NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3001 8.3049 118.1928 53.4592 33.3669 176.4798 2 L 3.4088 7.8347 119.5393 53.3521 40.0613 170.4507 3 T 4.3295 7.7452 106.4617 61.5096 72.5120 172.3440 4 D 4.6776 7.7023 125.3996 51.0244 42.3339 175.4555 5 P 5.0871 0.0000 0.0000 65.1281 31.2058 178.6328 6 I 3.6783 7.8830 117.8664 64.2411 37.1139 177.8809 7 A 3.9672 8.5668 122.1561 55.4196 18.2800 179.4739 8 D 4.3059 7.7290 116.0722 56.5838 39.4263 178.3664 9 M 3.9379 7.9103 119.6200 58.6790 32.3528 178.1397 10 L 3.9454 8.0898 119.1515 58.1543 41.6987 179.8616 11 T 3.8366 7.9236 115.6842 66.4288 68.2914 176.7154 12 R 3.8790 8.1874 120.4293 59.4274 30.0784 178.8365 13 I 3.6109 7.4861 118.9442 64.4920 37.2806 178.2595 14 R 3.7800 7.9217 119.0652 59.6385 29.6783 178.2463 15 N 4.2704 8.4803 114.7304 56.1985 38.9605 177.0706 16 A 4.1380 8.3593 122.7534 55.3396 18.5023 179.6638 17 T 3.9216 8.5508 108.9401 65.2715 68.4533 176.7771 18 R 3.6107 7.6208 119.2418 57.9467 30.1018 178.3321 19 V 4.0731 7.1436 109.1569 59.8304 33.6102 174.6890 20 Y 3.5747 7.1701 115.5398 58.1180 34.7310 169.2028 21 K 4.5104 7.7270 119.4539 54.9405 34.8672 177.4771 22 E 4.1515 8.9020 121.8574 58.8119 29.7650 176.3982 23 S 5.1039 7.4088 108.8687 59.2189 65.4213 174.5467 24 T 4.7159 7.8156 114.9448 62.5085 73.0348 173.2329 25 D 5.8500 8.5210 123.4253 52.5898 43.8018 176.2095 26 V 4.2694 8.5651 113.7830 60.4931 33.8782 169.9061 27 P 3.7994 0.0000 0.0000 62.0006 31.8719 175.7512 28 A 4.3223 8.1778 125.7988 52.0770 19.4017 177.2994 29 S 4.4876 8.3839 112.1351 56.1048 65.8378 176.3203 30 R 3.8993 8.7948 123.8256 59.9890 29.7345 178.6116 31 F 4.0662 8.2195 119.5981 61.2099 39.4146 177.0547 32 K 3.9593 7.9794 118.3753 59.2737 31.6949 179.1631 33 E 3.5698 7.9744 118.4641 59.3704 29.4314 179.0696 34 E 3.7772 7.8342 118.1536 59.4549 29.4262 179.5748 35 I 3.4887 7.3190 119.4751 64.4801 37.1865 178.6326 36 L 3.8710 7.7876 119.7007 57.2082 41.2511 179.3653 37 R 3.9967 8.3676 119.8843 59.8648 30.0675 178.7279 38 I 3.8365 7.8347 119.0461 63.8066 37.1172 177.9491 39 L 4.1709 8.1870 120.8417 56.9520 41.8003 177.9470 40 A 4.4873 8.0560 120.0960 53.4131 19.8185 178.6800 41 R 3.8154 8.0539 117.1759 59.3698 30.1489 177.0675 42 E 4.2826 8.1233 113.7590 55.4851 29.8855 174.5037 43 G 3.7333 8.0753 111.7301 45.5113 0.0000 172.9122 44 F 4.8791 9.1875 121.6972 56.6636 41.8555 174.7800 45 I 4.7288 7.8107 110.2467 58.7038 39.9059 176.1257 46 K 4.1210 9.4075 123.9074 57.6185 32.7944 177.9246 47 G 4.0106 7.5427 105.6437 47.1883 0.0000 169.8401 48 Y 5.9358 7.7069 116.3052 57.8403 40.5837 173.1203 49 E 4.7273 8.2869 114.8399 55.3368 32.5801 175.1338 50 R 4.4576 8.9091 120.7720 56.9975 30.5001 176.1160 51 V 4.5103 8.4534 124.4365 61.1275 34.6529 173.9751 52 D 5.2265 8.5610 124.0304 53.2340 43.2648 176.8213 53 V 4.1980 8.3189 122.6026 62.2084 32.0898 174.5650 54 D 4.5623 9.3833 128.9033 54.9791 38.2561 174.9705 55 G 3.9533 8.6239 104.9545 45.2095 0.0000 173.5706 56 K 4.5940 7.6565 119.5684 53.4495 34.2405 173.7242 57 P 4.7582 0.0000 0.0000 63.3065 32.3703 175.1532 58 Y 5.1102 9.0981 122.2139 56.4401 43.0234 173.8404 59 L 5.0022 8.6129 118.5083 53.7358 45.9313 176.4306 60 R 4.2172 8.7329 124.0803 55.9672 31.3082 176.1819 61 V 4.4863 8.4189 126.2607 61.1570 32.2763 173.5328 62 Y 4.5014 8.3894 124.7791 57.5727 38.3946 175.8053 63 L 4.4999 8.5829 124.6638 54.6027 42.6431 176.6634 64 K 4.8222 8.2010 121.1843 55.1917 34.8531 174.4326 65 Y 4.8778 8.3798 121.2915 56.5505 43.1133 174.8624 66 G 4.0891 8.9855 109.2961 44.8479 0.0000 171.6439 67 P 4.6909 0.0000 0.0000 61.8962 32.7037 176.4752 68 R 4.0651 8.4419 121.6869 56.8013 30.6626 175.5892 69 R 4.7260 8.1927 119.5899 54.6160 34.5304 175.9673 70 Q 4.4252 8.5743 120.7923 55.8719 31.2716 176.0679 71 G 3.9318 8.7392 109.5270 44.2516 0.0000 171.4810 72 P 4.1082 0.0000 0.0000 63.9781 31.5247 175.6065 73 D 4.2369 8.7263 121.4518 54.1110 38.8859 171.4981 74 P 4.8512 0.0000 0.0000 62.0373 28.4455 175.6109 75 R 4.1757 7.7186 121.4377 55.5684 30.9892 175.5819 76 P 4.4741 0.0000 0.0000 62.6821 32.1173 176.2469 77 E 4.1715 8.6623 123.1896 56.2722 30.3080 175.6415 78 Q 4.8585 8.3199 122.8454 54.2633 30.0338 176.3880 79 V 3.7548 8.5005 123.2582 65.1491 31.8724 175.9961 80 I 4.4315 7.2404 120.8311 59.2919 36.1340 174.4168 81 H 4.0740 8.5571 121.5115 58.7922 29.2770 175.5458 82 H 4.3532 7.8355 116.4395 55.0128 33.4120 172.6074 83 I 4.7123 7.3471 123.8207 59.2913 41.1291 173.8305 84 R 4.4542 8.2605 126.4406 55.3310 33.9382 174.1489 85 R 4.1900 8.7143 126.3859 56.5303 30.5562 174.6847 86 I 4.1379 7.8837 123.1791 63.0526 39.1697 177.0470 87 S 4.1276 8.0622 123.9305 58.1478 61.1630 174.2960 88 K 4.3690 8.1266 126.6381 54.3349 32.9835 176.8741 89 P 4.3404 0.0000 0.0000 65.7041 31.5521 178.3190 90 G 3.5649 8.1357 107.4304 47.5010 0.0000 173.3506 91 R 4.3519 7.5559 120.5732 53.8016 31.6305 174.4386 92 R 4.0215 8.5320 125.5368 55.8243 30.5446 176.1942 93 V 4.0832 8.2080 124.3570 61.4665 33.0320 173.9430 94 Y 5.1197 8.4276 125.4846 56.2611 40.5533 175.6673 95 V 4.5493 8.4734 116.6209 59.3537 35.6192 176.1375 96 G 4.2155 8.9521 112.9468 44.5439 0.0000 175.1215 97 V 3.5768 8.3901 118.0573 64.8892 31.2149 179.1575 98 K 4.6323 7.8008 118.7312 56.2340 31.9167 177.6500 99 E 4.6337 8.2085 117.7596 55.7518 31.9430 176.7711 100 I 3.6675 7.1657 119.2468 61.1685 37.5177 174.3010 101 P 4.3895 0.0000 0.0000 62.4938 31.8523 176.3531 102 R 4.3104 8.0362 119.0314 54.0907 30.7977 176.2801 103 V 3.3715 8.2425 123.8169 63.4183 31.7442 176.1153 104 R 3.6005 9.0451 130.6404 57.9225 28.8805 176.0551 105 R 3.6571 8.4974 112.9302 57.4590 27.8989 177.7787 106 G 4.2062 8.1621 106.9549 45.9337 0.0000 174.4838 107 L 4.0540 7.6672 118.1810 56.5823 41.7503 176.3999 108 G 4.5561 7.7976 105.2782 44.3528 0.0000 172.2494 109 I 5.0729 8.9805 118.3260 59.3662 40.6522 174.4921 110 A 5.1906 8.7516 129.0315 48.6630 20.5752 174.5926 111 I 4.3084 8.0738 122.0352 61.8983 38.7011 175.1384 112 L 5.1105 8.5785 125.8310 54.3753 44.4910 174.9635 113 S 4.6149 9.1887 117.7389 58.0728 63.1422 173.6050 114 T 4.8982 8.7721 118.7903 60.6685 70.5011 175.8658 115 S 4.4731 8.1526 115.5999 59.5035 63.0065 174.5520 116 K 4.6071 8.8389 120.2116 54.9332 34.0749 176.7364 117 G 3.8223 6.3049 104.9542 45.4610 0.0000 172.1160 118 V 4.6960 7.9559 123.3429 61.1569 34.2401 175.8481 119 L 5.0470 8.6294 126.4796 53.0588 46.6526 176.1616 120 T 4.7414 8.2263 110.6475 60.9110 71.0713 175.5746 121 D 4.3438 8.2976 119.3987 57.0440 39.1133 179.0083 122 R 3.9658 7.9119 119.7506 58.4798 30.1679 178.7975 123 E 3.9388 8.3178 118.2296 59.3250 29.5068 179.2571 124 A 3.9915 8.3009 121.1271 55.1105 18.2369 179.5086 125 R 3.8326 7.6319 115.7068 59.4051 30.1822 178.2774 126 K 4.0631 8.0287 118.2799 59.7335 32.3834 178.6844 127 L 4.1294 7.8774 117.3301 55.3664 42.4075 176.7214 128 G 3.6960 8.3789 105.8168 45.9447 0.0000 172.9704 129 V 4.5701 7.3728 108.9518 59.6802 36.4393 176.0671 130 G 4.1863 8.4452 108.7238 44.2776 0.0000 171.6656 131 G 4.7946 7.8735 105.4205 45.6530 0.0000 171.7942 132 E 4.7399 8.3126 120.5884 55.6417 30.7985 175.7843 133 L 4.3000 8.6037 130.0969 55.6512 42.1752 177.4034 134 I 3.8367 8.7083 127.8554 63.3088 37.7651 175.7326 135 C 5.3694 7.6491 114.0809 58.1804 33.7763 171.7265 136 E 4.9608 8.1602 115.6489 55.3418 33.2649 174.5747 137 V 4.6996 8.9781 119.6532 61.3942 35.7454 174.5387 138 W 4.7317 8.5059 123.0756 57.3442 28.2862 174.0482 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 4.30 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 2 L 7.83 3.41 0.00 1.86 1.72 0.90 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 3 T 7.75 4.33 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 1.19 0.00 0.00 4 D 7.70 4.68 0.00 2.72 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 5 P 0.00 5.09 0.00 2.18 2.06 0.00 3.88 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 6 I 7.88 3.68 2.18 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.00 0.99 0.00 0.00 7 A 8.57 3.97 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 8 D 7.73 4.31 0.00 2.99 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 9 M 7.91 3.94 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.53 0.00 10 L 8.09 3.95 0.00 1.75 1.62 0.87 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.92 3.84 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 1.18 0.00 0.00 12 R 8.19 3.88 0.00 1.92 1.98 0.00 3.31 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.83 0.00 13 I 7.49 3.61 1.95 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 1.33 0.69 0.80 0.00 0.00 14 R 7.92 3.78 0.00 1.91 1.98 0.00 3.03 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 15 N 8.48 4.27 0.00 2.82 2.84 0.00 0.00 7.09 7.56 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 16 A 8.36 4.14 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 17 T 8.55 3.92 4.32 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 1.11 0.00 0.00 18 R 7.62 3.61 0.00 1.94 1.92 0.00 3.03 0.00 0.00 3.37 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 19 V 7.14 4.07 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 0.73 0.00 0.00 1.00 0.00 0.00 20 Y 7.17 3.57 0.00 3.05 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.73 4.51 0.00 1.84 1.79 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.38 7.81 22 E 8.90 4.15 0.00 2.10 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 2.48 2.53 0.00 23 S 7.41 5.10 0.00 3.60 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 7.82 4.72 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 25 D 8.52 5.85 0.00 2.52 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 26 V 8.57 4.27 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 0.67 0.00 0.00 0.89 0.00 0.00 27 P 0.00 3.80 0.00 1.75 1.73 0.00 3.57 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.65 0.00 28 A 8.18 4.32 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 29 S 8.38 4.49 0.00 3.97 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 30 R 8.79 3.90 0.00 1.98 2.07 0.00 3.26 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.81 0.00 31 F 8.22 4.07 0.00 3.13 3.03 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 32 K 7.98 3.96 0.00 1.90 1.76 0.00 1.80 0.00 0.00 1.60 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.52 7.81 33 E 7.97 3.57 0.00 2.22 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 2.37 2.55 0.00 34 E 7.83 3.78 0.00 1.79 1.72 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 2.41 2.38 0.00 35 I 7.32 3.49 1.86 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 1.49 0.75 0.79 0.00 0.00 36 L 7.79 3.87 0.00 1.01 1.30 0.53 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.37 4.00 0.00 1.96 2.05 0.00 3.21 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 38 I 7.83 3.84 1.82 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 1.40 0.96 0.92 0.00 0.00 39 L 8.19 4.17 0.00 1.90 1.73 0.74 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.06 4.49 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.05 3.82 0.00 1.99 2.17 0.00 3.27 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 42 E 8.12 4.28 0.00 2.21 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 2.36 2.50 0.00 43 G 8.08 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 F 9.19 4.88 0.00 3.12 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 45 I 7.81 4.73 1.97 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.80 0.95 0.00 0.00 46 K 9.41 4.12 0.00 1.92 1.97 0.00 2.00 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.54 1.63 7.81 47 G 7.54 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 0.00 0.00 0.00 48 Y 7.71 5.94 0.00 3.04 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 49 E 8.29 4.73 0.00 2.03 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 2.45 2.39 0.00 50 R 8.91 4.46 0.00 1.75 2.01 0.00 3.28 0.00 0.00 3.19 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 51 V 8.45 4.51 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 1.03 0.00 0.00 1.08 0.00 0.00 52 D 8.56 5.23 0.00 2.74 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 53 V 8.32 4.20 1.82 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 0.67 0.00 0.00 0.49 0.00 0.00 54 D 9.38 4.56 0.00 2.86 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.62 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 56 K 7.66 4.59 0.00 2.17 1.96 0.00 1.84 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.54 7.81 57 P 0.00 4.76 0.00 2.04 2.01 0.00 3.55 0.00 0.00 3.99 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 58 Y 9.10 5.11 0.00 2.99 2.86 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 59 L 8.61 5.00 0.00 1.58 1.58 0.88 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.73 4.22 0.00 1.60 1.02 0.00 3.04 0.00 0.00 2.90 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 61 V 8.42 4.49 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 0.96 0.00 0.00 0.88 0.00 0.00 62 Y 8.39 4.50 0.00 3.04 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 63 L 8.58 4.50 0.00 1.84 1.37 1.09 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.20 4.82 0.00 1.74 1.73 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.46 7.81 65 Y 8.38 4.88 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 66 G 8.99 4.09 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 0.00 0.00 0.00 67 P 0.00 4.69 0.00 2.10 1.99 0.00 3.64 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 2.13 2.10 0.00 68 R 8.44 4.07 0.00 1.77 1.81 0.00 3.13 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 69 R 8.19 4.73 0.00 1.80 1.74 0.00 3.35 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 70 Q 8.57 4.43 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.93 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 71 G 8.74 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 72 P 0.00 4.11 0.00 2.06 2.02 0.00 3.84 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 2.03 2.09 0.00 73 D 8.73 4.24 0.00 2.77 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 74 P 0.00 4.85 0.00 2.06 2.12 0.00 3.40 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.81 0.00 75 R 7.72 4.18 0.00 1.76 2.03 0.00 3.41 0.00 0.00 3.68 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.66 0.00 76 P 0.00 4.47 0.00 1.36 1.82 0.00 2.97 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 1.31 1.82 0.00 77 E 8.66 4.17 0.00 2.08 1.88 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 2.38 2.41 0.00 78 Q 8.32 4.86 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.87 0.00 0.00 0.00 0.00 0.00 2.42 2.23 0.00 79 V 8.50 3.75 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 0.79 0.00 0.00 0.90 0.00 0.00 80 I 7.24 4.43 1.76 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 0.77 0.69 0.00 0.00 81 H 8.56 4.07 0.00 3.05 3.08 0.00 5.93 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 82 H 7.84 4.35 0.00 2.26 1.31 0.00 5.76 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.35 4.71 1.57 0.00 0.00 0.70 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 1.13 0.70 0.00 0.00 84 R 8.26 4.45 0.00 1.71 1.84 0.00 3.18 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 85 R 8.71 4.19 0.00 1.78 1.78 0.00 3.26 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.86 0.00 86 I 7.88 4.14 1.86 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.04 0.89 0.00 0.00 87 S 8.06 4.13 0.00 3.77 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 88 K 8.13 4.37 0.00 1.86 1.68 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.51 7.81 89 P 0.00 4.34 0.00 2.14 2.14 0.00 3.73 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 1.96 1.93 0.00 90 G 8.14 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 91 R 7.56 4.35 0.00 1.86 1.73 0.00 3.05 0.00 0.00 3.13 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 92 R 8.53 4.02 0.00 1.79 1.45 0.00 3.50 0.00 0.00 3.13 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 93 V 8.21 4.08 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 0.91 0.00 0.00 0.93 0.00 0.00 94 Y 8.43 5.12 0.00 2.89 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 95 V 8.47 4.55 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 0.95 0.00 0.00 1.04 0.00 0.00 96 G 8.95 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 0.00 0.00 0.00 0.00 97 V 8.39 3.58 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 0.80 0.00 0.00 0.96 0.00 0.00 98 K 7.80 4.63 0.00 1.78 1.87 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.46 7.81 99 E 8.21 4.63 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 2.24 2.26 0.00 100 I 7.17 3.67 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.81 0.92 0.00 0.00 101 P 0.00 4.39 0.00 2.04 1.97 0.00 3.63 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 2.03 2.10 0.00 102 R 8.04 4.31 0.00 1.71 1.85 0.00 3.24 0.00 0.00 3.14 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 103 V 8.24 3.37 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 1.06 0.00 0.00 1.02 0.00 0.00 104 R 9.05 3.60 0.00 1.18 1.62 0.00 3.05 0.00 0.00 2.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.30 0.00 105 R 8.50 3.66 0.00 1.95 1.90 0.00 3.35 0.00 0.00 3.30 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 106 G 8.16 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 0.00 0.00 0.00 0.00 107 L 7.67 4.05 0.00 1.79 1.80 0.92 0.77 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 0.00 108 G 7.80 4.56 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 0.00 109 I 8.98 5.07 2.04 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.40 1.04 0.00 0.00 110 A 8.75 5.19 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 0.00 111 I 8.07 4.31 1.83 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 1.37 0.81 0.83 0.00 0.00 112 L 8.58 5.11 0.00 1.88 1.73 0.96 0.51 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 0.00 113 S 9.19 4.61 0.00 4.25 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 0.00 114 T 8.77 4.90 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 1.24 0.00 0.00 115 S 8.15 4.47 0.00 3.84 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 0.00 116 K 8.84 4.61 0.00 1.65 1.77 0.00 1.89 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.34 1.50 7.81 117 G 6.30 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 V 7.96 4.70 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 0.72 0.00 0.00 0.88 0.00 0.00 119 L 8.63 5.05 0.00 1.63 1.56 0.93 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.23 4.74 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 1.35 0.00 0.00 121 D 8.30 4.34 0.00 2.89 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 0.00 122 R 7.91 3.97 0.00 1.89 2.03 0.00 3.14 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 123 E 8.32 3.94 0.00 2.13 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 2.34 2.34 0.00 124 A 8.30 3.99 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 0.00 125 R 7.63 3.83 0.00 2.02 2.17 0.00 3.28 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 126 K 8.03 4.06 0.00 1.91 2.05 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.49 7.81 127 L 7.88 4.13 0.00 1.67 1.73 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.38 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 V 7.37 4.57 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 0.73 0.00 0.00 0.95 0.00 0.00 130 G 8.45 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 0.00 131 G 7.87 4.79 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 0.00 132 E 8.31 4.74 0.00 2.41 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 2.35 2.04 0.00 133 L 8.60 4.30 0.00 1.77 1.55 0.92 1.14 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 0.00 134 I 8.71 3.84 2.10 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.95 1.01 0.00 0.00 135 C 7.65 5.37 0.00 3.11 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 0.00 136 E 8.16 4.96 0.00 2.15 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 2.27 2.34 0.00 137 V 8.98 4.70 1.58 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 0.08 0.00 0.00 0.65 0.00 0.00 138 W 8.51 4.73 0.00 3.55 3.12 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