NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2022 8.3144 121.7924 55.4975 33.3534 174.9264 2 L 4.1479 8.5737 126.4052 55.9256 42.4974 174.6442 3 T 4.7430 9.9939 124.7100 61.8073 72.0987 172.4999 4 I 5.0788 8.5711 126.8803 59.5475 39.3084 174.7975 5 E 4.8857 9.4959 124.9916 54.6001 33.0255 174.8270 6 S 5.1404 8.8374 117.6925 57.2038 65.0309 173.3646 7 T 4.6233 8.6511 119.9384 59.5519 69.7853 171.9407 8 P 4.9308 0.0000 0.0000 61.9866 32.8965 175.9321 9 F 4.3159 8.8251 120.8542 60.6936 40.5919 173.7733 10 N 5.2486 8.3473 116.5333 51.8138 38.4689 174.7267 11 V 4.1900 8.9519 124.1977 61.6984 33.7101 174.2982 12 A 5.0625 7.8309 126.2019 48.8133 21.9751 176.1010 13 E 4.0361 8.2878 120.0124 58.9692 29.5634 177.2546 14 G 4.0910 8.6620 112.9753 44.9271 0.0000 172.3260 15 K 4.8687 7.9076 119.7342 54.1987 36.2459 174.5282 16 E 5.1999 8.6530 117.4506 54.8777 32.6304 175.7224 17 V 4.2028 8.4015 120.2499 59.7120 34.8654 174.0599 18 L 4.6138 8.5311 126.6120 53.5641 43.7930 175.3752 19 L 4.9309 8.7101 128.7798 53.6591 41.5672 175.5320 20 L 4.5364 8.7905 124.3616 54.2744 43.1713 175.8912 21 V 4.7839 8.2307 123.5633 61.6886 32.9294 174.5714 22 H 4.8344 9.5776 125.1859 54.2184 31.8226 173.5827 23 N 4.1346 8.4738 115.9924 54.2327 35.1696 174.7877 24 L 4.1858 7.6084 119.3506 53.9025 43.4177 175.0745 25 P 4.5750 0.0000 0.0000 62.5457 32.8116 174.3108 26 Q 4.5944 8.3108 117.0916 55.3069 31.7484 174.3463 27 H 3.9700 8.6017 111.8675 57.1167 25.9435 175.5123 28 L 4.4693 7.9742 118.4099 54.9719 42.3264 176.9457 29 F 4.6005 9.0184 126.5006 58.7608 41.2825 176.2241 30 G 3.8713 7.3665 103.9727 45.9170 0.0000 171.8687 31 Y 5.5074 8.1766 121.4086 56.7210 40.6419 175.1547 32 S 4.9631 8.9365 118.2975 56.9292 67.2909 172.8844 33 W 5.1853 9.3043 125.8709 55.5266 30.9491 175.2443 34 Y 5.0251 9.6728 121.8024 56.1138 41.6753 175.0941 35 K 4.2544 9.4741 124.1263 57.1964 31.9492 176.7130 36 G 3.8786 6.4630 115.5200 46.0819 0.0000 171.1387 37 E 4.8482 8.6903 123.4269 55.0854 30.4136 175.0903 38 R 4.7326 7.3996 114.6229 54.7324 32.4945 175.2148 39 C 3.5994 7.9661 113.8600 57.0071 28.5321 173.6116 40 D 4.6489 7.2846 131.2285 54.3329 42.5869 175.1486 41 G 4.4296 8.4463 100.3701 46.9083 0.0000 173.5419 42 N 4.6798 8.8471 116.3002 54.4926 39.2912 175.2734 43 C 4.9214 7.9877 116.6773 59.0957 28.8128 173.1156 44 Q 4.5172 8.0788 120.2969 56.4075 30.0666 176.0215 45 I 4.1728 8.9642 127.0867 62.9354 38.5319 175.4153 46 I 4.5974 7.3902 119.3942 59.9933 41.4693 172.4967 47 G 4.4932 9.0137 115.1292 44.5176 0.0000 171.2376 48 Y 5.1326 9.5753 125.5093 55.7021 42.1124 174.6071 49 V 3.7966 8.2654 128.9882 61.5090 31.8973 176.6119 50 I 3.2137 7.8818 130.0872 64.2661 37.3512 178.7183 51 G 3.7614 7.8434 107.7746 48.3678 0.0000 173.9655 52 T 4.3322 7.2743 105.4718 60.1856 69.3499 173.6100 53 Q 3.0266 7.5775 118.9808 57.1320 26.9672 173.3772 54 C 4.2966 7.5611 119.3563 59.0725 31.8549 171.6152 55 A 5.2705 8.4104 128.1819 50.4598 20.7382 175.6755 56 T 4.6058 8.8899 119.6437 60.7446 71.7443 172.1139 57 P 4.1556 0.0000 0.0000 62.7459 32.6024 176.0549 58 G 4.2188 8.5133 109.2957 43.2695 0.0000 172.5210 59 P 4.3800 0.0000 0.0000 65.0767 31.3393 177.4617 60 A 4.4610 8.2189 119.3402 51.8748 18.8785 176.1366 61 Y 4.4184 7.8773 119.9183 57.9105 38.8168 175.5097 62 S 4.1825 9.2351 123.4661 59.5739 63.9163 175.1932 63 G 3.6007 7.5646 107.7144 44.9068 0.0000 173.9980 64 R 4.4088 7.5745 116.8521 55.5999 32.1429 175.0773 65 E 4.5796 7.7411 119.7571 55.5726 30.5582 175.8549 66 I 4.1835 8.6573 126.9508 59.4567 39.3262 174.6415 67 I 4.4537 7.9465 127.6112 59.7278 39.4968 174.1660 68 Y 4.8145 8.1552 125.0935 55.3448 41.1086 175.2173 69 P 4.7146 0.0000 0.0000 65.0331 31.5853 177.0261 70 N 4.6256 8.2406 114.3186 52.2052 37.3471 175.9613 71 A 3.3620 7.9739 120.2650 52.5499 17.7996 179.0660 72 S 4.7450 8.0840 112.6724 58.2951 64.5423 173.0883 73 L 4.8716 8.5724 125.1356 53.0995 44.6608 174.6567 74 L 4.9115 8.9387 129.3184 53.6353 43.9332 174.8698 75 I 4.7845 8.2481 128.2704 59.8661 39.0151 175.7324 76 Q 4.4815 8.5856 126.4727 53.7600 30.7706 174.8418 77 N 4.0313 8.3345 115.9282 54.7260 37.3088 174.6797 78 I 3.9566 8.1961 120.1490 61.4671 38.4180 176.4909 79 I 4.7331 9.3085 118.9245 58.6931 40.1896 176.4291 80 Q 4.0131 8.4013 118.0061 58.9333 28.5466 177.8581 81 N 4.5999 8.0224 113.9744 54.9359 39.2003 175.0842 82 D 4.6077 7.7326 116.4168 57.0743 41.3313 176.7169 83 T 3.7159 7.6153 116.3875 63.4608 69.1380 174.3582 84 G 3.9212 6.6438 115.3012 46.1504 0.0000 170.2297 85 F 5.4373 8.3037 118.8828 56.1239 42.3732 174.5636 86 Y 5.1101 9.7893 118.9567 56.6937 42.1273 174.5900 87 T 5.2398 9.2729 119.0478 61.7439 72.4603 172.5726 88 L 4.4086 8.9449 127.6155 53.1995 44.9484 174.2540 89 H 5.1181 9.3602 126.1095 54.6552 32.3772 173.1489 90 V 4.6859 8.4220 127.0922 61.3133 31.6286 173.4445 91 I 4.3272 8.7194 127.5843 61.1387 37.6494 175.1450 92 K 5.2099 9.7668 127.0242 53.7939 36.0654 176.4427 93 S 4.0691 8.3533 115.6714 58.4602 62.9378 174.4040 94 D 4.5812 7.5611 115.5907 54.9916 42.4502 175.1557 95 L 4.0590 7.8364 121.9736 55.0345 41.0324 175.2347 96 V 3.8111 7.4362 117.5203 63.3379 29.8099 175.0190 97 N 5.6055 8.6153 128.4762 57.4172 38.9646 175.6995 98 E 3.6587 6.8922 116.8874 52.4830 28.9300 176.2327 99 E 5.2125 8.8170 125.2216 54.6698 31.8494 174.7513 100 A 4.8840 8.8773 126.1440 50.7066 23.2238 174.9926 101 T 5.2100 8.7309 116.0098 61.8683 72.0512 173.4706 102 G 4.6517 9.8161 112.2291 44.9047 0.0000 170.8808 103 Q 5.1170 8.4988 116.2540 55.2585 31.3580 173.3111 104 F 4.2039 8.1165 114.1084 55.8221 41.8471 173.0035 105 R 4.8081 8.3610 117.8189 54.2645 33.8340 174.8689 106 V 5.1449 8.1232 121.7879 61.2996 34.1605 174.3833 107 Y 5.1015 8.7838 124.9902 54.4485 41.4126 172.9403 108 P 4.7900 0.0000 0.0000 62.6002 32.7639 175.1564 109 E 4.6597 8.3915 120.3737 55.5080 32.2413 176.2278 110 L 4.0169 8.6176 121.4116 55.4099 41.6334 174.4306 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 8.31 4.20 0.00 1.75 1.80 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.46 7.81 2 L 8.57 4.15 0.00 1.78 1.62 1.02 0.57 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 3 T 9.99 4.74 4.29 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 0.00 0.00 0.00 1.24 0.00 0.00 4 I 8.57 5.08 2.05 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 1.48 0.94 1.28 0.00 0.00 5 E 9.50 4.89 0.00 2.02 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 2.41 2.31 0.00 6 S 8.84 5.14 0.00 3.93 3.77 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 7 T 8.65 4.62 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 1.22 0.00 0.00 8 P 0.00 4.93 0.00 2.27 2.06 0.00 3.69 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 1.95 1.93 0.00 9 F 8.83 4.32 0.00 3.17 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 10 N 8.35 5.25 0.00 2.76 2.93 0.00 0.00 6.85 7.84 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 11 V 8.95 4.19 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 0.90 0.00 0.00 0.89 0.00 0.00 12 A 7.83 5.06 0.75 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 0.00 0.00 13 E 8.29 4.04 0.00 1.88 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 2.26 2.22 0.00 14 G 8.66 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 15 K 7.91 4.87 0.00 1.61 1.63 0.00 1.57 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.24 1.40 7.81 16 E 8.65 5.20 0.00 1.89 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 2.07 2.17 0.00 17 V 8.40 4.20 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 -0.13 0.00 0.00 0.35 0.00 0.00 18 L 8.53 4.61 0.00 1.68 1.62 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.71 4.93 0.00 1.31 1.58 0.13 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.79 4.54 0.00 1.67 1.56 0.91 0.43 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 21 V 8.23 4.78 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 0.70 0.00 0.00 1.11 0.00 0.00 22 H 9.58 4.83 0.00 3.17 3.17 0.00 5.80 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 23 N 8.47 4.13 0.00 3.01 2.92 0.00 0.00 6.96 7.89 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 24 L 7.61 4.19 0.00 1.58 1.60 0.88 1.13 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 P 0.00 4.58 0.00 2.27 2.13 0.00 3.84 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 2.07 2.03 0.00 26 Q 8.31 4.59 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.97 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 27 H 8.60 3.97 0.00 3.36 3.38 0.00 5.62 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 28 L 7.97 4.47 0.00 1.64 1.52 1.20 0.99 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 29 F 9.02 4.60 0.00 2.89 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 30 G 7.37 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 31 Y 8.18 5.51 0.00 3.12 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 32 S 8.94 4.96 0.00 3.93 3.50 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 33 W 9.30 5.19 0.00 3.32 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 34 Y 9.67 5.03 0.00 2.93 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 35 K 9.47 4.25 0.00 1.68 1.74 0.00 1.12 0.00 0.00 0.97 0.00 0.00 2.61 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.27 1.30 7.81 36 G 6.46 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 37 E 8.69 4.85 0.00 1.85 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 2.12 2.02 0.00 38 R 7.40 4.73 0.00 1.77 1.80 0.00 2.93 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.50 0.00 39 C 7.97 3.60 0.00 2.41 2.46 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 40 D 7.28 4.65 0.00 2.58 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 41 G 8.45 4.43 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.85 4.68 0.00 2.86 2.91 0.00 0.00 6.87 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 43 C 7.99 4.92 0.00 3.02 2.96 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 44 Q 8.08 4.52 0.00 2.30 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.76 0.00 0.00 0.00 0.00 0.00 2.21 1.56 0.00 45 I 8.96 4.17 2.20 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 1.21 0.58 1.14 0.00 0.00 46 I 7.39 4.60 2.04 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 1.33 1.31 1.08 0.00 0.00 47 G 9.01 4.49 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 0.00 48 Y 9.58 5.13 0.00 3.06 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 49 V 8.27 3.80 1.80 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 0.53 0.00 0.00 0.69 0.00 0.00 50 I 7.88 3.21 1.69 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 -0.16 1.04 0.00 0.00 51 G 7.84 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 52 T 7.27 4.33 4.13 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 1.13 0.00 0.00 53 Q 7.58 3.03 0.00 2.19 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 7.08 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 54 C 7.56 4.30 0.00 2.87 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 55 A 8.41 5.27 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 56 T 8.89 4.61 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 1.16 0.00 0.00 57 P 0.00 4.16 0.00 1.79 0.93 0.00 3.61 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.75 0.00 58 G 8.51 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 59 P 0.00 4.38 0.00 2.19 2.17 0.00 3.96 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.13 0.00 60 A 8.22 4.46 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 61 Y 7.88 4.42 0.00 3.27 3.05 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 62 S 9.24 4.18 0.00 3.85 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 63 G 7.56 3.60 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 0.00 0.00 0.00 64 R 7.57 4.41 0.00 1.62 1.98 0.00 3.38 0.00 0.00 3.27 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.47 0.00 65 E 7.74 4.58 0.00 1.94 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 2.31 0.00 66 I 8.66 4.18 1.69 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 1.00 0.55 0.38 0.00 0.00 67 I 7.95 4.45 1.81 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.40 0.61 0.00 0.00 68 Y 8.16 4.81 0.00 3.09 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 69 P 0.00 4.71 0.00 2.19 2.34 0.00 3.83 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 2.15 2.25 0.00 70 N 8.24 4.63 0.00 2.80 2.91 0.00 0.00 6.02 7.18 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 71 A 7.97 3.36 0.73 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 72 S 8.08 4.75 0.00 4.06 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 73 L 8.57 4.87 0.00 0.70 0.46 0.72 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.94 4.91 0.00 1.92 1.53 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 75 I 8.25 4.78 1.59 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 0.98 0.26 0.81 0.00 0.00 76 Q 8.59 4.48 0.00 1.86 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.68 0.00 0.00 0.00 0.00 0.00 2.37 2.21 0.00 77 N 8.33 4.03 0.00 2.73 2.75 0.00 0.00 6.96 7.91 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 78 I 8.20 3.96 1.85 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 1.47 0.54 0.99 0.00 0.00 79 I 9.31 4.73 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.90 0.96 0.00 0.00 80 Q 8.40 4.01 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.82 7.14 0.00 0.00 0.00 0.00 0.00 2.76 2.29 0.00 81 N 8.02 4.60 0.00 2.67 2.84 0.00 0.00 7.02 8.47 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 82 D 7.73 4.61 0.00 3.09 3.05 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 83 T 7.62 3.72 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 1.19 0.00 0.00 84 G 6.64 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.30 5.44 0.00 2.98 3.06 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 0.00 0.00 0.00 86 Y 9.79 5.11 0.00 3.16 3.36 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 87 T 9.27 5.24 4.39 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 1.27 0.00 0.00 88 L 8.94 4.41 0.00 0.27 0.82 0.12 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 89 H 9.36 5.12 0.00 3.45 3.38 0.00 5.64 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 8.42 4.69 2.21 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 1.17 0.00 0.00 1.01 0.00 0.00 91 I 8.72 4.33 2.13 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.76 1.06 0.00 0.00 92 K 9.77 5.21 0.00 1.81 1.72 0.00 1.72 0.00 0.00 1.93 0.00 0.00 2.95 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.69 1.53 7.81 93 S 8.35 4.07 0.00 3.92 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 94 D 7.56 4.58 0.00 2.46 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 95 L 7.84 4.06 0.00 1.87 1.82 0.89 0.79 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 96 V 7.44 3.81 2.08 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 0.89 0.00 0.00 0.99 0.00 0.00 97 N 8.62 5.61 0.00 2.53 2.55 0.00 0.00 7.32 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 98 E 6.89 3.66 0.00 1.99 1.94 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 0.00 2.40 2.38 0.00 99 E 8.82 5.21 0.00 2.02 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 2.26 0.00 100 A 8.88 4.88 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 0.00 101 T 8.73 5.21 4.43 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 0.00 0.00 0.00 1.58 0.00 0.00 102 G 9.82 4.65 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 0.00 103 Q 8.50 5.12 0.00 1.16 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.59 0.00 0.00 0.00 0.00 0.00 1.69 2.31 0.00 104 F 8.12 4.20 0.00 2.92 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 0.00 105 R 8.36 4.81 0.00 1.50 1.75 0.00 3.11 0.00 0.00 3.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.17 0.00 106 V 8.12 5.14 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 1.10 0.00 0.00 107 Y 8.78 5.10 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 0.00 108 P 0.00 4.79 0.00 2.12 2.28 0.00 3.88 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 2.06 2.04 0.00 109 E 8.39 4.66 0.00 1.88 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 2.32 2.06 0.00 110 L 8.62 4.02 0.00 1.80 1.68 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00