NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1925 8.1727 122.0538 56.2964 34.1498 174.0582 2 V 4.5586 8.1660 126.8129 60.6727 32.4060 174.4998 3 F 4.3683 10.0180 129.1659 57.5918 40.1081 174.9478 4 E 4.1806 9.0992 121.5778 55.5246 30.9859 176.6451 5 R 3.2312 8.9623 120.0077 61.0395 29.9638 179.3007 6 C 4.3225 8.0063 115.3735 59.7385 36.0026 175.8123 7 E 3.9032 8.0851 120.6935 59.1888 29.2567 178.4804 8 L 3.6321 8.1061 120.1978 57.9139 42.0715 178.5996 9 A 3.9407 7.8581 120.7113 55.4476 18.3295 179.9130 10 R 3.9136 8.1223 116.4123 59.4854 30.1047 179.4995 11 T 3.8674 7.7659 115.5455 66.6543 68.5090 176.7315 12 L 3.8578 8.0922 121.2676 57.5123 41.6011 179.5312 13 K 3.9066 8.0194 119.6228 59.5630 31.9544 178.8769 14 R 3.9424 7.8189 117.7281 59.1400 30.0441 177.5625 15 L 4.3177 7.6429 116.0358 54.1978 41.7344 176.8570 16 G 3.8352 7.8347 106.8675 47.0756 0.0000 175.1134 17 M 3.8496 7.8542 120.6742 56.1250 32.4345 175.8073 18 D 4.4501 7.9451 117.9150 55.8303 41.0953 175.7874 19 G 3.9533 9.4139 115.6620 45.4437 0.0000 171.3768 20 Y 4.2623 8.2799 122.0846 58.7585 38.8943 176.3628 21 R 3.6395 9.1150 126.4117 57.2778 27.8065 177.1711 22 G 3.8017 8.2903 103.3143 45.6282 0.0000 174.0092 23 I 4.1166 7.5652 121.7568 58.8883 38.1494 175.8396 24 S 4.6014 8.3291 120.4281 57.7610 63.8494 174.9103 25 L 4.2007 8.8866 123.4478 58.6695 41.6917 179.3872 26 A 4.1232 8.1715 120.0236 55.3351 18.2302 179.2463 27 N 4.4359 8.2383 114.9485 56.2559 38.5748 177.7419 28 W 4.2128 8.0416 119.9762 59.8966 29.1626 178.3800 29 M 4.1575 8.5444 119.0199 58.5740 31.4528 177.9533 30 C 3.1513 8.0670 118.6815 59.0561 44.6954 175.3059 31 L 3.9708 8.1981 121.7738 58.2936 41.7036 178.8454 32 A 4.0526 8.3399 120.7566 54.8945 18.3106 179.4644 33 K 2.8418 8.0921 118.1463 59.2802 32.0099 179.0740 34 W 4.3550 7.5859 117.2915 59.0002 29.0822 178.4862 35 E 4.3190 8.3075 118.6548 58.7127 29.2204 177.7814 36 S 4.5417 7.9554 109.9431 56.6333 64.3461 174.5042 37 G 3.2608 8.0735 108.7580 46.9452 0.0000 173.4013 38 Y 3.6198 7.6743 113.5595 58.6301 35.0286 168.5014 39 N 5.2867 7.5877 119.2070 52.0013 39.8998 175.7112 40 T 4.0169 8.9768 117.4460 63.8603 69.2150 175.9573 41 R 4.4604 8.0205 116.7612 55.6074 30.2026 176.1591 42 A 4.2612 7.7373 122.5429 52.9892 19.1411 176.9926 43 T 5.1176 8.4859 112.0627 59.9523 72.4679 173.2042 44 N 4.8759 8.7625 121.8820 52.3623 42.1190 172.3981 45 Y 4.6179 8.7537 127.9936 57.2799 40.7720 173.8608 46 N 4.7492 8.3678 124.8159 50.9684 38.4303 175.0484 47 A 3.7141 8.2594 127.7196 54.7974 18.9091 180.2288 48 G 3.7072 8.0146 104.0225 48.0362 0.0000 173.6724 49 D 4.6713 6.9813 112.0680 52.0690 40.3835 175.9945 50 R 3.9707 8.1577 116.7546 57.2101 28.0984 175.8440 51 S 4.9329 7.7306 112.7353 57.1944 66.1345 172.9046 52 T 5.0744 8.6864 116.0283 61.9543 72.7770 172.7661 53 D 5.3314 8.9477 125.4052 53.3511 43.0748 175.0910 54 Y 5.1442 9.2847 121.0052 57.4940 41.7421 177.0025 55 G 4.1413 9.0392 111.1230 45.4975 0.0000 173.6418 56 I 3.9115 8.1404 116.7953 62.8440 37.8129 176.7405 57 F 4.7567 8.0490 115.5846 56.3475 39.8411 175.3623 58 Q 3.5384 8.1405 118.8784 57.0368 26.4798 173.9600 59 A 4.4780 8.5079 120.2730 51.8538 20.3908 177.9511 60 N 5.3459 9.4212 122.2295 53.4115 39.9478 175.8374 61 S 4.7103 9.2021 121.0080 60.1133 63.1975 175.3326 62 R 3.8016 8.8471 122.2274 58.5547 30.4499 177.6870 63 Y 4.2666 7.6834 114.1212 58.0447 40.8665 177.1321 64 W 4.7843 8.2446 119.0730 57.8615 29.8890 173.6784 65 C 5.6224 7.9325 110.5623 53.5130 45.5021 171.7519 66 N 5.1848 8.9442 119.5005 52.0805 39.6771 174.7323 67 D 4.8524 8.5351 122.9383 52.2437 40.4954 178.0964 68 G 4.0499 8.5063 108.5063 45.9930 0.0000 174.6803 69 K 4.4291 7.8614 116.3072 56.6975 33.2339 175.9829 70 T 4.4176 7.7745 117.2306 61.6478 69.3948 172.9340 71 P 4.2179 0.0000 0.0000 63.8578 32.2297 176.4613 72 G 3.8593 8.3474 109.1842 46.5053 0.0000 172.7396 73 A 4.5746 7.5229 119.6454 50.4035 21.2933 176.8595 74 V 4.4402 8.0689 113.0275 59.6561 35.3427 176.2014 75 N 4.9284 8.0380 116.1406 51.7728 38.4329 174.3220 76 A 3.9726 8.7880 124.1507 54.9239 19.0858 178.4296 77 C 4.5055 8.4909 111.2256 57.2053 41.1117 173.0309 78 H 4.1443 7.9518 116.3823 56.5768 26.3766 174.3557 79 L 4.8217 8.3239 117.3513 52.8524 46.4380 176.7272 80 S 4.6118 8.3910 115.7068 58.1183 63.2397 176.0231 81 C 4.1629 8.7334 124.1513 59.5424 40.6814 176.4006 82 S 3.9093 7.8007 114.6587 61.2182 61.6821 175.9053 83 A 4.0476 7.7724 122.5539 54.4966 18.2584 177.9627 84 L 4.4352 7.7036 116.1929 55.1270 41.8005 177.6328 85 L 5.2357 7.7452 116.8986 53.7349 42.2242 176.7302 86 Q 4.3650 7.7649 117.7845 55.4302 29.4778 176.0085 87 D 4.4449 8.5105 119.6154 56.8714 41.1983 176.6432 88 N 4.6244 8.0599 118.2607 53.0725 39.3934 174.6650 89 I 4.2757 8.4232 118.6631 60.9472 37.9741 177.0076 90 A 3.9395 8.5038 125.0764 56.0116 18.1043 180.1765 91 D 4.2576 8.0693 116.4128 57.4930 41.0047 178.7111 92 A 4.0731 8.0125 120.7963 55.0568 18.2979 179.7706 93 V 3.4162 8.2192 117.0742 65.9735 31.6488 178.1156 94 A 3.8102 8.0932 120.7263 55.2380 18.1828 178.8588 95 C 4.2042 8.4725 116.9353 59.7499 37.9275 175.6464 96 A 3.9473 7.9511 122.4204 55.0122 17.5908 179.7582 97 K 3.7520 7.6987 116.5085 59.3979 32.3493 179.1510 98 R 4.0704 7.7648 118.9716 59.3693 30.0602 178.5645 99 V 2.7077 7.4233 117.9036 65.8530 31.1809 177.7983 100 V 3.9742 7.3861 107.8176 62.2269 31.6452 177.4746 101 R 4.1773 7.7176 118.3561 56.9467 30.6261 175.8803 102 D 4.7497 7.3397 118.4022 52.9965 42.0192 175.2486 103 P 4.2258 0.0000 0.0000 66.3301 31.2571 177.7889 104 Q 4.0077 8.2120 117.4269 56.5304 29.9582 177.3183 105 G 3.6356 7.8876 106.9902 46.1131 0.0000 176.2136 106 I 3.4727 7.7824 120.5815 63.3826 37.9309 177.9873 107 R 4.1746 7.3383 117.4912 58.1468 30.0089 177.5114 108 A 4.0146 7.7697 120.7562 54.0655 18.5915 177.3268 109 W 4.7121 8.0088 116.7298 55.2050 29.8207 177.2573 110 V 3.7353 8.7091 124.0669 66.0428 30.8125 177.5671 111 A 4.0648 8.3090 120.1154 54.7431 18.1293 179.2506 112 W 3.9522 8.4794 127.0422 60.6534 30.6023 178.3891 113 R 3.6529 8.1768 116.3657 59.2822 29.6372 178.4244 114 N 4.3243 7.8294 114.8149 55.8773 38.7360 176.9836 115 R 4.0219 7.7224 116.3529 56.0468 31.3896 176.2252 116 C 4.5699 7.7049 115.5098 57.8514 42.5666 174.3606 117 Q 3.3218 6.4688 118.5903 57.5419 28.5890 175.6003 118 N 4.1957 8.7235 119.9727 54.1461 36.2458 173.7549 119 R 4.5097 7.4004 115.5175 54.1034 32.9618 175.8277 120 D 4.5758 8.3982 118.9956 53.9727 40.1199 175.8452 121 V 4.5190 8.1838 118.6063 61.3465 32.4253 178.3489 122 R 4.0298 8.0031 120.8205 59.5882 29.6144 178.4729 123 Q 3.9722 8.1923 115.7666 59.8545 28.1444 178.4840 124 Y 4.3414 7.9672 117.4863 59.8410 38.3035 176.7551 125 V 4.3998 7.8670 110.7527 60.6586 33.1185 175.4457 126 Q 4.1901 8.0079 120.2828 57.2787 28.7790 176.8972 127 G 3.9627 8.9371 110.6269 45.9407 0.0000 174.4927 128 C 4.4123 8.0686 115.9513 56.8868 40.5641 174.0629 129 G 3.8708 8.1462 107.2431 46.6562 0.0000 174.1657 130 V 4.0027 7.8521 118.1015 61.0775 32.0301 175.8290 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 K 8.17 4.19 0.00 2.02 1.71 0.00 1.33 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.98 1.17 7.81 2 V 8.17 4.56 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 10.02 4.37 0.00 2.98 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 4 E 9.10 4.18 0.00 1.94 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 0.00 2.30 2.22 0.00 5 R 8.96 3.23 0.00 1.94 1.89 0.00 3.42 0.00 0.00 3.44 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 6 C 8.01 4.32 0.00 3.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.09 3.90 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.40 0.00 8 L 8.11 3.63 0.00 1.42 1.38 -0.18 0.61 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 9 A 7.86 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 10 R 8.12 3.91 0.00 1.88 1.99 0.00 3.13 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 11 T 7.77 3.87 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 1.21 0.00 0.00 12 L 8.09 3.86 0.00 1.72 1.58 0.93 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.02 3.91 0.00 1.94 1.92 0.00 1.65 0.00 0.00 1.58 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.82 3.94 0.00 1.95 2.09 0.00 3.30 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.64 4.32 0.00 1.64 1.54 0.83 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.83 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 17 M 7.85 3.85 0.00 1.13 1.88 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.18 0.00 18 D 7.95 4.45 0.00 2.66 2.67 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 19 G 9.41 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 20 Y 8.28 4.26 0.00 3.28 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 9.11 3.64 0.00 1.95 1.86 0.00 3.21 0.00 0.00 2.95 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.41 0.00 22 G 8.29 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 23 I 7.57 4.12 1.90 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.60 -0.28 0.00 0.00 24 S 8.33 4.60 0.00 4.06 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 25 L 8.89 4.20 0.00 2.13 1.82 0.97 1.21 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 26 A 8.17 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.24 4.44 0.00 2.81 2.71 0.00 0.00 6.95 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 W 8.04 4.21 0.00 3.54 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 M 8.54 4.16 0.00 2.16 2.35 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.90 0.00 30 C 8.07 3.15 0.00 2.31 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 31 L 8.20 3.97 0.00 1.83 1.87 0.63 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.34 4.05 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.09 2.84 0.00 1.55 1.40 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.52 1.22 7.81 34 W 7.59 4.36 0.00 3.36 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 35 E 8.31 4.32 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.46 0.00 36 S 7.96 4.54 0.00 4.09 4.15 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 37 G 8.07 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 0.00 0.00 0.00 38 Y 7.67 3.62 0.00 3.25 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 39 N 7.59 5.29 0.00 2.80 2.83 0.00 0.00 7.01 6.92 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 40 T 8.98 4.02 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 1.50 0.00 0.00 41 R 8.02 4.46 0.00 1.99 2.11 0.00 3.15 0.00 0.00 3.26 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 42 A 7.74 4.26 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.49 5.12 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 44 N 8.76 4.88 0.00 3.04 2.66 0.00 0.00 6.82 6.92 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 45 Y 8.75 4.62 0.00 2.99 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 46 N 8.37 4.75 0.00 2.62 2.58 0.00 0.00 6.58 7.30 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 47 A 8.26 3.71 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.01 3.71 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 0.00 0.00 0.00 49 D 6.98 4.67 0.00 2.72 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 50 R 8.16 3.97 0.00 2.04 2.21 0.00 3.12 0.00 0.00 3.19 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.52 0.00 51 S 7.73 4.93 0.00 3.99 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 52 T 8.69 5.07 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 0.66 0.00 0.00 53 D 8.95 5.33 0.00 2.66 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 54 Y 9.28 5.14 0.00 2.93 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 55 G 9.04 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 56 I 8.14 3.91 1.69 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 0.83 1.78 0.27 0.00 0.00 57 F 8.05 4.76 0.00 3.20 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 58 Q 8.14 3.54 0.00 2.54 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.53 2.76 0.00 59 A 8.51 4.48 1.50 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 0.00 0.00 0.00 60 N 9.42 5.35 0.00 3.06 3.09 0.00 0.00 6.97 7.63 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 61 S 9.20 4.71 0.00 4.19 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 8.85 3.80 0.00 1.58 1.55 0.00 2.58 0.00 0.00 2.81 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.06 0.00 63 Y 7.68 4.27 0.00 1.58 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 W 8.24 4.78 0.00 3.59 3.33 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 65 C 7.93 5.62 0.00 3.18 3.23 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 66 N 8.94 5.18 0.00 2.79 2.70 0.00 0.00 7.10 9.13 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 67 D 8.54 4.85 0.00 2.89 2.76 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 68 G 8.51 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.86 4.43 0.00 1.86 1.93 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.47 7.81 70 T 7.77 4.42 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 1.16 0.00 0.00 71 P 0.00 4.22 0.00 2.01 1.97 0.00 3.80 0.00 0.00 3.88 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 72 G 8.35 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 73 A 7.52 4.57 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 74 V 8.07 4.44 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 0.65 0.00 0.00 0.86 0.00 0.00 75 N 8.04 4.93 0.00 2.73 2.66 0.00 0.00 6.76 7.79 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 76 A 8.79 3.97 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 77 C 8.49 4.51 0.00 3.31 3.23 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 78 H 7.95 4.14 0.00 3.32 3.36 0.00 5.63 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.32 4.82 0.00 1.68 1.50 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.39 4.61 0.00 3.83 3.69 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 81 C 8.73 4.16 0.00 2.22 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 82 S 7.80 3.91 0.00 3.88 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 83 A 7.77 4.05 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.70 4.44 0.00 1.95 1.81 1.07 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.75 5.24 0.00 1.78 1.72 1.08 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.76 4.36 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 7.12 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 87 D 8.51 4.44 0.00 2.66 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 88 N 8.06 4.62 0.00 2.70 2.75 0.00 0.00 6.95 7.94 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 89 I 8.42 4.28 1.79 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.92 0.97 0.00 0.00 90 A 8.50 3.94 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 91 D 8.07 4.26 0.00 2.75 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 92 A 8.01 4.07 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 93 V 8.22 3.42 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 0.74 0.00 0.00 0.88 0.00 0.00 94 A 8.09 3.81 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 95 C 8.47 4.20 0.00 3.12 3.28 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 96 A 7.95 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.70 3.75 0.00 1.63 1.43 0.00 1.28 0.00 0.00 0.77 0.00 0.00 2.19 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.30 0.91 7.81 98 R 7.76 4.07 0.00 1.98 2.15 0.00 3.27 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.92 0.00 99 V 7.42 2.71 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 -0.30 0.00 0.00 -0.58 0.00 0.00 100 V 7.39 3.97 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 1.06 0.00 0.00 1.41 0.00 0.00 101 R 7.72 4.18 0.00 2.19 2.01 0.00 3.33 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 102 D 7.34 4.75 0.00 3.01 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 0.00 103 P 0.00 4.23 0.00 2.15 2.20 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 104 Q 8.21 4.01 0.00 2.07 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.89 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.89 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 0.00 106 I 7.78 3.47 0.99 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.54 0.00 0.00 107 R 7.34 4.17 0.00 2.07 2.04 0.00 3.23 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.56 0.00 108 A 7.77 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.01 4.71 0.00 3.51 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 0.00 110 V 8.71 3.74 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 1.09 0.00 0.00 0.99 0.00 0.00 111 A 8.31 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.48 3.95 0.00 3.49 3.52 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 0.00 113 R 8.18 3.65 0.00 1.98 1.98 0.00 3.34 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.00 0.00 114 N 7.83 4.32 0.00 2.54 2.70 0.00 0.00 7.00 7.61 0.00 0.00 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 7.72 4.02 0.00 0.96 0.68 0.00 2.79 0.00 0.00 2.79 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.87 0.00 116 C 7.70 4.57 0.00 1.69 2.76 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 0.00 117 Q 6.47 3.32 0.00 0.93 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.83 0.00 0.00 0.00 0.00 0.00 2.16 2.26 0.00 118 N 8.72 4.20 0.00 2.80 2.82 0.00 0.00 6.88 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 0.00 119 R 7.40 4.51 0.00 1.92 1.82 0.00 3.20 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 120 D 8.40 4.58 0.00 2.63 2.64 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 0.00 121 V 8.18 4.52 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.06 0.00 0.00 122 R 8.00 4.03 0.00 1.92 2.03 0.00 3.28 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 123 Q 8.19 3.97 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.12 0.00 0.00 0.00 0.00 0.00 2.10 1.60 0.00 124 Y 7.97 4.34 0.00 3.20 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 0.00 125 V 7.87 4.40 2.14 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 1.01 0.00 0.00 1.05 0.00 0.00 126 Q 8.01 4.19 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.78 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 127 G 8.94 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 0.00 128 C 8.07 4.41 0.00 3.10 3.14 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 0.00 129 G 8.15 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 0.00 130 V 7.85 4.00 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 0.81 0.00 0.00 0.96 0.00 0.00