NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2305 8.4445 119.1062 54.1560 29.2655 174.9533 4 L 3.7832 7.5917 121.4826 53.3938 41.9752 176.9384 5 T 4.1058 8.2088 117.8712 61.0171 68.9411 174.3407 6 E 3.9398 8.8008 122.6825 59.6703 28.9740 178.6054 7 E 3.9288 8.3322 120.0869 58.9357 29.2806 177.6598 8 Q 4.4720 7.8389 116.2389 56.7920 29.3708 175.4115 9 I 4.3219 8.7864 119.0678 63.7088 39.3411 177.5660 10 A 4.1861 8.2482 121.5948 56.1795 18.0312 178.6826 11 E 4.2373 8.2081 116.0630 59.1072 29.2745 178.9173 12 F 4.2533 8.2932 117.7598 59.1646 40.1269 175.7626 13 K 4.7247 9.1327 117.6738 58.3427 34.1886 178.2582 14 E 4.1683 9.2493 116.5255 58.0649 29.5174 177.5280 15 A 4.6635 7.9087 120.9258 52.9473 21.3149 178.2759 16 F 3.9911 8.1870 116.8281 61.0146 39.5283 176.5445 17 S 4.1007 8.9871 117.3776 61.3561 63.1467 176.4711 18 L 4.0172 7.5740 120.2469 57.7778 42.1575 177.5342 19 F 4.5076 7.7159 115.8484 57.2911 39.2200 176.1304 20 D 4.4695 8.6361 123.0940 51.4737 39.0471 175.3638 21 K 3.5433 7.5257 122.0898 59.8728 33.4478 177.4173 22 D 4.5796 8.2626 117.9954 59.0312 37.8274 179.0574 23 G 3.9273 6.8262 105.1188 47.7344 0.0000 174.7730 24 D 4.3239 9.8364 118.9849 52.8690 39.5137 176.8293 25 G 5.0680 8.1812 122.0667 45.0756 0.0000 171.7444 26 T 5.0096 7.7259 108.8511 59.4601 71.9706 173.0158 27 I 4.6655 8.3176 116.2357 59.2906 40.4658 176.9770 28 T 4.1465 9.9194 115.1788 62.4348 69.1927 173.5266 29 T 4.1225 8.8306 115.4571 66.1897 68.6202 176.3708 30 K 3.8073 8.0281 119.8194 60.0967 32.1856 179.0458 31 E 3.9363 8.1247 118.3664 59.1127 29.3021 179.1281 32 L 3.9353 8.2431 120.7418 58.1529 42.3889 178.9419 33 G 3.9527 8.1758 105.2637 48.5529 0.0000 175.4872 34 T 3.8494 8.0201 118.2123 66.1231 68.3948 177.0635 35 V 2.8396 7.6338 120.3396 66.0104 31.3822 178.0614 36 M 3.9532 8.1014 118.2243 58.5437 31.8424 178.4040 37 R 4.6498 7.8886 119.1214 58.9563 30.0920 178.7637 38 S 4.0257 7.5003 112.5341 61.8488 62.7417 176.3037 39 L 4.1359 7.0147 117.6827 54.8403 41.0198 177.7874 40 G 3.8562 8.5853 107.5909 45.5267 0.0000 173.1887 41 Q 4.6844 7.5915 119.6179 55.0509 31.8079 173.9372 42 N 4.6193 7.9887 114.6895 52.5145 37.8295 172.4519 43 P 4.5852 0.0000 0.0000 61.9131 33.0882 175.9643 44 T 4.3120 8.0432 108.1973 60.6280 69.7630 175.4452 45 E 3.9216 8.7592 122.1584 58.9318 29.5202 178.0901 46 A 4.6233 7.8269 119.1313 52.1895 21.4446 177.2428 47 E 4.1253 8.3767 115.8943 57.9469 29.4611 178.1541 48 L 3.9530 7.6130 119.0188 58.9281 41.7562 177.4084 49 Q 4.1931 8.5305 118.9086 56.9290 28.3927 178.8668 50 D 4.6600 7.1664 122.7101 57.1717 42.3054 179.2589 51 M 4.1876 7.7026 116.9739 58.3428 32.1082 178.6452 52 I 3.7913 7.5861 118.0027 64.0591 38.2987 177.0591 53 N 4.5329 9.2299 116.5794 55.9619 38.7916 175.4230 54 E 4.4231 7.5688 117.0163 56.7643 30.9494 176.1687 55 V 4.4321 7.9442 112.2380 60.4232 32.1678 177.0531 56 D 4.5605 7.9996 119.4169 54.1885 40.5455 177.0032 57 A 4.7130 8.4039 124.0501 52.3604 21.4268 175.6684 58 D 5.2326 7.8329 119.1654 54.4922 42.3949 178.5154 59 G 3.9122 8.6936 109.3769 47.7646 0.0000 173.1076 60 N 4.0200 9.3351 115.0033 52.6665 37.4462 172.7719 61 G 3.9724 6.9155 111.7184 45.7431 0.0000 170.6298 62 T 4.7399 7.3748 113.9206 59.9512 70.8520 172.6409 63 I 4.7067 8.1888 127.4824 59.1757 41.2937 175.1456 64 D 4.8332 8.5822 128.4705 52.8840 41.6813 176.9292 65 F 3.3067 9.1976 116.1026 60.5636 38.7556 175.3896 66 P 4.2253 0.0000 0.0000 65.8484 30.6381 178.3325 67 E 3.8538 10.6236 117.4595 59.4341 29.2457 178.9237 68 F 4.4209 7.3878 118.3607 60.1513 39.9415 177.0195 69 L 3.8024 8.5649 120.6487 58.3795 42.0326 179.0241 70 T 4.0212 8.0779 116.0824 66.2708 68.8670 176.2908 71 M 3.9912 7.6350 118.6791 57.8982 32.0931 176.9488 72 M 4.1965 7.5056 116.8934 56.0986 31.7254 176.4217 73 A 4.6860 7.5519 118.7605 51.7243 20.3152 178.1981 74 R 4.1160 7.8537 115.4958 58.5170 30.2563 177.4587 75 K 4.6783 7.6838 117.4755 56.2214 33.1896 176.0164 76 M 4.5360 8.0075 115.8145 56.4785 34.4751 176.7339 77 K 3.9851 8.1043 116.9594 57.9957 32.0594 175.4965 78 D 4.4076 6.9876 116.1930 54.7764 42.4963 175.3731 79 T 3.8143 7.9949 115.4955 63.2088 67.8144 173.0904 80 D 5.0103 8.5173 127.6620 53.5899 42.5462 177.7691 81 S 4.2737 7.9283 118.7005 61.4012 62.6391 175.8471 82 E 3.8860 8.0763 122.0506 59.2999 29.7951 178.6170 83 E 4.1632 8.1998 117.9901 59.3573 29.7240 178.5716 84 E 4.0146 8.3352 118.2294 59.9794 29.4581 179.6235 85 I 4.1237 7.7694 118.6846 63.9501 36.9955 177.6573 86 R 4.6253 8.4274 118.4046 57.4336 29.9282 177.3009 87 E 4.3503 8.0630 116.0726 58.3937 30.5824 177.6061 88 A 4.3503 8.7601 121.6833 55.0493 18.4933 179.2025 89 F 3.3327 8.4571 119.2661 61.5963 39.3195 177.5856 90 R 3.9553 7.8203 116.0743 58.8585 29.8324 179.1627 91 V 3.6702 7.3854 117.4831 66.1174 31.7768 177.8426 92 F 4.2192 8.2311 114.5521 58.7089 40.3998 176.3029 93 D 4.4703 7.4563 120.6147 52.4479 37.5720 176.6434 94 K 4.1544 7.9609 118.7854 57.7647 32.6219 177.5172 95 D 4.7486 7.9148 116.7429 52.1078 40.5363 176.4415 96 G 3.8381 8.3229 107.7897 46.5420 0.0000 173.5543 97 N 4.7681 8.0201 112.4481 51.5799 37.4039 176.8272 98 G 3.9753 8.0899 105.0228 46.7568 0.0000 173.3903 99 Y 5.1040 7.8980 116.0610 56.2077 41.4703 175.0297 100 I 4.7494 9.0966 122.7841 59.6149 39.8634 174.9859 101 S 5.0426 8.7127 120.0473 55.9214 65.8218 174.8956 102 A 3.5969 9.0037 123.0965 56.0515 17.7566 179.4290 103 A 3.9813 8.1097 119.0721 55.4956 18.3924 179.4166 104 E 3.9603 8.2453 113.7037 59.4649 29.7411 178.4135 105 L 4.2345 8.9045 122.6548 57.8372 41.8567 178.4460 106 R 3.8752 8.2716 119.8066 60.4969 30.4030 177.6755 107 H 4.2020 8.6148 118.0622 59.4429 29.4212 177.3110 108 V 3.4186 8.4477 120.2905 66.0621 31.5023 178.2709 109 M 4.2201 8.8037 119.1245 57.9166 30.8951 178.4890 110 T 4.6365 7.7244 111.2600 63.5978 69.3975 176.7207 111 N 4.9260 8.0865 117.6833 55.7738 38.6531 175.4302 112 L 4.2808 7.4695 114.9739 54.5284 41.5363 177.2077 113 G 3.8496 9.4996 106.5692 45.8027 0.0000 173.0706 114 E 4.5020 8.0165 120.0392 53.8678 31.2795 175.2705 115 K 4.4170 8.5104 125.3755 55.0546 32.1183 175.4717 116 L 4.7254 8.1161 123.7688 52.7689 44.0498 176.5519 117 T 4.1738 8.3460 117.3573 61.4186 67.8115 174.9176 118 D 4.3763 8.8433 127.5446 57.6567 40.7357 179.0868 119 E 4.0228 8.3109 119.0381 59.3550 29.4637 178.2958 120 E 4.3891 8.0349 114.7548 57.0151 29.7910 177.9344 121 V 4.1360 7.4282 119.0194 64.9695 32.2502 177.0895 122 D 4.5022 7.7052 116.6087 56.4319 40.1965 178.1503 123 Q 4.1295 7.7516 119.4671 59.3991 29.1224 176.7413 124 M 4.2872 8.5483 120.5350 57.0023 31.7680 179.0130 125 I 3.5919 7.1979 121.3526 64.7985 38.0366 177.2558 126 R 3.8893 7.7575 118.2246 60.0877 29.6004 177.8239 127 E 4.0239 8.0341 118.4623 58.7028 29.7945 178.3596 128 A 4.2772 7.7252 119.5034 52.8692 19.2497 176.9144 129 D 4.7390 7.8848 118.0040 54.0009 41.9559 175.8425 130 I 4.2822 8.8351 126.9439 61.9600 38.9415 176.1915 131 D 4.6376 8.2550 117.6986 52.4652 39.7608 178.1006 132 G 3.8779 7.9166 108.7725 46.1894 0.0000 175.1676 133 D 4.5357 7.7664 117.1647 53.2857 38.7567 177.3568 134 G 4.1360 8.4263 105.8983 46.5322 0.0000 173.6590 135 Q 4.6927 7.7407 114.1399 54.5439 32.1939 174.4261 136 V 4.6684 8.5197 114.5182 60.2733 33.5861 175.4550 137 N 5.0230 8.9738 122.8315 51.4981 39.8634 175.2218 138 Y 3.0548 8.2238 119.0972 61.4960 38.4793 177.7474 139 E 3.6567 8.1122 117.3007 60.2647 29.5303 179.2654 140 E 3.9687 9.5325 117.7478 59.3796 29.7089 179.1880 141 F 4.1790 8.5708 122.0091 61.3794 39.4187 177.1379 142 V 3.3618 8.3381 118.9393 66.0010 31.0656 178.0408 143 Q 3.8362 7.8247 117.6552 59.0181 28.4201 177.8414 144 M 3.8789 7.8588 118.2012 59.8656 32.2630 177.2857 145 M 3.8423 7.6808 117.1158 58.1438 32.2029 177.7120 146 T 3.9814 7.6968 112.0110 63.7592 69.4148 174.6119 147 A 3.8174 7.2812 124.2508 52.0043 18.7582 177.3121 148 K 4.1126 8.5739 122.9204 56.5696 32.2897 176.0765 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 3 Q 8.44 4.23 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 4 L 7.59 3.78 0.00 1.74 1.51 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.21 4.11 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 1.23 0.00 0.00 6 E 8.80 3.94 0.00 2.24 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 0.00 2.37 2.38 0.00 7 E 8.33 3.93 0.00 2.08 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 2.44 2.43 0.00 8 Q 7.84 4.47 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.51 0.00 0.00 0.00 0.00 0.00 1.94 2.39 0.00 9 I 8.79 4.32 1.99 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 1.48 1.06 0.96 0.00 0.00 10 A 8.25 4.19 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 11 E 8.21 4.24 0.00 2.28 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 2.39 2.64 0.00 12 F 8.29 4.25 0.00 3.39 3.45 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 13 K 9.13 4.72 0.00 2.13 1.96 0.00 1.83 0.00 0.00 1.86 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.51 1.72 7.81 14 E 9.25 4.17 0.00 2.10 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 2.42 2.48 0.00 15 A 7.91 4.66 1.24 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 0.00 0.00 16 F 8.19 3.99 0.00 2.82 3.27 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 17 S 8.99 4.10 0.00 3.96 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 18 L 7.57 4.02 0.00 1.91 2.14 1.04 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 19 F 7.72 4.51 0.00 2.88 2.94 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 0.00 0.00 0.00 20 D 8.64 4.47 0.00 2.37 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.53 3.54 0.00 1.65 1.66 0.00 1.83 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.39 1.49 7.81 22 D 8.26 4.58 0.00 2.83 2.80 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 23 G 6.83 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 24 D 9.84 4.32 0.00 2.81 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 25 G 8.18 5.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.73 5.01 4.36 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 1.22 0.00 0.00 27 I 8.32 4.67 1.69 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.97 -0.13 0.00 0.00 28 T 9.92 4.15 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 1.22 0.00 0.00 29 T 8.83 4.12 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 1.22 0.00 0.00 30 K 8.03 3.81 0.00 1.83 1.89 0.00 1.55 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.62 7.81 31 E 8.12 3.94 0.00 2.10 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 2.42 2.28 0.00 32 L 8.24 3.94 0.00 1.79 1.83 1.15 1.42 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 33 G 8.18 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 34 T 8.02 3.85 4.35 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 1.32 0.00 0.00 35 V 7.63 2.84 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 0.82 0.00 0.00 0.68 0.00 0.00 36 M 8.10 3.95 0.00 2.11 2.08 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 2.88 2.77 0.00 37 R 7.89 4.65 0.00 1.79 1.95 0.00 3.14 0.00 0.00 3.29 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 38 S 7.50 4.03 0.00 3.88 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 39 L 7.01 4.14 0.00 1.70 1.55 0.24 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.59 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 41 Q 7.59 4.68 0.00 2.21 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.91 0.00 0.00 0.00 0.00 0.00 2.25 2.23 0.00 42 N 7.99 4.62 0.00 2.79 2.80 0.00 0.00 5.94 7.75 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 43 P 0.00 4.59 0.00 2.21 2.12 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 44 T 8.04 4.31 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 1.21 0.00 0.00 45 E 8.76 3.92 0.00 1.97 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 2.33 2.34 0.00 46 A 7.83 4.62 1.27 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 47 E 8.38 4.13 0.00 2.04 1.95 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 2.31 2.31 0.00 48 L 7.61 3.95 0.00 1.90 1.70 0.95 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 8.53 4.19 0.00 2.33 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.18 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 50 D 7.17 4.66 0.00 2.68 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 51 M 7.70 4.19 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.55 0.00 52 I 7.59 3.79 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.15 1.03 0.00 0.00 53 N 9.23 4.53 0.00 2.74 2.93 0.00 0.00 7.27 7.53 0.00 0.00 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 E 7.57 4.42 0.00 2.31 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 2.30 2.38 0.00 55 V 7.94 4.43 2.45 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 0.73 0.00 0.00 1.15 0.00 0.00 56 D 8.00 4.56 0.00 2.68 2.85 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 57 A 8.40 4.71 1.23 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 0.00 0.00 58 D 7.83 5.23 0.00 2.78 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.69 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 60 N 9.34 4.02 0.00 2.60 2.78 0.00 0.00 6.98 7.86 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 61 G 6.92 3.97 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 0.00 0.00 0.00 62 T 7.37 4.74 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 1.23 0.00 0.00 63 I 8.19 4.71 1.95 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 1.39 1.42 1.08 0.00 0.00 64 D 8.58 4.83 0.00 3.07 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 65 F 9.20 3.31 0.00 2.93 2.98 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 66 P 0.00 4.23 0.00 2.39 2.08 0.00 4.03 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 67 E 10.62 3.85 0.00 2.20 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 2.38 2.92 0.00 68 F 7.39 4.42 0.00 2.92 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 69 L 8.56 3.80 0.00 1.65 1.71 0.78 1.05 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 70 T 8.08 4.02 4.26 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 1.17 0.00 0.00 71 M 7.64 3.99 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 72 M 7.51 4.20 0.00 1.47 1.72 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 2.76 1.81 0.00 73 A 7.55 4.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 R 7.85 4.12 0.00 2.05 1.98 0.00 3.27 0.00 0.00 3.13 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 75 K 7.68 4.68 0.00 1.64 1.70 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.41 7.81 76 M 8.01 4.54 0.00 2.30 1.86 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 77 K 8.10 3.99 0.00 1.66 1.96 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.46 7.81 78 D 6.99 4.41 0.00 2.61 2.45 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 79 T 7.99 3.81 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 1.23 0.00 0.00 80 D 8.52 5.01 0.00 2.66 2.60 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 81 S 7.93 4.27 0.00 4.08 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 0.00 82 E 8.08 3.89 0.00 2.03 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 0.00 2.39 2.56 0.00 83 E 8.20 4.16 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 2.42 2.48 0.00 84 E 8.34 4.01 0.00 2.27 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 2.45 2.54 0.00 85 I 7.77 4.12 2.16 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.10 0.98 0.00 0.00 86 R 8.43 4.63 0.00 1.90 2.09 0.00 2.96 0.00 0.00 2.91 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.32 0.00 87 E 8.06 4.35 0.00 2.19 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 2.30 2.67 0.00 88 A 8.76 4.35 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 0.00 0.00 0.00 0.00 0.00 89 F 8.46 3.33 0.00 3.34 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 90 R 7.82 3.96 0.00 1.81 2.01 0.00 3.23 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.94 0.00 91 V 7.39 3.67 2.33 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 0.54 0.00 0.00 0.97 0.00 0.00 92 F 8.23 4.22 0.00 2.61 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 93 D 7.46 4.47 0.00 2.08 2.24 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 94 K 7.96 4.15 0.00 2.07 1.84 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.56 7.81 95 D 7.91 4.75 0.00 2.68 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 96 G 8.32 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 97 N 8.02 4.77 0.00 3.06 3.19 0.00 0.00 6.90 6.80 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 98 G 8.09 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 0.00 0.00 0.00 99 Y 7.90 5.10 0.00 2.90 2.90 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 0.00 100 I 9.10 4.75 1.99 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.24 0.91 0.00 0.00 101 S 8.71 5.04 0.00 3.91 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 0.00 102 A 9.00 3.60 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 0.00 103 A 8.11 3.98 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.25 3.96 0.00 2.41 2.24 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 2.47 2.42 0.00 105 L 8.90 4.23 0.00 1.83 1.86 1.13 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.27 3.88 0.00 1.90 2.30 0.00 3.34 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 107 H 8.61 4.20 0.00 3.35 3.41 0.00 5.84 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 0.00 108 V 8.45 3.42 1.66 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 0.51 0.00 0.00 0.82 0.00 0.00 109 M 8.80 4.22 0.00 2.07 2.38 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.97 0.00 110 T 7.72 4.64 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 1.31 0.00 0.00 111 N 8.09 4.93 0.00 2.60 2.86 0.00 0.00 6.90 7.85 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 0.00 112 L 7.47 4.28 0.00 1.65 1.67 0.85 0.86 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 0.00 113 G 9.50 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 0.00 0.00 0.00 114 E 8.02 4.50 0.00 2.09 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 0.00 2.24 2.31 0.00 115 K 8.51 4.42 0.00 1.78 1.77 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.38 7.81 116 L 8.12 4.73 0.00 1.63 1.58 0.97 0.95 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 0.00 117 T 8.35 4.17 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 1.25 0.00 0.00 118 D 8.84 4.38 0.00 2.79 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 0.00 119 E 8.31 4.02 0.00 2.04 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 2.33 2.50 0.00 120 E 8.03 4.39 0.00 1.95 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 0.00 2.35 2.32 0.00 121 V 7.43 4.14 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 1.18 0.00 0.00 0.97 0.00 0.00 122 D 7.71 4.50 0.00 2.78 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 0.00 123 Q 7.75 4.13 0.00 2.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 124 M 8.55 4.29 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.60 0.00 125 I 7.20 3.59 1.90 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 1.70 0.75 0.97 0.00 0.00 126 R 7.76 3.89 0.00 2.16 1.90 0.00 3.11 0.00 0.00 3.10 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 127 E 8.03 4.02 0.00 2.05 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 2.32 2.34 0.00 128 A 7.73 4.28 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 0.00 129 D 7.88 4.74 0.00 2.77 2.70 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 0.00 130 I 8.84 4.28 1.88 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 1.36 0.89 0.91 0.00 0.00 131 D 8.25 4.64 0.00 2.81 2.90 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 0.00 132 G 7.92 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 0.00 133 D 7.77 4.54 0.00 2.89 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 0.00 134 G 8.43 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 0.00 135 Q 7.74 4.69 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 136 V 8.52 4.67 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 0.78 0.00 0.00 1.07 0.00 0.00 137 N 8.97 5.02 0.00 2.68 3.03 0.00 0.00 6.15 6.91 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 0.00 138 Y 8.22 3.05 0.00 2.05 2.65 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 0.00 139 E 8.11 3.66 0.00 2.31 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 2.38 2.39 0.00 140 E 9.53 3.97 0.00 2.33 2.23 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 2.69 2.57 0.00 141 F 8.57 4.18 0.00 3.26 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 0.00 142 V 8.34 3.36 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 0.78 0.00 0.00 -0.34 0.00 0.00 143 Q 7.82 3.84 0.00 2.21 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.49 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 144 M 7.86 3.88 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.63 0.00 145 M 7.68 3.84 0.00 1.82 1.60 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 2.47 2.36 0.00 146 T 7.70 3.98 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 0.00 147 A 7.28 3.82 1.29 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 0.00 0.00 0.00 148 K 8.57 4.11 0.00 1.70 1.67 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.40 7.81