173.0321 13 K 5.3996 8.0305 117.6923 54.3497 37.0332 175.5185 14 V 5.6279 8.7898 122.8840 59.0208 34.1058 174.4469 15 L 4.1201 8.3977 127.0170 54.6027 42.4796 175.7089 16 L 4.9755 8.5841 125.8703 53.0633 45.7980 176.2756 17 V 4.6817 8.3038 114.9259 59.4188 35.1822 174.8247 18 K 4.1843 8.2647 121.5332 55.6192 32.9348 176.7382 19 H 3.8828 8.8932 125.6304 56.5860 30.2306 175.7912 20 K 3.8302 8.8415 125.5874 59.5580 32.1289 177.9037 21 R 4.3562 8.2875 114.7637 57.4706 31.0228 177.3640 22 L 4.2716 7.9476 115.3425 54.4279 42.5272 177.0791 23 G 4.2618 8.4864 111.2845 45.6856 0.0000 174.9012 24 V 3.7778 7.3965 112.0991 61.6241 33.0234 175.5036 25 Y 4.6135 9.0546 121.9440 58.3267 39.0476 174.9263 26 I 4.7491 8.7275 123.2184 59.1603 42.4718 173.3882 27 Y 4.7559 7.5327 122.3915 55.7729 39.6809 173.2619 28 P 4.3289 0.0000 0.0000 62.8650 32.6587 175.6921 29 G 4.0236 8.5277 109.6963 46.7504 0.0000 171.5546 30 G 4.2627 7.6254 105.9035 46.3628 0.0000 172.7777 31 H 4.9231 8.9919 116.8736 55.6192 29.7536 175.5855 32 V 4.1764 7.9501 121.1059 61.6286 32.0988 176.0382 33 E 4.3108 8.7932 128.1837 55.7481 30.0689 176.6224 34 H 4.1544 8.8756 115.2924 59.1755 28.6090 176.1559 35 N 4.3219 8.0165 118.9074 52.5362 36.9076 174.5876 36 E 3.9613 7.7370 114.2823 52.6914 32.8534 178.3702 37 T 4.3800 9.5144 113.0215 60.4942 71.4984 174.1740 38 P 4.3245 0.0000 0.0000 65.9366 31.1539 179.0690 39 I 3.4136 7.6669 118.1453 64.3108 37.0098 178.1721 40 E 3.9209 8.0407 118.7902 59.1473 29.2535 179.1030 41 A 4.1479 8.3474 121.5018 55.3382 18.5164 180.1422 42 V 3.7245 8.0941 117.8278 64.7161 31.4004 178.7621 43 K 3.9069 7.8112 119.1745 59.2253 31.9266 179.1104 44 R 3.8779 8.1203 118.9082 59.6665 29.8029 178.3860 45 E 3.9733 8.6065 118.6843 59.4411 29.4582 179.1905 46 F 3.9093 8.4300 120.7342 61.0683 39.3373 176.8972 47 E 4.6741 8.6952 120.7625 58.7446 29.3282 178.5909 48 E 3.9703 8.2973 116.4589 58.9760 29.7287 178.2248 49 E 4.2593 8.1168 118.6535 57.4694 30.1508 177.0101 50 T 4.8990 7.6913 106.4926 59.4544 70.8407 175.4400 51 G 4.4171 8.4992 110.3434 46.2487 0.0000 173.2621 52 I 4.6294 7.7114 120.5152 60.9454 38.8195 175.1196 53 V 4.5925 9.0177 126.6777 61.5803 33.1813 175.1292 54 V 4.7988 8.1866 119.5346 59.4933 35.8118 174.2370 55 E 4.5403 8.9851 122.1643 53.8393 32.2239 173.2453 56 P 4.8755 0.0000 0.0000 62.4753 32.1498 175.6365 57 I 4.6675 9.3482 116.3059 58.9239 41.0583 174.9744 58 G 3.9540 8.0230 110.1332 45.6033 0.0000 171.8356 59 F 4.2639 7.9814 121.2936 58.2035 39.9629 174.3514 60 T 4.4435 6.4717 115.6274 59.9993 71.5487 173.5741 61 Y 3.9103 9.0463 122.6280 61.2604 38.0278 176.6183 62 G 4.1402 8.5803 108.9198 45.6732 0.0000 173.6339 63 I 3.9670 8.3528 121.4399 60.7062 37.8010 175.0984 64 I 4.5808 7.4432 122.1114 60.6111 40.5042 173.4180 65 D 4.4230 7.7719 122.6594 53.9825 43.3596 176.3718 66 E 4.0649 9.0398 117.8178 58.4892 29.5133 176.8234 67 N 4.9236 8.6966 114.4039 52.6054 40.9716 173.8841 68 A 4.5262 7.4154 119.1382 51.1693 22.5322 175.2263 69 V 4.7835 8.0038 118.6742 59.6863 34.3200 174.9260 70 E 4.1917 8.8386 126.0230 56.2909 30.1798 175.8859 71 R 4.7747 8.4365 125.4787 53.5097 32.1788 174.3353 72 P 4.5483 0.0000 0.0000 63.6571 31.6602 175.9587 73 M 4.3947 8.7951 122.4223 55.0052 32.5335 174.7510 74 P 4.1090 0.0000 0.0000 62.0166 32.0122 176.3417 75 L 4.2209 8.7944 124.9078 58.2673 42.6234 177.3100 76 V 4.2841 6.9899 114.8124 60.9634 34.3454 171.9149 77 I 4.6918 8.2523 121.9960 59.5510 39.7757 174.7905 78 L 4.5796 8.2620 126.9347 52.7178 44.6515 175.4348 79 E 4.7327 8.7236 124.8842 55.1750 30.2785 174.5300 80 E 4.6413 9.2948 128.0800 54.8305 31.9507 175.4946 81 V 4.5442 8.3365 124.1421 61.5235 33.1127 175.1896 82 V 4.0766 8.4919 129.5031 60.9626 32.9493 174.5691 83 K 4.4525 8.3106 128.3667 56.0091 32.6500 176.4237 84 Y 5.0125 8.6285 122.8086 55.2621 41.0481 175.1146 85 P 4.2762 0.0000 0.0000 65.7383 31.4771 177.3629 86 E 4.3509 8.1813 112.7331 55.5434 30.2731 175.8558 87 E 4.9659 7.0160 116.2420 57.3431 34.1640 174.9775 88 T 4.9766 8.2294 114.8321 63.0130 71.8930 173.4788 89 H 5.1275 8.7927 123.3008 54.3450 31.7544 173.9519 90 I 4.9816 8.3724 120.9263 59.9415 39.8327 174.6225 91 H 5.1834 9.1545 124.0159 54.0432 31.8296 172.8922 92 F 4.7566 9.2401 127.2925 57.1865 40.4361 174.3121 93 D 5.0871 8.7694 128.8045 52.7907 42.0749 175.6547 94 L 3.9914 8.9134 128.5489 54.1128 42.5408 176.3991 95 I 4.4553 8.0608 126.6979 60.1359 38.4012 174.8576 96 Y 4.9463 8.8078 125.6957 56.0229 40.9171 175.0150 97 L 4.6452 8.4724 124.1696 55.0046 43.5520 175.9085 98 V 5.0429 8.7166 118.4965 59.4788 35.9135 174.8255 99 K 4.6883 8.7230 122.2286 54.8986 35.7262 175.1094 100 R 4.4655 8.4928 122.5707 56.1316 30.7187 176.2425 101 V 4.4753 10.0955 118.9435 59.2225 34.0740 176.1479 102 G 3.8309 9.0766 109.2281 45.4446 0.0000 172.8289 103 G 4.4494 8.8319 107.8970 46.0339 0.0000 172.1055 104 D 4.8825 8.0353 115.8959 52.0837 45.5918 175.0458 105 L 4.3642 8.8622 124.2597 56.1262 41.8603 176.3649 106 K 4.6073 9.4259 125.8734 57.1529 35.0175 176.3688 107 N 4.7097 8.1473 116.3278 53.2878 41.7385 172.8243 108 G 4.1565 8.7564 110.0064 44.3225 0.0000 172.5104 109 E 4.6668 8.7960 117.3989 53.9419 33.4777 175.7476 110 W 4.4016 8.9629 124.0353 56.7541 29.6179 175.6653 111 I 4.2495 8.6663 127.9607 59.4453 38.3403 175.1834 112 D 4.8495 8.7227 127.8057 54.5143 41.5448 177.5050 113 V 3.7331 8.6677 119.9687 63.6812 31.6810 177.3249 114 R 4.2351 8.9395 118.1915 57.1093 30.3675 176.6479 115 E 4.5791 8.2594 116.8906 55.7909 31.5182 177.5598 116 I 3.5884 7.9743 118.3854 64.1314 37.8191 175.7981 117 D 4.6705 8.0271 117.2680 55.0820 40.9636 176.4155 118 R 4.7096 8.0243 116.0628 55.6789 29.8972 175.2712 119 I 4.4531 7.5894 118.1101 60.0661 40.4137 174.7457 120 E 4.2612 8.9843 126.4102 56.7227 30.2064 175.5076 121 T 5.2537 8.3051 116.7142 59.4072 72.1764 173.5951 122 F 4.4616 9.3622 124.4933 57.0955 40.6721 172.8011 123 P 4.0876 0.0000 0.0000 64.4130 31.5660 176.6208 124 N 4.2926 8.8941 117.0552 53.9079 36.9970 176.2016 125 V 3.6960 7.5803 120.1562 65.5592 31.4514 178.0378 126 R 3.9415 7.9561 117.1277 59.1419 29.8588 178.9846 127 K 3.9646 7.9538 117.8269 59.3770 32.0407 179.3207 128 V 3.6092 8.0969 118.5496 66.1797 31.4645 178.1617 129 V 3.6943 8.1935 118.1184 66.0862 31.2755 178.1567 130 S 4.1123 8.1191 114.7980 61.6316 62.8500 176.1439 131 L 3.9086 8.1284 121.5085 58.1106 41.3068 179.2616 132 A 4.0454 8.3649 120.4705 55.4748 18.2002 179.6536 133 L 3.9760 8.1839 117.2712 58.3016 41.9375 180.0032 134 S 4.2616 8.6333 115.0556 61.7121 62.6582 177.1126 135 T 4.0021 7.7354 118.3621 66.4784 68.2258 176.9055 136 L 4.1107 7.8241 120.9544 57.6174 41.7215 178.8817 137 Y 4.0220 8.3887 119.9194 60.5043 38.5384 177.7844 138 R 3.6318 7.7163 118.3178 59.4833 30.6749 178.2553 139 L 4.2036 7.9587 118.9243 57.7883 41.4350 179.0320 140 G 3.7631 8.6523 106.4255 47.7499 0.0000 174.8991 141 K 4.2937 8.1528 120.5155 56.7969 33.5588 178.1693 142 I 4.2106 7.4622 123.0730 63.0139 38.5255 176.7741 143 S 4.5698 7.6603 112.9154 58.6565 63.0784 175.2434 144 K 4.2887 7.5959 122.6433 57.9737 33.1277 177.3213 145 L 4.0476 7.7757 119.3947 57.8728 42.2141 178.0700 146 A 4.2367 7.4550 119.3054 54.4207 19.4893 178.4666 147 A 4.1932 7.1799 119.8324 49.7870 16.8324 177.3575 148 A 4.0971 7.7858 123.5439 52.7153 19.1231 176.8128 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.16 4.58 0.00 2.15 2.36 0.00 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.63 0.00 2 I 8.13 4.48 1.93 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 1.41 1.01 1.08 0.00 0.00 3 V 9.50 4.96 1.98 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 0.27 0.00 0.00 0.99 0.00 0.00 4 T 8.96 5.14 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 1.41 0.00 0.00 5 S 9.42 5.32 0.00 3.50 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 6 G 9.51 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.97 4.51 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 1.10 0.00 0.00 0.81 0.00 0.00 8 L 8.70 5.20 0.00 1.90 1.69 1.07 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.65 5.20 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 1.04 0.00 0.00 1.04 0.00 0.00 10 E 9.57 4.56 0.00 1.56 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 2.21 2.38 0.00 11 N 9.79 4.14 0.00 2.72 2.80 0.00 0.00 7.17 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 12 G 8.55 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 13 K 8.03 5.40 0.00 2.04 1.99 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.58 7.81 14 V 8.79 5.63 2.19 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 1.02 0.00 0.00 1.10 0.00 0.00 15 L 8.40 4.12 0.00 0.27 1.27 -0.05 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 16 L 8.58 4.98 0.00 1.61 1.69 0.87 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.30 4.68 1.98 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 0.52 0.00 0.00 0.85 0.00 0.00 18 K 8.26 4.18 0.00 1.50 1.55 0.00 1.66 0.00 0.00 1.46 0.00 0.00 2.75 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.87 1.13 7.81 19 H 8.89 3.88 0.00 3.23 3.23 0.00 5.61 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 20 K 8.84 3.83 0.00 1.74 1.86 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.40 7.81 21 R 8.29 4.36 0.00 1.97 2.06 0.00 3.21 0.00 0.00 3.08 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.41 0.00 22 L 7.95 4.27 0.00 1.44 1.69 0.90 0.93 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 23 G 8.49 4.26 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 0.00 24 V 7.40 3.78 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.08 0.00 0.00 25 Y 9.05 4.61 0.00 3.04 2.81 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 26 I 8.73 4.75 1.70 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 1.09 1.08 0.82 0.00 0.00 27 Y 7.53 4.76 0.00 3.14 3.18 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 28 P 0.00 4.33 0.00 1.00 1.27 0.00 3.84 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.64 0.00 29 G 8.53 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 0.00 0.00 0.00 30 G 7.63 4.26 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 0.00 31 H 8.99 4.92 0.00 3.02 3.28 0.00 5.89 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.95 4.18 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 0.80 0.00 0.00 0.99 0.00 0.00 33 E 8.79 4.31 0.00 1.90 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 0.00 2.37 2.26 0.00 34 H 8.88 4.15 0.00 3.27 3.45 0.00 5.53 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.02 4.32 0.00 2.79 2.74 0.00 0.00 6.04 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 36 E 7.74 3.96 0.00 2.18 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 2.24 2.36 0.00 37 T 9.51 4.38 4.26 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 1.24 0.00 0.00 38 P 0.00 4.32 0.00 2.37 2.34 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 39 I 7.67 3.41 1.79 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 1.58 1.31 0.75 0.00 0.00 40 E 8.04 3.92 0.00 2.15 1.98 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 2.30 2.30 0.00 41 A 8.35 4.15 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 42 V 8.09 3.72 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 0.75 0.00 0.00 1.09 0.00 0.00 43 K 7.81 3.91 0.00 1.90 1.88 0.00 1.60 0.00 0.00 1.52 0.00 0.00 2.83 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.61 1.44 7.81 44 R 8.12 3.88 0.00 1.88 2.14 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 45 E 8.61 3.97 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 46 F 8.43 3.91 0.00 3.41 2.98 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 47 E 8.70 4.67 0.00 2.29 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 2.34 0.00 48 E 8.30 3.97 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.33 0.00 49 E 8.12 4.26 0.00 1.77 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 2.24 2.59 0.00 50 T 7.69 4.90 4.20 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 0.76 0.00 0.00 51 G 8.50 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 0.00 0.00 0.00 0.00 52 I 7.71 4.63 2.26 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.63 1.10 0.00 0.00 53 V 9.02 4.59 2.00 0.00 0.00 0.00 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 1.00 0.00 0.00 54 V 8.19 4.80 1.75 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 -0.21 0.00 0.00 0.47 0.00 0.00 55 E 8.99 4.54 0.00 1.91 1.68 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 2.13 2.22 0.00 56 P 0.00 4.88 0.00 1.57 1.42 0.00 3.50 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.84 0.00 57 I 9.35 4.67 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.68 0.93 0.00 0.00 58 G 8.02 3.95 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 0.00 0.00 0.00 59 F 7.98 4.26 0.00 3.09 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 60 T 6.47 4.44 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 1.09 0.00 0.00 61 Y 9.05 3.91 0.00 3.03 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 62 G 8.58 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 0.00 0.00 0.00 0.00 63 I 8.35 3.97 1.89 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 1.30 0.55 0.91 0.00 0.00 64 I 7.44 4.58 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 1.46 0.62 0.96 0.00 0.00 65 D 7.77 4.42 0.00 2.90 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 66 E 9.04 4.06 0.00 1.96 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 2.31 2.39 0.00 67 N 8.70 4.92 0.00 2.70 2.80 0.00 0.00 6.71 7.27 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 68 A 7.42 4.53 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 69 V 8.00 4.78 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 0.73 0.00 0.00 0.91 0.00 0.00 70 E 8.84 4.19 0.00 2.15 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 2.31 2.33 0.00 71 R 8.44 4.77 0.00 1.77 1.85 0.00 3.42 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 72 P 0.00 4.55 0.00 2.15 2.07 0.00 3.74 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 73 M 8.80 4.39 0.00 1.98 2.17 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.88 0.00 74 P 0.00 4.11 0.00 1.66 1.34 0.00 3.62 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.50 0.00 75 L 8.79 4.22 0.00 1.56 1.80 0.92 0.97 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 76 V 6.99 4.28 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 0.51 0.00 0.00 0.87 0.00 0.00 77 I 8.25 4.69 1.66 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 1.14 0.53 0.18 0.00 0.00 78 L 8.26 4.58 0.00 1.60 1.53 0.99 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.72 4.73 0.00 1.97 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 2.33 2.54 0.00 80 E 9.29 4.64 0.00 2.08 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 2.50 0.00 81 V 8.34 4.54 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 0.72 0.00 0.00 0.93 0.00 0.00 82 V 8.49 4.08 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 0.11 0.00 0.00 0.97 0.00 0.00 83 K 8.31 4.45 0.00 1.58 1.68 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.40 7.81 84 Y 8.63 5.01 0.00 3.09 2.81 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 85 P 0.00 4.28 0.00 2.06 2.15 0.00 3.77 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 2.07 2.13 0.00 86 E 8.18 4.35 0.00 2.08 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 0.00 2.28 2.23 0.00 87 E 7.02 4.97 0.00 2.35 2.25 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 2.14 2.18 0.00 88 T 8.23 4.98 4.27 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 1.21 0.00 0.00 89 H 8.79 5.13 0.00 3.08 3.25 0.00 5.57 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 90 I 8.37 4.98 1.95 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 0.93 1.01 0.00 0.00 91 H 9.15 5.18 0.00 3.22 3.20 0.00 5.62 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 F 9.24 4.76 0.00 3.17 2.98 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 93 D 8.77 5.09 0.00 2.80 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.91 3.99 0.00 1.65 1.32 1.07 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.06 4.46 1.79 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.60 0.48 0.00 0.00 96 Y 8.81 4.95 0.00 2.92 2.78 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 97 L 8.47 4.65 0.00 1.83 1.68 0.96 0.90 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 98 V 8.72 5.04 1.85 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 0.76 0.00 0.00 0.72 0.00 0.00 99 K 8.72 4.69 0.00 1.77 1.87 0.00 1.29 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.30 7.81 100 R 8.49 4.47 0.00 1.95 2.01 0.00 3.23 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 101 V 10.10 4.48 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 0.69 0.00 0.00 0.85 0.00 0.00 102 G 9.08 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 0.00 103 G 8.83 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 0.00 0.00 0.00 0.00 104 D 8.04 4.88 0.00 2.63 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.86 4.36 0.00 1.85 1.74 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 106 K 9.43 4.61 0.00 1.61 1.81 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.72 1.51 7.81 107 N 8.15 4.71 0.00 2.68 2.80 0.00 0.00 7.36 8.00 0.00 0.00 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 8.76 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 0.00 109 E 8.80 4.67 0.00 1.81 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 0.00 2.25 2.31 0.00 110 W 8.96 4.40 0.00 3.21 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 0.00 111 I 8.67 4.25 1.92 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.73 0.81 0.00 0.00 112 D 8.72 4.85 0.00 2.75 2.56 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 0.00 113 V 8.67 3.73 2.10 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 0.83 0.00 0.00 0.99 0.00 0.00 114 R 8.94 4.24 0.00 1.95 1.97 0.00 3.10 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 115 E 8.26 4.58 0.00 2.06 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 2.20 2.19 0.00 116 I 7.97 3.59 1.87 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 1.42 0.61 0.95 0.00 0.00 117 D 8.03 4.67 0.00 2.70 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 0.00 118 R 8.02 4.71 0.00 1.85 1.95 0.00 3.04 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.80 0.00 119 I 7.59 4.45 1.97 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.64 0.76 0.00 0.00 120 E 8.98 4.26 0.00 2.10 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 2.41 2.33 0.00 121 T 8.31 5.25 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 1.27 0.00 0.00 122 F 9.36 4.46 0.00 3.00 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 0.00 123 P 0.00 4.09 0.00 1.49 1.71 0.00 2.20 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.77 0.00 124 N 8.89 4.29 0.00 2.95 2.97 0.00 0.00 6.75 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 0.00 125 V 7.58 3.70 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 1.11 0.00 0.00 0.54 0.00 0.00 126 R 7.96 3.94 0.00 1.90 1.97 0.00 3.18 0.00 0.00 3.51 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 127 K 7.95 3.96 0.00 2.00 1.88 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.50 7.81 128 V 8.10 3.61 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 1.07 0.00 0.00 1.15 0.00 0.00 129 V 8.19 3.69 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 1.13 0.00 0.00 1.10 0.00 0.00 130 S 8.12 4.11 0.00 4.18 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 0.00 131 L 8.13 3.91 0.00 1.92 1.75 0.92 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 132 A 8.36 4.05 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 0.00 133 L 8.18 3.98 0.00 1.91 1.75 0.94 1.01 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 0.00 134 S 8.63 4.26 0.00 3.97 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 0.00 135 T 7.74 4.00 4.50 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 1.23 0.00 0.00 136 L 7.82 4.11 0.00 1.71 1.76 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 8.39 4.02 0.00 3.07 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 0.00 138 R 7.72 3.63 0.00 1.93 2.09 0.00 3.31 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 139 L 7.96 4.20 0.00 1.80 1.68 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.65 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 0.00 141 K 8.15 4.29 0.00 1.73 1.67 0.00 1.10 0.00 0.00 1.40 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.90 1.20 7.81 142 I 7.46 4.21 2.04 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 1.52 0.85 0.88 0.00 0.00 143 S 7.66 4.57 0.00 4.00 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 0.00 144 K 7.60 4.29 0.00 1.84 1.79 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.45 7.81 145 L 7.78 4.05 0.00 1.63 1.64 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 146 A 7.45 4.24 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 0.00 147 A 7.18 4.19 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 0.00 148 A 7.79 4.10 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