NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6085 8.3044 120.6212 55.7705 32.8210 172.4273 2 Q 4.0455 8.6831 123.9602 54.3868 29.8689 168.9256 3 V 4.9910 8.1547 126.8342 61.3022 34.7585 174.6005 4 S 4.6021 8.6344 120.1591 57.1035 66.3474 172.8592 5 V 4.7486 8.4215 124.0270 61.4030 33.3546 174.4828 6 E 4.7783 8.8349 124.8727 55.0918 34.3937 174.2283 7 T 4.4373 8.3736 119.0430 62.9959 69.3957 174.3929 8 T 4.1391 8.7309 118.2497 61.9454 70.1861 174.0650 9 Q 4.5721 7.7675 115.8232 55.2587 32.5686 173.5323 10 G 3.8874 8.3543 111.2207 47.1401 0.0000 174.5705 11 L 4.3668 8.5168 125.4968 54.4379 42.0841 176.1142 12 G 4.1962 7.7993 108.1295 45.8686 0.0000 173.3697 13 R 5.1227 8.8209 122.1082 54.1709 35.3564 174.1867 14 R 4.7209 8.8722 121.0362 54.6923 33.6659 173.7632 15 V 4.7670 9.0797 126.9737 61.6132 33.8317 174.1994 16 T 4.8451 8.7098 125.1030 61.8238 70.9731 173.5487 17 I 4.8731 8.3437 126.9213 59.6228 41.0682 174.4506 18 T 5.0741 8.5460 122.8747 61.9147 71.1344 173.0971 19 I 4.6268 9.0395 127.8438 59.2007 39.4197 175.5593 20 A 4.5381 8.7477 129.7206 51.9923 19.2220 178.0717 21 A 4.1654 9.5964 124.6974 55.3676 18.3014 180.2286 22 D 4.4105 8.1043 117.1808 56.6043 39.7856 178.8794 23 S 4.1508 7.9373 116.4987 61.2793 62.6845 176.7519 24 I 3.7421 7.7072 122.1152 64.5514 37.0063 178.1240 25 E 4.0235 8.2201 119.4202 59.7346 29.2675 179.6480 26 T 3.8615 8.3136 115.8956 66.6026 68.4799 176.6694 27 A 4.0433 8.0017 122.5032 54.8659 18.3006 179.9809 28 V 3.5079 8.2017 117.3274 66.0419 31.6851 178.3381 29 K 3.9168 8.2293 118.4452 59.5826 31.8082 179.1915 30 S 4.0803 8.1267 113.2183 61.4928 62.2692 175.8913 31 E 3.9643 8.3972 122.0212 59.0990 29.2534 178.7284 32 L 3.9774 8.1730 119.4369 57.7514 41.4511 179.5582 33 V 3.5969 7.6686 117.2790 65.9679 31.2481 177.3155 34 N 4.4387 7.9204 116.7731 56.4118 38.7029 177.2004 35 V 3.4479 7.9690 119.7736 65.8368 31.5938 177.7466 36 A 3.9753 8.3532 120.8863 55.1748 17.9023 179.4060 37 K 4.1370 7.6299 114.7973 58.2749 32.3104 178.5965 38 K 4.2494 7.9355 117.6027 55.8129 33.1076 176.6285 39 V 4.0589 6.9902 119.7611 61.6190 32.5751 174.6317 40 R 4.8013 8.2234 126.2328 54.6247 32.5997 175.5936 41 I 3.9638 8.3293 119.6230 61.5666 35.5800 175.2150 42 D 4.4264 8.4507 128.6072 56.0076 39.9067 174.9961 43 G 4.1029 7.7336 102.6654 45.0079 0.0000 171.9139 44 L 4.4458 7.4406 120.0101 52.2609 43.5362 176.1946 45 R 3.8624 8.2921 119.6144 56.2424 30.0528 175.5999 46 K 3.8895 8.5527 126.8249 58.3244 32.5224 176.5751 47 G 4.4060 9.6538 114.4621 45.6162 0.0000 173.6875 48 K 4.3942 7.4748 118.5932 55.3522 33.2071 176.5219 49 V 3.6748 7.8063 117.6107 63.0902 32.0379 173.6826 50 P 4.4309 0.0000 0.0000 62.8626 32.0401 177.1952 51 M 4.1071 8.7985 120.9073 58.6433 31.9652 178.7330 52 N 4.5748 8.1695 116.6507 55.7997 37.3209 177.3490 53 I 3.7306 7.7639 122.2719 64.1923 37.3180 178.3256 54 V 3.7223 7.8330 118.3882 66.0248 31.2995 177.7742 55 A 4.0129 8.5749 120.9178 55.0985 18.0076 179.3842 56 Q 3.8364 7.6993 116.6988 59.4707 29.2268 178.4183 57 R 3.8263 7.7978 117.8688 58.1526 30.4299 176.9260 58 Y 4.7778 7.9176 113.5599 57.0674 40.2587 177.5963 59 G 3.8369 8.4700 107.8636 48.0157 0.0000 175.5921 60 A 3.9909 7.9106 122.6710 54.9661 18.5338 179.7501 61 S 4.2207 8.0219 113.2464 61.7357 62.8786 176.9896 62 V 3.5640 8.3210 121.4199 65.9617 31.2851 178.0479 63 R 3.8103 8.1741 118.5656 59.4267 29.8631 178.5711 64 Q 3.7896 7.9711 117.9099 58.7689 28.6174 178.0606 65 D 4.2365 7.9342 119.0450 57.4080 41.2132 178.5184 66 V 3.5175 7.9733 118.9491 65.9758 31.5046 178.0126 67 L 3.8901 7.8168 118.8889 57.5457 41.4921 179.7688 68 G 3.4075 7.9920 105.7037 47.6979 0.0000 175.2872 69 D 4.3027 8.2278 120.9652 57.0629 41.1790 178.3705 70 L 4.0449 8.2679 119.9051 57.9075 41.7005 179.3475 71 M 3.9836 7.8586 119.9758 57.8677 31.8652 179.0446 72 S 4.5412 7.8821 116.1231 61.1454 63.0672 176.5277 73 R 3.9381 8.3427 121.6901 59.8779 29.8631 178.3425 74 N 4.5012 8.7227 116.4178 56.0930 38.4174 177.3527 75 F 4.2930 8.5517 121.9808 61.4393 39.5761 177.3002 76 I 3.4189 7.9346 119.4635 64.4588 36.8400 178.1941 77 D 4.3198 8.1920 119.5184 57.1349 40.5748 178.7430 78 A 3.9208 7.9477 121.5508 55.1699 18.4402 179.8176 79 I 3.6657 7.4904 111.6932 63.7968 37.0650 178.6216 80 I 3.6003 7.5423 121.8369 63.9669 36.7155 178.2103 81 K 3.9153 7.8593 119.2193 59.6568 32.2594 178.4381 82 E 4.0671 8.3849 116.4255 56.3770 29.7554 176.7647 83 K 3.8169 7.4205 116.7223 57.6381 30.0588 175.3384 84 I 4.4119 7.5339 118.0513 59.5027 39.2971 175.5821 85 N 4.7967 8.2209 120.6664 50.6450 40.6984 172.8699 86 P 4.5381 0.0000 0.0000 62.2077 32.0980 175.7729 87 A 4.6291 9.0589 125.3537 51.8074 20.3732 178.7907 88 G 3.6511 8.5689 112.3109 46.2890 0.0000 172.7595 89 A 4.5111 8.5053 126.0672 50.2768 19.7600 175.6001 90 P 4.7672 0.0000 0.0000 63.0672 32.7487 175.9702 91 T 4.6273 8.9026 118.9801 62.2660 70.5247 173.5438 92 Y 4.4528 8.7974 124.7198 57.5506 39.8085 174.8552 93 V 4.7381 9.3051 125.3058 60.0468 32.1752 172.4957 94 P 4.9308 0.0000 0.0000 62.6161 32.4027 177.4290 95 G 4.2650 8.1852 109.0618 45.0304 0.0000 171.9653 96 E 4.5222 8.8754 120.5146 55.8076 30.3774 175.2078 97 Y 4.7088 8.6811 125.2097 56.1439 39.7831 174.2943 98 K 4.2501 7.7468 127.3912 53.8369 35.1190 175.0040 99 L 3.7577 7.9726 126.0120 56.0571 42.0119 177.4759 100 G 3.9516 9.1281 110.8045 45.3634 0.0000 172.3582 101 E 4.8799 7.4465 117.4806 54.0068 33.4584 175.4621 102 D 4.7611 8.7600 121.0401 54.5193 42.1603 175.5412 103 F 5.0807 9.2925 124.9032 57.1367 41.3362 174.3790 104 T 5.0744 8.1062 122.5776 61.9070 71.2255 172.8485 105 Y 4.8518 8.3032 122.8465 55.6403 42.2216 173.6054 106 S 4.7405 9.0009 113.7503 56.7314 67.4359 172.8411 107 V 4.6106 8.8022 119.6475 61.1164 34.6967 173.9431 108 E 5.0673 8.7033 126.8545 54.7146 33.1399 174.8388 109 F 4.9229 7.6236 115.7121 56.7760 41.8383 172.1015 110 E 5.1361 8.6828 118.1294 55.0442 31.9991 176.7059 111 V 4.5834 8.5764 117.6279 60.6985 33.7290 174.3165 112 Y 4.9346 7.3799 118.4914 54.8850 40.8442 172.6129 113 P 4.5281 0.0000 0.0000 62.4611 32.2729 176.1193 114 E 4.4707 8.4880 120.9020 55.1841 30.6192 176.4715 115 V 3.7322 8.2697 121.2041 63.0599 31.8755 175.1302 116 E 4.8617 8.5092 123.7870 54.5949 32.8946 175.3931 117 L 4.3469 8.2198 117.9592 55.1023 42.7385 176.6825 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 4.61 0.00 2.08 2.29 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.57 0.00 2 Q 8.68 4.05 0.00 2.23 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 3 V 8.15 4.99 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 0.86 0.00 0.00 0.94 0.00 0.00 4 S 8.63 4.60 0.00 3.87 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 5 V 8.42 4.75 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 0.81 0.00 0.00 0.99 0.00 0.00 6 E 8.83 4.78 0.00 1.84 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 2.17 2.22 0.00 7 T 8.37 4.44 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 1.17 0.00 0.00 8 T 8.73 4.14 4.18 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 1.11 0.00 0.00 9 Q 7.77 4.57 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.69 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 10 G 8.35 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 11 L 8.52 4.37 0.00 1.92 1.86 0.97 0.83 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 12 G 7.80 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 0.00 0.00 0.00 0.00 13 R 8.82 5.12 0.00 0.73 1.42 0.00 3.15 0.00 0.00 2.99 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 14 R 8.87 4.72 0.00 1.65 1.60 0.00 3.13 0.00 0.00 3.02 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.45 0.00 15 V 9.08 4.77 2.34 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 0.84 0.00 0.00 1.32 0.00 0.00 16 T 8.71 4.85 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 1.08 0.00 0.00 17 I 8.34 4.87 0.99 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 1.14 0.82 0.96 0.00 0.00 18 T 8.55 5.07 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 1.24 0.00 0.00 19 I 9.04 4.63 2.17 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.05 1.05 0.00 0.00 20 A 8.75 4.54 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 21 A 9.60 4.17 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.10 4.41 0.00 2.99 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 23 S 7.94 4.15 0.00 4.06 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 24 I 7.71 3.74 2.14 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.97 0.93 0.00 0.00 25 E 8.22 4.02 0.00 2.03 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 2.61 2.53 0.00 26 T 8.31 3.86 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 1.23 0.00 0.00 27 A 8.00 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.20 3.51 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 1.11 0.00 0.00 1.02 0.00 0.00 29 K 8.23 3.92 0.00 1.99 1.86 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.72 7.81 30 S 8.13 4.08 0.00 3.96 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 31 E 8.40 3.96 0.00 2.14 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 2.28 2.32 0.00 32 L 8.17 3.98 0.00 1.98 1.73 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.67 3.60 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 0.79 0.00 0.00 1.02 0.00 0.00 34 N 7.92 4.44 0.00 2.74 2.93 0.00 0.00 6.80 8.99 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 35 V 7.97 3.45 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 0.62 0.00 0.00 0.87 0.00 0.00 36 A 8.35 3.98 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 37 K 7.63 4.14 0.00 1.90 1.86 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.21 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.67 7.81 38 K 7.94 4.25 0.00 1.70 1.78 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.53 7.81 39 V 6.99 4.06 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 1.08 0.00 0.00 0.91 0.00 0.00 40 R 8.22 4.80 0.00 1.74 1.74 0.00 3.46 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 41 I 8.33 3.96 1.88 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 1.42 0.94 0.93 0.00 0.00 42 D 8.45 4.43 0.00 2.83 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 43 G 7.73 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 0.00 0.00 0.00 0.00 44 L 7.44 4.45 0.00 1.60 1.63 0.93 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.29 3.86 0.00 1.88 1.83 0.00 3.24 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 46 K 8.55 3.89 0.00 1.75 1.71 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.55 7.81 47 G 9.65 4.41 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 0.00 48 K 7.47 4.39 0.00 1.74 1.79 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.34 7.81 49 V 7.81 3.67 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 0.91 0.00 0.00 0.96 0.00 0.00 50 P 0.00 4.43 0.00 2.43 2.17 0.00 3.77 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 2.08 2.00 0.00 51 M 8.80 4.11 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.57 0.00 52 N 8.17 4.57 0.00 2.91 3.08 0.00 0.00 6.31 7.50 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 53 I 7.76 3.73 2.05 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 0.82 0.90 0.00 0.00 54 V 7.83 3.72 2.27 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 1.20 0.00 0.00 1.07 0.00 0.00 55 A 8.57 4.01 1.34 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 0.00 0.00 0.00 56 Q 7.70 3.84 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.94 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 57 R 7.80 3.83 0.00 0.84 0.91 0.00 3.01 0.00 0.00 2.97 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.62 0.00 58 Y 7.92 4.78 0.00 3.06 2.89 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 59 G 8.47 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 60 A 7.91 3.99 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 61 S 8.02 4.22 0.00 4.08 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 62 V 8.32 3.56 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.99 0.00 0.00 63 R 8.17 3.81 0.00 2.01 2.00 0.00 3.19 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 1.39 1.58 0.00 64 Q 7.97 3.79 0.00 2.26 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.57 0.00 0.00 0.00 0.00 0.00 2.28 2.53 0.00 65 D 7.93 4.24 0.00 2.76 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 66 V 7.97 3.52 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 1.00 0.00 0.00 0.95 0.00 0.00 67 L 7.82 3.89 0.00 1.56 1.25 -0.10 0.28 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 68 G 7.99 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 0.00 0.00 0.00 69 D 8.23 4.30 0.00 2.71 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 70 L 8.27 4.04 0.00 1.73 1.77 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 71 M 7.86 3.98 0.00 1.86 2.09 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 1.22 0.00 72 S 7.88 4.54 0.00 4.05 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 73 R 8.34 3.94 0.00 1.98 2.04 0.00 3.14 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 1.69 1.72 0.00 74 N 8.72 4.50 0.00 3.20 3.07 0.00 0.00 6.74 8.16 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 75 F 8.55 4.29 0.00 3.47 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 76 I 7.93 3.42 1.92 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 1.62 0.75 0.89 0.00 0.00 77 D 8.19 4.32 0.00 2.72 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 78 A 7.95 3.92 1.34 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 0.00 0.00 0.00 79 I 7.49 3.67 1.80 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 1.20 0.39 0.18 0.00 0.00 80 I 7.54 3.60 1.97 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.04 0.88 0.00 0.00 81 K 7.86 3.92 0.00 1.77 1.99 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 82 E 8.38 4.07 0.00 1.96 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 2.47 2.47 0.00 83 K 7.42 3.82 0.00 1.90 1.87 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.52 7.81 84 I 7.53 4.41 1.89 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.73 1.15 0.00 0.00 85 N 8.22 4.80 0.00 2.29 2.76 0.00 0.00 7.02 8.02 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 86 P 0.00 4.54 0.00 1.91 1.46 0.00 3.53 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.64 0.00 87 A 9.06 4.63 1.45 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 88 G 8.57 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 0.00 0.00 0.00 89 A 8.51 4.51 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 90 P 0.00 4.77 0.00 1.65 1.98 0.00 3.74 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 91 T 8.90 4.63 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 1.26 0.00 0.00 92 Y 8.80 4.45 0.00 2.95 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 93 V 9.31 4.74 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 1.04 0.00 0.00 0.94 0.00 0.00 94 P 0.00 4.93 0.00 2.45 2.32 0.00 3.93 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 2.12 2.08 0.00 95 G 8.19 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 0.00 0.00 0.00 0.00 96 E 8.88 4.52 0.00 2.06 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 2.36 2.36 0.00 97 Y 8.68 4.71 0.00 2.55 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 98 K 7.75 4.25 0.00 1.71 1.47 0.00 1.54 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.66 1.34 7.81 99 L 7.97 3.76 0.00 1.59 1.55 0.93 1.10 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 0.00 100 G 9.13 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 0.00 101 E 7.45 4.88 0.00 1.86 1.83 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 2.21 2.21 0.00 102 D 8.76 4.76 0.00 2.62 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 0.00 103 F 9.29 5.08 0.00 3.38 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 0.00 104 T 8.11 5.07 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 1.07 0.00 0.00 105 Y 8.30 4.85 0.00 3.18 2.52 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 0.00 106 S 9.00 4.74 0.00 3.86 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 0.00 107 V 8.80 4.61 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 -0.31 0.00 0.00 0.24 0.00 0.00 108 E 8.70 5.07 0.00 1.85 1.67 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 2.09 2.13 0.00 109 F 7.62 4.92 0.00 3.21 3.16 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 0.00 110 E 8.68 5.14 0.00 2.03 1.96 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 2.37 2.32 0.00 111 V 8.58 4.58 1.99 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 0.82 0.00 0.00 0.97 0.00 0.00 112 Y 7.38 4.93 0.00 3.01 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 0.00 113 P 0.00 4.53 0.00 2.27 2.15 0.00 3.98 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 114 E 8.49 4.47 0.00 2.01 1.96 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 2.29 2.24 0.00 115 V 8.27 3.73 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 0.83 0.00 0.00 0.95 0.00 0.00 116 E 8.51 4.86 0.00 2.06 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 2.18 2.31 0.00 117 L 8.22 4.35 0.00 1.60 1.54 0.93 0.82 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