NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 R 4.2642 8.2544 119.0594 56.0999 31.9763 175.5765 6 M 4.1165 8.1162 117.0383 55.0595 32.7409 174.9966 7 R 4.3295 8.8194 125.2988 56.0870 33.1937 176.7017 8 M 3.7637 8.7714 119.7570 59.0020 31.9987 178.3721 9 R 3.8689 7.9634 118.2359 59.0235 30.4694 176.5026 10 P 4.2872 0.0000 0.0000 65.6690 31.2679 178.0267 11 W 4.1090 8.3604 128.1270 60.1148 30.5362 177.7838 12 L 3.5399 8.4112 120.7169 57.9972 41.5125 178.7035 13 E 3.6921 8.1824 118.6282 59.4274 29.3548 179.0180 14 E 3.9239 7.9628 119.1187 59.2164 29.3795 178.9774 15 Q 3.6122 7.0574 117.3062 58.6061 29.0247 178.3952 16 I 3.4968 7.4152 120.9162 64.4212 36.8727 178.3871 17 N 4.5185 8.1648 116.2277 55.9567 38.3848 177.1365 18 S 4.2180 7.6638 114.1882 58.8123 63.2898 174.2345 19 N 4.1478 7.5585 118.1417 54.4009 36.4220 174.8504 20 T 4.1602 7.4475 107.0672 61.8684 69.6969 174.3911 21 I 4.1903 7.1619 124.2761 58.6076 38.4864 173.0633 22 P 4.3206 0.0000 0.0000 64.3805 31.3595 176.1086 23 G 3.8839 8.9883 112.1749 45.1574 0.0000 172.7935 24 L 4.3919 7.6347 120.6441 53.6606 41.2916 175.4433 25 K 4.5561 7.9418 124.2008 55.1268 36.3794 174.9319 26 W 4.9193 8.5997 120.9200 56.8033 29.2635 176.7018 27 L 4.3621 9.3392 124.5303 56.8674 42.5838 176.7809 28 N 4.6615 8.1800 117.2898 52.3051 39.7798 174.1617 29 K 3.1353 8.6181 128.2639 58.9415 32.6916 178.5559 30 E 3.7131 8.1498 118.4929 59.3085 29.5095 177.5515 31 K 4.2332 8.2232 114.5626 55.9257 32.3118 177.0788 32 K 3.7121 7.5150 117.5300 57.3672 30.4051 174.3680 33 I 5.1383 7.9707 119.9369 60.5236 38.6914 175.3246 34 F 5.7699 9.4434 121.7447 55.3338 41.9219 173.1357 35 Q 5.1688 9.2753 116.0739 54.4781 31.9454 174.2538 36 I 4.9762 9.0081 122.6141 58.7169 40.1688 173.3241 37 P 4.8796 0.0000 0.0000 62.1866 31.8733 176.3324 38 W 5.3189 9.1653 133.4713 56.7741 29.7535 175.0618 39 M 4.4008 8.2679 119.5464 55.2017 33.0735 174.9119 40 H 4.0628 8.9205 125.4811 56.2229 30.5014 175.5967 41 A 2.5800 7.9848 128.1750 52.9534 18.2430 177.6189 42 A 4.3059 7.7028 117.3636 52.5019 20.3468 177.5956 43 R 4.1326 7.6923 117.5163 55.6646 30.7578 175.2819 44 H 4.4177 8.7909 125.0086 57.7502 30.1985 174.8272 45 G 3.9979 8.9593 113.9871 45.2672 0.0000 173.8694 46 W 4.4416 7.8192 129.6451 57.3270 31.4855 175.3201 47 D 4.2465 8.1329 123.3624 51.2368 45.0359 176.6323 48 V 3.0019 7.5401 126.4376 64.9946 31.1385 178.5368 49 E 3.9126 7.9404 117.6522 58.3837 29.4171 178.3629 50 K 4.0537 7.6129 118.1906 58.1280 32.6473 177.5023 51 D 4.6616 7.9732 117.0715 54.2119 42.1551 177.4377 52 A 4.5952 7.5350 119.7548 50.9680 19.5631 176.0443 53 P 4.0796 0.0000 0.0000 66.2176 31.1496 178.2704 54 L 3.8770 7.3361 119.3311 57.8459 42.1514 178.8319 55 F 4.6189 7.2176 117.3545 60.4766 38.8784 177.5629 56 R 2.5912 8.3462 118.8066 59.0628 29.7205 178.2381 57 N 4.3772 8.3949 116.5527 56.2369 38.6002 177.2138 58 W 3.6916 8.4889 129.0700 60.1927 30.7001 177.9968 59 A 3.7974 7.7830 120.5031 54.9659 17.7140 179.7832 60 I 3.9607 7.7928 120.0418 64.2815 37.0034 178.1041 61 H 4.0587 8.1437 118.3689 58.5813 29.5895 176.3320 62 T 3.9843 6.9693 108.8974 60.6066 68.8560 175.4440 63 G 3.7992 7.4430 108.4199 46.3177 0.0000 175.1005 64 K 4.1959 7.9762 118.8674 57.6423 32.5939 176.6949 65 H 4.9787 7.8320 118.7687 54.5005 32.7451 171.6131 66 Q 4.5136 8.8202 126.0081 53.1037 29.3992 173.1712 67 P 4.2302 0.0000 0.0000 64.4632 31.8012 175.0147 68 G 4.2524 9.2287 111.2061 45.8846 0.0000 174.6223 69 I 3.9805 7.3902 118.7377 63.6736 37.7181 175.8602 70 D 4.6868 7.9496 119.7393 53.2452 41.5572 176.5126 71 K 4.1886 8.4995 124.4742 55.2600 32.9125 174.8986 72 P 4.3313 0.0000 0.0000 63.5856 32.2765 176.3145 73 D 4.3377 6.5350 120.8103 50.4700 41.2171 173.4342 74 P 4.0129 0.0000 0.0000 65.4481 31.8228 178.2612 75 K 3.7723 7.5985 116.4574 59.8067 32.0307 179.4084 76 T 3.9342 7.5779 115.8111 66.2403 68.3735 176.8890 77 W 4.5920 8.0513 120.9898 59.8684 29.0412 178.5350 78 K 2.7977 8.3235 119.2540 59.0556 31.5655 178.7843 79 A 4.0128 7.9610 121.0695 55.2525 18.3126 179.3615 80 N 4.4039 8.8891 115.3810 56.4124 38.5688 177.4730 81 F 4.0262 8.4325 122.0889 61.2050 39.4746 177.1359 82 R 4.1889 8.5729 118.6027 59.8240 29.9753 178.1997 83 C 4.1301 8.3570 116.2687 62.8496 27.9273 175.9500 84 A 3.9740 7.8495 121.0051 55.4337 18.0695 179.2869 85 M 3.8696 7.8772 117.2615 58.5151 31.7672 178.6554 86 N 4.3781 8.2359 116.0980 56.3723 38.8351 177.2553 87 S 4.3416 7.9110 113.8945 59.2956 63.5325 174.6724 88 L 4.1178 7.0565 124.0934 54.1033 41.6832 175.5423 89 P 4.4207 0.0000 0.0000 64.7962 32.0035 176.4846 90 D 4.9958 8.0592 117.5866 52.9178 40.8242 175.6861 91 I 5.3066 7.6498 119.3908 60.3308 40.8450 174.1467 92 E 4.9187 9.1660 124.5373 54.2811 33.2200 174.9129 93 E 3.8218 8.7499 121.7363 55.8269 30.8003 177.1868 94 V 4.1057 7.8365 126.2377 60.5227 30.8050 176.0619 95 K 3.8185 8.0366 124.7562 58.7123 32.4201 179.1191 96 D 4.4532 7.9892 117.0794 55.4783 39.5313 177.1771 97 R 4.3542 7.4863 117.2983 57.1599 31.1955 177.3073 98 S 4.0045 7.1307 112.3362 58.8431 63.5931 174.8800 99 I 4.3787 7.2178 123.5768 59.9239 37.9116 175.4510 100 K 4.5058 7.8247 118.9344 56.7175 32.8571 177.6353 101 K 4.5532 7.5184 117.3968 55.9182 35.4515 177.1494 102 G 3.9071 8.4965 109.6281 44.5655 0.0000 172.6641 103 N 4.5045 8.5875 116.7075 54.5227 39.7038 174.6610 104 N 4.2516 8.9052 119.8361 54.3474 36.4252 174.4193 105 A 4.6577 7.8588 118.6046 52.5584 20.3629 177.5682 106 F 5.5781 8.4560 113.6479 56.2418 42.0728 173.1168 107 R 4.6902 9.4931 118.1058 54.2805 34.0133 174.7777 108 V 4.7919 8.3610 122.2468 61.4572 34.0448 174.1313 109 Y 5.0003 8.5220 124.1562 56.0753 42.6339 174.1627 110 R 5.1856 8.9325 121.2376 54.9785 33.5551 174.0002 111 M 4.9000 9.0290 126.5475 54.2331 32.8508 176.2316 112 L 4.2325 8.8418 126.0828 53.8738 42.3897 175.8697 113 P 4.4158 0.0000 0.0000 63.0487 31.3217 176.1175 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 5 R 8.25 4.26 0.00 1.85 1.92 0.00 3.24 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 6 M 8.12 4.12 0.00 2.32 2.18 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.88 0.00 7 R 8.82 4.33 0.00 2.03 1.93 0.00 3.32 0.00 0.00 3.32 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.84 0.00 8 M 8.77 3.76 0.00 1.81 1.50 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 2.15 0.00 9 R 7.96 3.87 0.00 1.93 1.94 0.00 3.52 0.00 0.00 3.44 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 10 P 0.00 4.29 0.00 2.39 2.36 0.00 3.90 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.11 0.00 11 W 8.36 4.11 0.00 3.59 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.41 3.54 0.00 2.07 1.42 0.91 1.01 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 13 E 8.18 3.69 0.00 2.22 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 0.00 2.45 2.54 0.00 14 E 7.96 3.92 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.28 0.00 15 Q 7.06 3.61 0.00 1.65 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.73 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 16 I 7.42 3.50 1.18 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 0.86 0.62 -0.31 0.00 0.00 17 N 8.16 4.52 0.00 2.71 2.93 0.00 0.00 7.16 7.25 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 18 S 7.66 4.22 0.00 3.92 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 19 N 7.56 4.15 0.00 2.88 2.89 0.00 0.00 6.94 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.45 4.16 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 1.20 0.00 0.00 21 I 7.16 4.19 1.71 0.00 0.00 0.74 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 0.71 0.74 0.00 0.00 22 P 0.00 4.32 0.00 1.96 1.95 0.00 3.54 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.02 0.00 23 G 8.99 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.63 4.39 0.00 1.53 1.64 1.03 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 25 K 7.94 4.56 0.00 1.83 1.80 0.00 1.55 0.00 0.00 1.79 0.00 0.00 2.71 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.54 1.49 7.81 26 W 8.60 4.92 0.00 3.22 3.22 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 27 L 9.34 4.36 0.00 1.71 1.79 0.98 0.98 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 28 N 8.18 4.66 0.00 2.72 2.72 0.00 0.00 6.87 6.39 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 29 K 8.62 3.14 0.00 1.49 1.53 0.00 1.48 0.00 0.00 1.52 0.00 0.00 2.58 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.95 0.21 7.81 30 E 8.15 3.71 0.00 1.87 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 0.00 2.25 2.35 0.00 31 K 8.22 4.23 0.00 1.84 1.85 0.00 1.93 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.55 7.81 32 K 7.52 3.71 0.00 2.03 2.11 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.09 1.28 7.81 33 I 7.97 5.14 2.01 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.83 0.98 0.00 0.00 34 F 9.44 5.77 0.00 3.00 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 35 Q 9.28 5.17 0.00 2.40 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.21 2.45 0.00 36 I 9.01 4.98 2.35 0.00 0.00 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 1.67 1.15 1.43 0.00 0.00 37 P 0.00 4.88 0.00 2.14 2.12 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.07 0.00 38 W 9.17 5.32 0.00 3.49 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 39 M 8.27 4.40 0.00 2.41 2.13 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.74 0.00 40 H 8.92 4.06 0.00 3.24 3.15 0.00 5.72 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.98 2.58 0.10 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 0.00 0.00 42 A 7.70 4.31 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 43 R 7.69 4.13 0.00 1.86 2.08 0.00 3.20 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 44 H 8.79 4.42 0.00 3.15 3.27 0.00 5.95 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.96 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.82 4.44 0.00 3.49 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 47 D 8.13 4.25 0.00 2.56 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 0.00 0.00 0.00 0.00 48 V 7.54 3.00 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 0.75 0.00 0.00 1.12 0.00 0.00 49 E 7.94 3.91 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 2.24 2.25 0.00 50 K 7.61 4.05 0.00 1.69 1.60 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.38 7.81 51 D 7.97 4.66 0.00 2.25 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 52 A 7.53 4.60 1.70 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 53 P 0.00 4.08 0.00 2.15 2.24 0.00 3.49 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 1.87 1.98 0.00 54 L 7.34 3.88 0.00 1.46 0.94 0.88 0.78 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 55 F 7.22 4.62 0.00 3.41 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 R 8.35 2.59 0.00 1.25 1.83 0.00 2.96 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.65 0.00 57 N 8.39 4.38 0.00 3.35 3.40 0.00 0.00 6.70 8.49 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 58 W 8.49 3.69 0.00 3.47 3.41 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 59 A 7.78 3.80 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.79 3.96 1.94 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.58 0.86 0.00 0.00 61 H 8.14 4.06 0.00 3.09 2.94 0.00 5.93 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 T 6.97 3.98 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 63 G 7.44 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 64 K 7.98 4.20 0.00 1.81 1.93 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.48 7.81 65 H 7.83 4.98 0.00 3.26 2.93 0.00 5.81 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.82 4.51 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.66 0.00 0.00 0.00 0.00 0.00 2.21 2.37 0.00 67 P 0.00 4.23 0.00 2.00 2.02 0.00 3.57 0.00 0.00 3.67 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 68 G 9.23 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 0.00 0.00 0.00 0.00 69 I 7.39 3.98 1.97 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 0.59 0.92 0.00 0.00 70 D 7.95 4.69 0.00 2.85 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 71 K 8.50 4.19 0.00 1.74 1.73 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.47 7.81 72 P 0.00 4.33 0.00 2.06 2.10 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.31 0.00 73 D 6.54 4.34 0.00 2.37 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 0.00 0.00 0.00 74 P 0.00 4.01 0.00 2.15 2.42 0.00 3.30 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.92 0.00 75 K 7.60 3.77 0.00 1.62 1.72 0.00 1.49 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.30 7.81 76 T 7.58 3.93 4.33 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 1.28 0.00 0.00 77 W 8.05 4.59 0.00 3.68 3.37 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 78 K 8.32 2.80 0.00 1.42 1.62 0.00 1.22 0.00 0.00 1.27 0.00 0.00 2.38 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.81 0.21 7.81 79 A 7.96 4.01 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 80 N 8.89 4.40 0.00 3.17 3.15 0.00 0.00 6.68 8.01 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 81 F 8.43 4.03 0.00 3.45 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 82 R 8.57 4.19 0.00 2.46 2.27 0.00 3.29 0.00 0.00 3.53 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.87 0.00 83 C 8.36 4.13 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.85 3.97 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 85 M 7.88 3.87 0.00 1.79 2.17 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.83 0.00 86 N 8.24 4.38 0.00 2.87 2.90 0.00 0.00 7.12 7.62 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 87 S 7.91 4.34 0.00 4.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.06 4.12 0.00 1.58 1.80 0.78 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.42 0.00 2.19 2.19 0.00 3.75 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 90 D 8.06 5.00 0.00 2.85 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 91 I 7.65 5.31 1.90 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 1.54 0.65 1.07 0.00 0.00 92 E 9.17 4.92 0.00 2.03 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 2.23 2.24 0.00 93 E 8.75 3.82 0.00 1.40 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 1.95 1.61 0.00 94 V 7.84 4.11 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 0.94 0.00 0.00 0.87 0.00 0.00 95 K 8.04 3.82 0.00 1.75 1.73 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.28 7.81 96 D 7.99 4.45 0.00 2.73 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 97 R 7.49 4.35 0.00 1.96 2.08 0.00 3.18 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 98 S 7.13 4.00 0.00 3.70 3.47 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 0.00 99 I 7.22 4.38 1.16 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 1.18 0.58 0.81 0.00 0.00 100 K 7.82 4.51 0.00 1.97 1.74 0.00 1.46 0.00 0.00 1.50 0.00 0.00 2.71 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.45 7.81 101 K 7.52 4.55 0.00 1.70 1.72 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.32 1.38 7.81 102 G 8.50 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.59 4.50 0.00 2.75 2.78 0.00 0.00 6.93 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 0.00 104 N 8.91 4.25 0.00 2.99 2.96 0.00 0.00 6.95 7.35 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 0.00 105 A 7.86 4.66 1.55 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 0.00 106 F 8.46 5.58 0.00 3.32 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 0.00 107 R 9.49 4.69 0.00 1.59 1.35 0.00 2.21 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.10 0.00 108 V 8.36 4.79 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 0.98 0.00 0.00 1.13 0.00 0.00 109 Y 8.52 5.00 0.00 1.60 2.47 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 0.00 110 R 8.93 5.19 0.00 1.89 1.79 0.00 3.13 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 111 M 9.03 4.90 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.14 2.82 0.00 112 L 8.84 4.23 0.00 1.57 1.66 1.02 1.04 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 0.00 113 P 0.00 4.42 0.00 2.18 2.05 0.00 3.83 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00