NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2980 8.2644 123.5811 52.8216 19.4310 177.4813 2 T 4.5537 8.5342 112.0884 63.2344 68.9995 171.3116 3 K 5.3137 8.2933 120.9495 55.6350 37.2954 174.4475 4 A 5.3947 9.1241 124.1105 50.8441 23.4526 175.0591 5 V 5.0053 8.6976 117.1538 60.9405 35.4558 173.4227 6 C 4.9209 9.2603 122.2531 58.1325 35.4568 172.6451 7 V 4.5213 8.4967 126.2528 61.5822 32.8655 174.1671 8 L 4.8517 8.8223 129.4999 53.9241 43.4930 176.3936 9 K 5.0129 8.8801 121.9850 55.5495 37.4492 175.0279 10 G 4.8059 8.7141 106.0359 47.3127 0.0000 172.1837 11 D 4.6925 9.5333 123.6172 54.4404 40.1368 177.5614 12 G 4.9825 8.8619 118.7642 46.3450 0.0000 171.7803 13 P 4.5165 0.0000 0.0000 61.7195 31.9825 175.3720 14 V 4.4035 8.1788 123.5404 62.1965 32.1959 174.4601 15 Q 5.1186 8.6352 125.5123 54.6357 33.3993 174.2974 16 G 4.3949 8.7835 108.0266 45.6417 0.0000 171.8827 17 I 5.1471 8.3686 120.5546 59.3064 40.7704 174.8713 18 I 4.7147 8.7515 127.2563 59.4717 40.4856 174.2412 19 N 5.0277 8.4389 124.1899 51.2981 41.3022 173.8413 20 F 5.3283 8.8307 120.3165 55.7580 42.9442 173.8732 21 E 5.2539 9.7205 123.3259 54.8490 33.3777 173.7536 22 Q 4.8326 9.1792 127.6396 54.2536 30.6197 174.7198 23 K 4.1891 8.9693 127.4611 58.9708 32.7232 177.3865 24 E 4.8065 7.7342 114.4907 54.3863 32.3799 176.1486 25 S 4.1953 8.6807 115.0088 61.0442 63.2544 174.5183 26 N 4.7501 8.1935 117.2856 52.4370 37.1351 174.0893 27 G 4.2197 7.7613 107.5657 42.9670 0.0000 171.0760 28 P 4.7233 0.0000 0.0000 62.6101 32.6732 175.7105 29 V 4.6648 8.8628 120.8276 61.2141 33.7558 174.5621 30 K 4.9168 9.2960 128.2107 55.7540 33.8885 175.9147 31 V 4.7862 9.2331 124.8359 60.7891 34.4882 174.2060 32 W 5.5161 8.0416 123.7762 54.8670 31.7550 175.3613 33 G 3.8085 7.5421 107.4737 46.3191 0.0000 170.7864 34 S 5.0468 7.7688 114.3683 56.9032 66.6069 174.3974 35 I 5.1441 8.7203 126.1672 59.3557 41.0503 174.6460 36 K 4.7980 9.1826 125.3600 55.6612 36.1611 176.9482 37 G 4.1892 8.7166 105.7386 46.6557 0.0000 173.5316 38 L 4.4109 7.7541 119.9723 53.1745 42.8901 176.6807 39 T 4.3504 8.1318 111.3611 61.0769 69.5113 173.9771 40 E 4.0244 8.5655 124.3290 57.3298 30.3683 175.1320 41 G 3.7339 8.4349 110.7225 43.8535 0.0000 172.3878 42 L 4.7670 8.1894 118.7661 54.7782 42.8316 176.6250 43 H 5.0024 9.3041 119.5863 53.6474 32.6532 173.5130 44 G 4.0569 9.0889 110.9840 46.8394 0.0000 172.7333 45 F 5.3526 8.7850 124.5862 57.3854 42.1187 172.8111 46 H 5.0105 8.7796 122.7233 54.0395 33.9239 172.7889 47 V 4.3381 8.5148 121.1062 62.8001 32.5440 175.1473 48 H 5.1817 9.4389 125.3325 54.3761 30.8206 175.8723 49 E 3.7823 8.8999 122.1196 58.7419 29.7211 177.1984 50 F 5.0308 8.0487 118.0542 55.7420 41.2441 176.1323 51 G 4.1769 8.4579 113.1292 44.7587 0.0000 173.9101 52 D 4.8242 8.0440 118.3898 52.6341 42.9141 174.6562 53 N 5.2039 8.4893 124.0780 53.3316 39.5272 176.8449 54 T 3.8431 8.4891 117.6165 66.5548 68.4594 175.6403 55 A 4.6039 8.2660 121.2665 51.6282 19.8004 176.7226 56 G 3.8523 7.9443 107.7391 46.2568 0.0000 174.1782 57 C 4.3916 8.6583 114.4384 59.7963 34.2396 175.6000 58 T 3.7647 8.0052 114.7829 65.3229 66.6379 175.5673 59 S 4.3429 7.9834 115.2278 60.3791 63.1360 175.5702 60 A 4.5419 7.5059 124.4158 53.6684 18.4277 178.5638 61 G 4.2019 8.1916 105.5561 44.2300 0.0000 170.8607 62 P 4.6833 0.0000 0.0000 61.9625 33.7721 175.2039 63 H 4.4357 8.3967 116.5282 55.7908 29.4740 175.6420 64 F 4.2462 9.1300 125.6899 58.0901 40.2453 175.1680 65 N 5.1075 7.8307 125.5762 51.7299 38.9011 173.0977 66 P 4.1766 0.0000 0.0000 65.0384 32.1396 177.8509 67 L 4.3030 7.5766 116.6020 53.8674 42.0461 176.0835 68 S 3.6359 7.5731 113.7581 59.6819 60.6655 172.2020 69 R 4.4541 8.1047 118.0960 54.6760 31.8728 176.3900 70 K 4.4399 8.7367 118.6068 55.6433 33.8321 176.4770 71 H 3.9792 8.5620 122.7898 57.0753 30.4559 174.9607 72 G 4.1300 7.4182 109.5234 45.8276 0.0000 172.2780 73 G 4.1089 9.0516 109.9670 43.5197 0.0000 173.2847 74 P 4.3751 0.0000 0.0000 65.2936 31.2792 177.6056 75 K 4.2466 7.9029 115.8647 56.9864 32.5486 176.3695 76 D 4.6485 7.7920 119.9953 53.1658 41.7371 176.1180 77 E 3.8910 8.8919 124.7428 59.1187 30.0477 176.7225 78 E 4.2454 7.9768 122.6940 55.2582 28.5532 174.8136 79 R 4.8989 7.5985 119.8690 54.8626 32.6472 174.8770 80 H 4.4293 8.9829 116.6452 55.4194 29.3548 177.1523 81 V 3.4838 8.2239 122.4079 66.2341 31.4640 177.2658 82 G 3.8416 8.2626 105.1354 47.5204 0.0000 173.4320 83 D 4.9545 8.2165 121.0655 53.9355 40.2091 175.7070 84 L 4.5757 8.4203 121.5693 52.9996 42.7490 177.9936 85 G 4.1299 8.6065 109.9713 46.2175 0.0000 174.8258 86 N 5.6316 8.6122 120.0995 51.3709 42.3356 173.1217 87 V 4.2900 8.5006 114.2551 60.1875 35.0250 175.0757 88 T 5.0488 8.1957 118.3009 61.8805 71.5646 172.8225 89 A 4.8700 8.8274 128.9738 50.3926 21.1334 176.5770 90 D 4.9138 8.7156 121.5091 53.3083 42.2273 177.2938 91 K 3.9400 8.5318 120.5581 59.3289 31.9444 178.0599 92 D 4.4266 8.1807 116.1686 53.7639 39.6224 177.2891 93 G 4.3659 8.6009 109.5588 44.6559 0.0000 172.6850 94 V 4.7936 8.2073 120.1706 60.9783 33.9657 174.2275 95 A 5.4797 8.8011 129.4796 49.5248 21.2945 175.0297 96 D 4.8652 8.6907 123.2740 53.5696 42.1528 176.0614 97 V 4.1176 8.5289 124.5732 61.3313 33.4629 174.9149 98 S 4.9683 8.5263 123.0965 57.5785 63.9969 172.6325 99 I 4.8090 9.2784 128.0343 59.2001 41.2223 174.1702 100 E 5.2325 8.8616 125.5117 54.5233 32.3551 174.4180 101 D 4.9346 9.3312 125.5271 52.9150 44.7802 175.7895 102 S 4.6507 8.9910 119.5377 58.6541 63.9265 174.8619 103 V 4.0754 7.9406 119.9801 64.3562 32.2593 176.3155 104 I 3.9981 7.7601 111.4843 61.2913 38.0499 174.6704 105 S 4.6651 8.4214 114.7556 57.3845 65.4840 174.1689 106 L 4.4316 8.8675 123.0022 54.3140 41.5578 176.4070 107 S 4.4603 7.8586 112.7728 58.1884 66.2626 175.0753 108 G 3.7959 8.5290 108.7175 44.6519 0.0000 173.3724 109 D 4.4039 8.5615 116.7268 57.0147 41.4448 177.2520 110 H 5.1185 8.0554 114.9140 55.5430 28.9958 174.0362 111 C 4.4261 8.0576 120.8450 59.5928 31.9073 173.4627 112 I 3.9692 8.0778 118.1277 60.3145 38.1865 175.7058 113 I 3.6817 7.2917 122.8190 62.8871 37.6113 176.3697 114 G 3.8103 9.3891 112.9837 45.3731 0.0000 172.9465 115 R 4.9331 7.4535 118.8770 54.8284 33.7225 174.6702 116 T 4.9766 7.9829 116.1089 61.9377 71.0377 173.9182 117 L 4.6954 8.5937 128.7527 54.2687 43.8846 175.4571 118 V 4.9528 8.6999 125.4484 60.9592 35.2942 174.1998 119 V 5.0923 8.6392 126.4375 60.4427 33.7820 174.6491 120 H 5.2492 8.9803 121.4661 53.9894 30.7385 174.5460 121 E 4.2043 9.2783 121.9573 59.0344 29.9934 176.5759 122 K 4.8103 8.3137 116.6416 53.7425 36.5700 175.7830 123 A 4.3831 8.3667 123.4372 52.2940 18.8992 176.1078 124 D 4.9286 9.2633 122.1135 53.3941 41.6086 176.2351 125 D 4.5766 9.1795 125.6282 53.2548 39.6755 176.7248 126 L 3.4109 9.8023 119.6569 56.2169 39.4800 176.1126 127 G 4.1675 8.5045 104.9787 45.9078 0.0000 174.9583 128 K 4.3771 8.0108 117.2392 55.8612 32.2899 176.6781 129 G 4.0265 7.4958 109.3107 44.0831 0.0000 173.5650 130 G 4.0440 8.3207 105.8770 45.0519 0.0000 172.9273 131 N 4.8947 7.6377 116.2428 51.1714 40.1812 173.8714 132 E 4.0817 8.6989 115.4610 59.2194 30.0212 178.8074 133 E 3.9293 8.1520 119.6308 58.8538 29.4723 178.3353 134 S 4.1855 8.3420 113.8454 61.3167 62.2770 175.2963 135 T 4.4927 7.6581 110.2460 61.7306 68.5088 175.2183 136 K 4.2763 7.7043 119.0695 58.1279 34.0653 177.0510 137 T 4.1013 8.0225 106.3780 60.1684 70.2365 175.5554 138 G 3.8743 8.0910 110.0990 45.2642 0.0000 173.4104 139 N 4.3202 7.8616 114.2309 54.2268 36.6058 175.0434 140 A 4.4171 6.9985 119.5377 51.6252 19.4395 179.9014 141 G 4.1027 7.9252 103.8908 44.3887 0.0000 172.8817 142 S 4.4623 8.5753 114.5829 58.4920 64.9892 173.6094 143 R 4.6221 8.3073 118.9982 54.7653 30.0349 176.6221 144 L 4.2960 8.8648 125.9573 57.5016 43.0352 177.2253 145 A 5.0611 7.7793 117.5068 51.4868 22.6672 174.1065 146 C 5.5649 8.3486 113.7015 55.8235 46.9526 172.6702 147 G 4.6954 8.0901 104.0730 46.1321 0.0000 172.4712 148 V 4.4591 8.2489 121.0892 62.2294 32.7316 175.5488 149 I 4.1128 8.9450 129.8141 61.1229 38.0314 175.4113 150 G 4.4121 9.0013 114.4917 43.9354 0.0000 172.1189 151 I 4.4784 8.2797 121.2703 61.0624 37.6538 175.5639 152 A 4.8171 8.4836 128.0643 49.6938 21.9963 176.2930 153 Q 4.0671 8.5073 118.8937 56.4316 29.2125 176.0280 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 A 8.26 4.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 T 8.53 4.55 4.59 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 1.24 0.00 0.00 3 K 8.29 5.31 0.00 1.90 1.68 0.00 1.96 0.00 0.00 1.94 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.50 7.81 4 A 9.12 5.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.70 5.01 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 0.95 0.00 0.00 6 C 9.26 4.92 0.00 3.12 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 7 V 8.50 4.52 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 0.93 0.00 0.00 0.92 0.00 0.00 8 L 8.82 4.85 0.00 1.71 1.59 1.05 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.88 5.01 0.00 1.66 1.66 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.38 7.81 10 G 8.71 4.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 9.53 4.69 0.00 2.65 2.40 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 12 G 8.86 4.98 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 13 P 0.00 4.52 0.00 2.18 1.99 0.00 3.86 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 2.10 2.02 0.00 14 V 8.18 4.40 2.07 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 1.02 0.00 0.00 1.01 0.00 0.00 15 Q 8.64 5.12 0.00 2.01 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.36 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 16 G 8.78 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 0.00 0.00 0.00 0.00 17 I 8.37 5.15 1.82 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 1.20 1.45 0.83 0.00 0.00 18 I 8.75 4.71 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.30 0.42 0.00 0.00 19 N 8.44 5.03 0.00 1.44 1.59 0.00 0.00 6.39 8.00 0.00 0.00 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 F 8.83 5.33 0.00 2.85 2.88 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 21 E 9.72 5.25 0.00 2.45 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 2.32 2.55 0.00 22 Q 9.18 4.83 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.75 0.00 0.00 0.00 0.00 0.00 2.46 2.65 0.00 23 K 8.97 4.19 0.00 1.81 1.88 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.46 7.81 24 E 7.73 4.81 0.00 2.17 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 2.28 2.54 0.00 25 S 8.68 4.20 0.00 4.01 4.06 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 26 N 8.19 4.75 0.00 2.86 2.95 0.00 0.00 5.76 7.00 0.00 0.00 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 G 7.76 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 28 P 0.00 4.72 0.00 2.22 2.11 0.00 3.76 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 29 V 8.86 4.66 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 1.32 0.00 0.00 1.09 0.00 0.00 30 K 9.30 4.92 0.00 1.95 1.85 0.00 1.49 0.00 0.00 1.46 0.00 0.00 2.90 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.60 1.43 7.81 31 V 9.23 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 0.77 0.00 0.00 1.07 0.00 0.00 32 W 8.04 5.52 0.00 3.49 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 33 G 7.54 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.77 5.05 0.00 3.89 3.62 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 35 I 8.72 5.14 1.79 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 1.26 0.48 0.92 0.00 0.00 36 K 9.18 4.80 0.00 1.72 1.87 0.00 1.35 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.33 7.81 37 G 8.72 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 0.00 0.00 0.00 0.00 38 L 7.75 4.41 0.00 1.79 1.40 0.80 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.13 4.35 4.28 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 1.24 0.00 0.00 40 E 8.57 4.02 0.00 1.96 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 2.30 2.45 0.00 41 G 8.43 3.73 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 0.00 42 L 8.19 4.77 0.00 1.49 1.58 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.30 5.00 0.00 3.01 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.09 4.06 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 0.00 0.00 0.00 45 F 8.79 5.35 0.00 2.99 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 46 H 8.78 5.01 0.00 3.06 3.11 0.00 5.85 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 47 V 8.51 4.34 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 0.89 0.00 0.00 0.88 0.00 0.00 48 H 9.44 5.18 0.00 3.05 3.40 0.00 5.69 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.90 3.78 0.00 1.61 1.12 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 1.57 2.17 0.00 50 F 8.05 5.03 0.00 3.11 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 51 G 8.46 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 0.00 0.00 0.00 0.00 52 D 8.04 4.82 0.00 2.62 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 53 N 8.49 5.20 0.00 2.83 2.75 0.00 0.00 7.05 7.05 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 54 T 8.49 3.84 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 1.19 0.00 0.00 55 A 8.27 4.60 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 56 G 7.94 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 57 C 8.66 4.39 0.00 2.96 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 58 T 8.01 3.76 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 1.23 0.00 0.00 59 S 7.98 4.34 0.00 4.18 4.02 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 60 A 7.51 4.54 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.19 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 62 P 0.00 4.68 0.00 2.03 2.19 0.00 3.52 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 1.94 1.97 0.00 63 H 8.40 4.44 0.00 2.77 3.19 0.00 5.73 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.13 4.25 0.00 2.90 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 65 N 7.83 5.11 0.00 2.58 2.43 0.00 0.00 6.94 7.71 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 66 P 0.00 4.18 0.00 2.10 1.94 0.00 2.99 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.11 0.00 67 L 7.58 4.30 0.00 1.55 1.68 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.57 3.64 0.00 4.01 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 69 R 8.10 4.45 0.00 1.90 1.96 0.00 3.10 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 70 K 8.74 4.44 0.00 1.66 1.68 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.36 7.81 71 H 8.56 3.98 0.00 3.17 3.15 0.00 5.96 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 72 G 7.42 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 0.00 0.00 0.00 73 G 9.05 4.11 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 0.00 0.00 0.00 74 P 0.00 4.38 0.00 2.23 2.37 0.00 3.79 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 2.02 2.05 0.00 75 K 7.90 4.25 0.00 1.77 1.90 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 7.79 4.65 0.00 2.76 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.89 3.89 0.00 1.91 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 2.28 2.29 0.00 78 E 7.98 4.25 0.00 2.06 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 0.00 2.32 2.30 0.00 79 R 7.60 4.90 0.00 1.95 1.87 0.00 2.85 0.00 0.00 3.87 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 80 H 8.98 4.43 0.00 3.49 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.22 3.48 1.53 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 0.81 0.00 0.00 0.50 0.00 0.00 82 G 8.26 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 83 D 8.22 4.95 0.00 2.69 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 84 L 8.42 4.58 0.00 1.79 1.88 0.93 1.00 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 85 G 8.61 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 0.00 0.00 0.00 86 N 8.61 5.63 0.00 2.58 2.69 0.00 0.00 6.67 7.68 0.00 0.00 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 V 8.50 4.29 1.82 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 -0.16 0.00 0.00 0.81 0.00 0.00 88 T 8.20 5.05 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 1.20 0.00 0.00 89 A 8.83 4.87 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 90 D 8.72 4.91 0.00 2.77 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 91 K 8.53 3.94 0.00 1.78 1.87 0.00 1.82 0.00 0.00 1.83 0.00 0.00 3.22 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.38 7.81 92 D 8.18 4.43 0.00 2.79 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 93 G 8.60 4.37 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 0.00 94 V 8.21 4.79 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 0.91 0.00 0.00 0.92 0.00 0.00 95 A 8.80 5.48 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 96 D 8.69 4.87 0.00 2.55 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 97 V 8.53 4.12 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 0.76 0.00 0.00 0.61 0.00 0.00 98 S 8.53 4.97 0.00 3.90 3.73 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 99 I 9.28 4.81 1.98 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.53 1.02 0.00 0.00 100 E 8.86 5.23 0.00 1.97 1.82 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 2.21 2.48 0.00 101 D 9.33 4.93 0.00 2.86 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 0.00 102 S 8.99 4.65 0.00 3.92 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 0.00 103 V 7.94 4.08 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 0.80 0.00 0.00 0.94 0.00 0.00 104 I 7.76 4.00 1.94 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 1.49 0.81 1.04 0.00 0.00 105 S 8.42 4.67 0.00 3.83 3.83 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 0.00 106 L 8.87 4.43 0.00 1.88 1.64 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.86 4.46 0.00 3.87 3.79 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 0.00 108 G 8.53 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 0.00 109 D 8.56 4.40 0.00 2.61 2.63 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 0.00 0.00 0.00 0.00 110 H 8.06 5.12 0.00 3.28 3.43 0.00 5.69 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.06 4.43 0.00 3.15 2.81 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 0.00 0.00 0.00 0.00 112 I 8.08 3.97 1.64 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.17 0.99 0.00 0.00 113 I 7.29 3.68 1.77 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 1.20 0.37 0.83 0.00 0.00 114 G 9.39 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.45 4.93 0.00 1.62 1.84 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.22 0.00 116 T 7.98 4.98 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 1.18 0.00 0.00 117 L 8.59 4.70 0.00 1.78 1.52 0.50 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.70 4.95 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 0.69 0.00 0.00 0.70 0.00 0.00 119 V 8.64 5.09 2.30 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 0.77 0.00 0.00 1.04 0.00 0.00 120 H 8.98 5.25 0.00 3.21 3.58 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.28 4.20 0.00 2.10 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 2.37 2.35 0.00 122 K 8.31 4.81 0.00 1.75 1.67 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.37 4.38 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 0.00 124 D 9.26 4.93 0.00 2.71 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 0.00 125 D 9.18 4.58 0.00 2.94 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 0.00 126 L 9.80 3.41 0.00 1.85 1.86 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.50 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 0.00 0.00 0.00 0.00 128 K 8.01 4.38 0.00 1.90 1.82 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.50 7.81 129 G 7.50 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 0.00 0.00 0.00 130 G 8.32 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 0.00 0.00 0.00 131 N 7.64 4.89 0.00 2.77 2.79 0.00 0.00 6.28 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 0.00 132 E 8.70 4.08 0.00 2.21 2.25 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 2.36 2.35 0.00 133 E 8.15 3.93 0.00 2.09 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 2.40 0.00 134 S 8.34 4.19 0.00 4.22 3.99 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 0.00 135 T 7.66 4.49 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 1.21 0.00 0.00 136 K 7.70 4.28 0.00 1.91 1.80 0.00 1.97 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.32 1.36 7.81 137 T 8.02 4.10 4.16 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 1.17 0.00 0.00 138 G 8.09 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 0.00 139 N 7.86 4.32 0.00 2.91 2.92 0.00 0.00 6.85 7.11 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 0.00 140 A 7.00 4.42 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 0.00 141 G 7.93 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 0.00 142 S 8.58 4.46 0.00 3.95 4.07 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 0.00 143 R 8.31 4.62 0.00 1.68 1.86 0.00 3.20 0.00 0.00 3.14 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.65 0.00 144 L 8.86 4.30 0.00 1.72 1.70 0.96 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.78 5.06 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 0.00 146 C 8.35 5.56 0.00 3.06 3.12 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 0.00 147 G 8.09 4.70 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 0.00 148 V 8.25 4.46 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 0.77 0.00 0.00 0.92 0.00 0.00 149 I 8.95 4.11 1.81 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.25 0.44 0.00 0.00 150 G 9.00 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 0.00 151 I 8.28 4.48 1.86 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 1.25 0.54 0.91 0.00 0.00 152 A 8.48 4.82 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 0.00 153 Q 8.51 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00