NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6401 8.1476 120.2829 54.9146 34.4494 174.1467 2 K 4.7808 8.3621 121.9613 56.0837 33.8740 170.9105 3 V 5.0416 8.5227 115.0201 59.7752 37.6378 175.3296 4 I 4.8194 8.5762 121.8728 59.1251 40.3658 174.0780 5 L 4.7928 8.2111 131.6193 54.3137 41.6863 177.7460 6 L 4.7770 7.8572 128.3911 54.0359 39.3307 176.5357 7 E 4.7071 7.6358 114.5446 55.4205 32.9388 173.7621 8 P 4.3800 0.0000 0.0000 63.6967 31.2823 174.5385 9 L 4.2574 8.7172 126.5035 53.3591 43.2393 176.3808 10 E 3.7908 9.4469 122.4870 60.7764 30.0771 177.8608 11 N 4.4035 8.1911 120.9123 56.8211 39.2329 176.0919 12 L 4.1131 7.5210 117.9165 54.0105 42.5040 180.1690 13 G 4.2345 7.0626 106.9697 46.2236 0.0000 171.4816 14 D 4.9658 7.8516 119.6625 52.8534 42.1548 175.9009 15 V 3.8978 7.9391 119.8502 64.5161 31.8205 176.2017 16 G 3.9871 8.8728 114.6515 45.4051 0.0000 173.8317 17 Q 4.2975 7.4249 117.3932 55.6996 30.4737 175.4985 18 V 4.8677 8.5238 119.9961 60.2204 33.8148 174.8856 19 V 4.5582 8.2297 127.1253 59.9114 35.2550 174.2289 20 D 5.2943 8.5992 122.9424 53.0600 42.1375 176.2141 21 V 4.8778 8.1825 116.7200 58.8928 34.6712 175.7406 22 K 4.1034 8.6073 120.5585 56.0621 32.2405 175.8711 23 P 4.2850 0.0000 0.0000 66.3458 31.1893 178.6424 24 G 3.8138 8.1175 103.1555 48.4914 0.0000 174.4198 25 Y 4.4739 7.8856 121.0965 60.0139 38.5790 177.6751 26 A 4.1779 7.8282 120.1956 53.3959 19.7753 178.6597 27 R 4.0196 7.9569 116.3333 58.0219 30.2948 176.6772 28 N 4.9749 8.3842 113.5256 52.9880 39.1423 173.8700 29 Y 4.7350 7.0070 118.3547 58.3618 42.3227 176.4586 30 L 3.5598 7.3884 118.1739 58.0107 42.9292 179.3976 31 L 4.3207 8.4666 120.7124 57.4023 42.0778 178.0666 32 P 4.2437 0.0000 0.0000 65.4663 31.4204 177.9586 33 R 4.2927 7.8672 114.1041 54.9437 31.2444 176.7669 34 G 3.8258 7.5710 106.3043 47.0515 0.0000 173.2401 35 L 4.5898 8.2159 119.5294 55.6128 45.2495 178.0988 36 A 5.2987 7.6503 117.8178 50.0820 23.5892 174.5807 37 V 4.4455 8.3424 117.5092 60.5809 35.2491 173.6956 38 L 4.0815 8.8749 128.7645 55.5633 42.2666 177.4948 39 A 4.5057 8.3494 130.3653 52.1238 15.8673 176.8028 40 T 4.2326 7.8300 113.2586 59.9455 70.5893 176.4283 41 E 3.9967 8.5749 121.4288 58.9184 29.4815 178.4043 42 S 4.2053 7.7867 113.6716 61.7244 62.6360 175.8729 43 N 4.4041 8.0676 118.5645 56.0522 38.1214 177.2598 44 L 4.0395 7.7994 119.9320 57.5276 41.8865 179.5745 45 K 4.0970 7.9016 118.2760 59.5048 32.0542 179.3608 46 A 4.0931 7.9691 120.0743 54.6333 18.2367 179.1405 47 L 3.9682 8.0237 119.3881 58.1305 42.1379 178.8098 48 E 4.0252 8.2177 118.4275 58.9223 29.2494 179.2493 49 A 3.9540 7.9013 120.6524 55.2795 18.0797 179.4407 50 R 3.9052 7.7029 116.6523 59.8955 30.0529 179.1028 51 I 3.8319 7.7845 119.4579 64.1428 37.2477 178.4043 52 R 3.9009 8.5882 118.7462 60.0689 30.0766 178.3187 53 A 3.9656 8.5366 120.6763 55.1006 18.0274 178.9769 54 Q 3.9452 8.2745 115.6608 59.6111 29.1659 178.6343 55 A 4.2035 8.3022 122.8149 54.4781 18.2443 178.7651 56 K 4.1627 8.5378 115.2273 58.0644 33.1138 179.3276 57 R 3.9114 8.0789 121.3410 59.3528 30.1691 177.6111 58 L 4.4270 7.6953 117.2449 56.0512 42.2455 178.5578 59 A 4.0876 8.2851 120.9291 53.9662 18.2102 178.2927 60 E 4.3537 7.8817 116.8565 57.3912 30.0882 178.0112 61 R 4.0086 7.5062 116.9149 58.7267 29.5353 178.1813 62 K 3.8345 8.2697 118.7630 58.2102 32.0304 178.2600 63 A 4.1553 7.3026 118.9161 54.0806 18.7408 178.4043 64 E 4.1715 7.9079 117.7880 58.4463 29.8338 177.4382 65 A 4.2867 7.7068 118.7381 53.0912 18.3795 178.2149 66 E 4.2022 7.5908 119.3188 58.0217 29.4933 178.3451 67 R 4.0275 7.7700 118.3035 58.8600 30.3527 178.5322 68 L 4.0919 7.8126 117.8596 56.9204 41.5131 179.0977 69 K 4.0262 7.4987 118.1383 59.3384 32.1862 178.2947 70 E 4.1416 7.6990 117.6358 58.4574 29.3465 178.0067 71 I 4.1341 7.4172 117.4823 62.6432 38.5954 176.9842 72 L 3.9715 7.7994 117.3672 55.9576 41.6395 177.6675 73 E 4.3847 8.0087 118.3928 56.7975 30.4509 175.4572 74 N 4.9984 7.4567 115.3394 52.1557 39.3134 174.4492 75 L 4.5827 7.6332 118.4759 53.8038 45.3155 174.4239 76 T 4.4422 8.3378 115.7229 60.5307 70.7592 174.3676 77 L 4.5967 8.1005 127.3854 53.7331 42.3521 175.0509 78 T 4.4305 8.2388 116.2730 60.4338 70.0667 174.1957 79 I 4.2507 8.7787 128.4541 58.8904 39.2088 173.5483 80 P 4.4674 0.0000 0.0000 61.9302 29.3831 175.8302 81 V 4.3896 8.2609 123.4003 60.8738 34.8218 173.9578 82 R 4.6030 8.2482 121.9546 55.1820 32.1331 174.4738 83 A 4.8273 8.0956 123.3642 51.8197 21.7385 175.5797 84 G 3.7535 9.0487 110.5023 46.6145 0.0000 174.4932 85 E 4.6206 8.5022 119.1353 56.4368 33.6533 176.4279 86 T 4.5254 7.9267 111.9642 64.9071 71.6416 174.6771 87 K 4.8248 7.9235 119.6687 55.2829 34.3039 176.1248 88 I 3.9460 7.6940 122.5068 62.3634 37.6514 175.1888 89 Y 3.9432 9.6919 123.5305 59.6150 38.9376 179.3373 90 G 3.8092 9.5196 109.7933 47.6361 0.0000 174.7274 91 S 5.4261 8.7366 121.1417 57.6990 65.0542 174.4507 92 V 5.1084 8.0954 127.7976 59.7121 32.8609 174.7133 93 T 4.8945 8.2620 117.8762 60.9709 70.2858 174.9809 94 A 4.2042 8.4718 119.7263 54.0670 18.7152 179.8385 95 K 3.9558 7.7142 117.3353 59.4561 32.5862 178.9110 96 D 4.4962 8.1389 117.7480 56.4340 40.6401 178.0231 97 I 4.0697 7.1232 120.1106 63.5048 37.4080 177.7361 98 A 4.1040 7.9044 120.6675 54.4625 18.0377 178.9863 99 E 3.9706 8.3710 118.4846 59.0996 30.0111 178.2337 100 A 4.1769 7.7099 119.0924 53.8417 18.2229 178.9662 101 L 4.0554 7.8841 119.4971 57.6829 42.3691 178.4517 102 S 4.5432 7.7785 113.1522 59.7598 62.3676 175.8639 103 R 4.1019 7.5659 120.5679 58.9179 30.2637 178.5441 104 Q 4.1101 7.9034 116.3880 58.7979 28.6660 176.8764 105 H 4.6332 8.4103 113.1088 58.0761 31.5481 173.0135 106 G 3.7878 7.4248 107.5642 45.6609 0.0000 173.3762 107 I 3.6656 7.6546 122.8893 60.9506 38.4404 174.8719 108 T 4.5870 8.3574 125.2138 62.1507 68.0737 173.9524 109 I 4.6902 7.8118 118.8157 58.8955 40.8437 174.3417 110 D 4.9373 8.8897 122.1328 52.1398 42.0341 176.0659 111 P 4.5707 0.0000 0.0000 64.5356 31.6824 177.6964 112 K 4.1582 8.0558 118.6656 59.5792 32.7365 178.6409 113 R 3.7138 7.8826 117.2339 58.4771 30.1520 176.1855 114 L 4.1563 7.5486 119.6292 54.9283 41.8884 177.5898 115 A 4.3125 8.5896 131.5508 51.2638 15.8392 174.9068 116 L 4.4009 7.6090 119.2932 53.8778 45.3805 174.3422 117 E 4.4389 8.7023 123.0221 56.7316 31.4917 176.2267 118 K 4.0090 7.8641 120.9860 55.4608 32.4031 175.0977 119 P 4.5226 0.0000 0.0000 61.5735 30.4257 174.1926 120 I 3.5276 8.0198 124.0497 61.0138 38.0231 175.8832 121 K 5.1139 8.5424 131.0492 55.7794 32.7695 174.9468 122 E 4.6854 8.2669 116.7847 54.0679 33.0803 173.7760 123 L 4.4305 9.0331 126.0815 54.5669 43.4936 175.5743 124 G 3.6350 7.7555 109.3556 43.6828 0.0000 172.0574 125 E 4.6617 7.9218 116.8778 54.7737 32.1877 174.7115 126 Y 4.8628 8.1404 117.6749 56.8046 43.4397 174.1142 127 V 4.5972 8.4248 119.7963 61.2577 32.4943 175.2664 128 L 4.4989 8.4241 128.5087 54.8820 44.0010 175.6043 129 T 4.8344 8.3308 114.7983 63.2049 72.9463 172.5318 130 Y 4.8893 9.4905 127.9219 55.8606 41.8231 174.5173 131 K 4.8455 7.2339 124.2834 54.2425 31.6263 174.2581 132 P 4.3776 0.0000 0.0000 64.5806 32.2013 176.5198 133 H 4.9396 7.8258 116.6972 53.2656 32.3728 172.4176 134 P 4.2192 0.0000 0.0000 64.8831 31.2443 176.9053 135 E 4.6387 8.1053 112.3656 55.9409 30.2609 176.6126 136 V 4.3635 7.3729 118.8541 60.7710 31.3844 172.6173 137 P 4.8120 0.0000 0.0000 61.9821 33.2244 175.8802 138 I 4.5442 8.6177 120.9557 59.9132 41.1533 175.0754 139 Q 4.7377 8.7274 127.3165 54.9521 29.0483 176.1025 140 L 4.3479 8.4707 128.2085 53.5362 43.0328 175.9084 141 K 4.2710 8.7271 126.5870 57.0881 33.1485 176.6261 142 V 4.4017 8.4727 124.0590 61.0763 34.4213 175.6066 143 S 4.5996 7.5619 112.2494 57.5894 62.9456 175.8015 144 V 4.0019 8.0464 121.8785 63.3225 32.6669 176.9470 145 V 3.9860 8.9087 128.2821 62.8667 31.5271 175.5060 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 8.15 4.64 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 2 K 8.36 4.78 0.00 1.92 2.21 0.00 1.61 0.00 0.00 1.78 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.53 7.81 3 V 8.52 5.04 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 1.02 0.00 0.00 4 I 8.58 4.82 1.87 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 1.28 1.36 0.99 0.00 0.00 5 L 8.21 4.79 0.00 1.73 1.78 1.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.86 4.78 0.00 1.64 1.74 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 7 E 7.64 4.71 0.00 1.89 1.77 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 2.05 2.24 0.00 8 P 0.00 4.38 0.00 2.12 2.11 0.00 3.79 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 1.99 2.01 0.00 9 L 8.72 4.26 0.00 1.66 1.69 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 10 E 9.45 3.79 0.00 1.99 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 2.37 2.31 0.00 11 N 8.19 4.40 0.00 2.67 2.88 0.00 0.00 6.97 7.78 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 12 L 7.52 4.11 0.00 1.74 1.60 1.10 1.05 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 13 G 7.06 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 0.00 0.00 0.00 0.00 14 D 7.85 4.97 0.00 2.73 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 15 V 7.94 3.90 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 0.72 0.00 0.00 0.94 0.00 0.00 16 G 8.87 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 0.00 0.00 0.00 17 Q 7.42 4.30 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 18 V 8.52 4.87 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 1.00 0.00 0.00 0.93 0.00 0.00 19 V 8.23 4.56 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 0.97 0.00 0.00 20 D 8.60 5.29 0.00 2.72 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 21 V 8.18 4.88 2.38 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 0.88 0.00 0.00 1.05 0.00 0.00 22 K 8.61 4.10 0.00 1.90 1.79 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.47 7.81 23 P 0.00 4.28 0.00 2.18 2.10 0.00 3.65 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 2.15 2.22 0.00 24 G 8.12 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 25 Y 7.89 4.47 0.00 3.01 3.25 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 26 A 7.83 4.18 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 27 R 7.96 4.02 0.00 1.95 1.98 0.00 3.22 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 28 N 8.38 4.97 0.00 2.85 2.83 0.00 0.00 6.68 7.22 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 29 Y 7.01 4.74 0.00 2.86 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 30 L 7.39 3.56 0.00 1.57 1.42 0.71 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.47 4.32 0.00 1.75 1.74 0.93 0.73 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 32 P 0.00 4.24 0.00 2.03 2.08 0.00 3.74 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 1.95 2.27 0.00 33 R 7.87 4.29 0.00 1.47 1.78 0.00 3.29 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 34 G 7.57 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 0.00 0.00 0.00 35 L 8.22 4.59 0.00 1.41 1.55 0.50 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.65 5.30 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 37 V 8.34 4.45 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 0.91 0.00 0.00 0.90 0.00 0.00 38 L 8.87 4.08 0.00 1.66 1.63 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.35 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 40 T 7.83 4.23 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 1.25 0.00 0.00 41 E 8.57 4.00 0.00 1.98 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 2.29 2.37 0.00 42 S 7.79 4.21 0.00 3.87 3.82 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 43 N 8.07 4.40 0.00 2.77 2.84 0.00 0.00 7.01 6.74 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 44 L 7.80 4.04 0.00 1.63 1.74 0.92 0.70 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 45 K 7.90 4.10 0.00 1.91 1.84 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.62 1.59 7.81 46 A 7.97 4.09 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 47 L 8.02 3.97 0.00 1.95 1.86 0.92 0.70 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 48 E 8.22 4.03 0.00 2.18 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 2.60 2.47 0.00 49 A 7.90 3.95 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 50 R 7.70 3.91 0.00 2.01 2.01 0.00 3.29 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.89 0.00 51 I 7.78 3.83 2.00 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 1.76 0.85 0.91 0.00 0.00 52 R 8.59 3.90 0.00 1.92 1.99 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 53 A 8.54 3.97 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 54 Q 8.27 3.95 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 55 A 8.30 4.20 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 56 K 8.54 4.16 0.00 2.01 2.07 0.00 1.31 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.77 1.44 7.81 57 R 8.08 3.91 0.00 2.07 2.03 0.00 3.08 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 58 L 7.70 4.43 0.00 1.73 1.74 0.93 0.67 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 59 A 8.29 4.09 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 60 E 7.88 4.35 0.00 2.15 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 2.24 2.33 0.00 61 R 7.51 4.01 0.00 2.16 2.01 0.00 3.19 0.00 0.00 3.12 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 62 K 8.27 3.83 0.00 1.52 1.71 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.26 0.99 7.81 63 A 7.30 4.16 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 64 E 7.91 4.17 0.00 2.20 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 2.28 2.37 0.00 65 A 7.71 4.29 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 66 E 7.59 4.20 0.00 2.42 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 2.26 2.38 0.00 67 R 7.77 4.03 0.00 2.16 1.94 0.00 3.38 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 68 L 7.81 4.09 0.00 1.71 1.69 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.50 4.03 0.00 1.90 1.95 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.53 7.81 70 E 7.70 4.14 0.00 2.11 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 2.56 2.45 0.00 71 I 7.42 4.13 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.38 0.91 0.00 0.00 72 L 7.80 3.97 0.00 1.92 1.67 0.82 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.01 4.38 0.00 2.17 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 2.23 2.45 0.00 74 N 7.46 5.00 0.00 2.69 2.79 0.00 0.00 6.72 7.73 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 75 L 7.63 4.58 0.00 1.55 1.49 0.92 0.79 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 76 T 8.34 4.44 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 77 L 8.10 4.60 0.00 1.75 1.68 0.93 1.04 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 78 T 8.24 4.43 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 79 I 8.78 4.25 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.97 0.93 0.00 0.00 80 P 0.00 4.47 0.00 1.93 2.01 0.00 3.63 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 2.01 2.07 0.00 81 V 8.26 4.39 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 0.78 0.00 0.00 0.99 0.00 0.00 82 R 8.25 4.60 0.00 1.70 1.49 0.00 2.21 0.00 0.00 2.51 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.14 0.00 83 A 8.10 4.83 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 84 G 9.05 3.75 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 0.00 85 E 8.50 4.62 0.00 1.93 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 2.22 2.25 0.00 86 T 7.93 4.53 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 1.25 0.00 0.00 87 K 7.92 4.82 0.00 1.71 1.81 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.65 1.48 7.81 88 I 7.69 3.95 1.93 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 1.35 0.81 1.07 0.00 0.00 89 Y 9.69 3.94 0.00 2.95 2.84 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 90 G 9.52 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 91 S 8.74 5.43 0.00 3.97 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 92 V 8.10 5.11 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 0.61 0.00 0.00 0.96 0.00 0.00 93 T 8.26 4.89 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 94 A 8.47 4.20 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 95 K 7.71 3.96 0.00 1.83 1.87 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.49 7.81 96 D 8.14 4.50 0.00 2.70 2.74 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 0.00 97 I 7.12 4.07 2.05 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 1.72 0.93 0.93 0.00 0.00 98 A 7.90 4.10 1.43 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 99 E 8.37 3.97 0.00 2.26 1.90 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 2.30 2.32 0.00 100 A 7.71 4.18 1.44 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 0.00 0.00 101 L 7.88 4.06 0.00 1.98 1.63 0.89 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 102 S 7.78 4.54 0.00 4.10 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 0.00 103 R 7.57 4.10 0.00 1.84 1.92 0.00 3.19 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 104 Q 7.90 4.11 0.00 2.16 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 105 H 8.41 4.63 0.00 3.09 3.26 0.00 5.84 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 0.00 106 G 7.42 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 0.00 0.00 0.00 107 I 7.65 3.67 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.10 0.91 0.00 0.00 108 T 8.36 4.59 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 0.00 109 I 7.81 4.69 1.27 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 1.34 0.67 0.56 0.00 0.00 110 D 8.89 4.94 0.00 2.86 2.68 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 0.00 0.00 0.00 0.00 111 P 0.00 4.57 0.00 2.21 2.34 0.00 3.81 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 2.02 2.02 0.00 112 K 8.06 4.16 0.00 1.77 1.89 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.41 7.81 113 R 7.88 3.71 0.00 0.69 1.69 0.00 3.22 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 114 L 7.55 4.16 0.00 2.03 1.72 1.01 1.50 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 0.00 115 A 8.59 4.31 1.26 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 0.00 0.00 0.00 116 L 7.61 4.40 0.00 1.56 1.51 0.88 0.97 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 0.00 117 E 8.70 4.44 0.00 2.07 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 2.15 2.23 0.00 118 K 7.86 4.01 0.00 1.69 1.71 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.42 7.81 119 P 0.00 4.52 0.00 1.97 2.01 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 120 I 8.02 3.53 1.97 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 1.02 0.94 0.97 0.00 0.00 121 K 8.54 5.11 0.00 1.92 1.68 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.40 7.81 122 E 8.27 4.69 0.00 1.96 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 2.35 2.43 0.00 123 L 9.03 4.43 0.00 1.66 1.71 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 124 G 7.76 3.63 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 0.00 0.00 0.00 125 E 7.92 4.66 0.00 2.08 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 2.03 2.16 0.00 126 Y 8.14 4.86 0.00 2.97 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 0.00 127 V 8.42 4.60 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 0.86 0.00 0.00 0.97 0.00 0.00 128 L 8.42 4.50 0.00 1.98 1.68 0.97 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 129 T 8.33 4.83 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 1.24 0.00 0.00 130 Y 9.49 4.89 0.00 3.00 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 0.00 131 K 7.23 4.85 0.00 1.56 1.56 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.26 7.81 132 P 0.00 4.38 0.00 2.16 2.34 0.00 3.81 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 2.21 2.65 0.00 133 H 7.83 4.94 0.00 3.18 3.12 0.00 5.88 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 0.00 134 P 0.00 4.22 0.00 1.98 2.04 0.00 3.10 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.98 0.00 135 E 8.11 4.64 0.00 2.06 2.02 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 2.32 2.35 0.00 136 V 7.37 4.36 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 0.84 0.00 0.00 0.94 0.00 0.00 137 P 0.00 4.81 0.00 2.00 1.99 0.00 3.70 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 2.03 2.12 0.00 138 I 8.62 4.54 1.99 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 1.28 0.95 1.02 0.00 0.00 139 Q 8.73 4.74 0.00 1.92 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 140 L 8.47 4.35 0.00 1.80 1.61 0.88 0.36 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 0.00 141 K 8.73 4.27 0.00 1.94 1.73 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.54 1.46 7.81 142 V 8.47 4.40 2.36 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 0.84 0.00 0.00 1.12 0.00 0.00 143 S 7.56 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 0.00 144 V 8.05 4.00 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 1.00 0.00 0.00 1.05 0.00 0.00 145 V 8.91 3.99 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 0.84 0.00 0.00 1.01 0.00 0.00