NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.6337 8.4249 119.2029 53.5876 40.4915 176.9671 3 L 4.4990 7.9692 112.0059 51.7676 40.7544 175.2412 4 R 4.0734 7.4833 119.5963 59.4089 31.0937 178.6035 5 T 3.8921 7.8338 110.3768 64.5097 68.9428 176.3242 6 Q 3.9730 8.0083 120.0880 58.9727 28.4280 178.3563 7 K 3.9147 7.6832 120.5018 58.8633 32.1819 178.8286 8 R 4.0196 7.8830 118.2773 60.9106 30.6195 177.2077 9 L 4.4331 7.8359 121.4608 54.5033 43.0586 176.5246 10 A 3.7530 8.5046 124.7168 53.5576 16.1764 178.2726 11 A 4.1651 8.4112 122.4394 55.5095 19.7048 177.8817 12 S 5.4509 8.9814 123.9541 59.9737 61.1977 179.8151 13 V 4.1162 8.6924 130.8688 61.8080 30.2372 175.3015 14 V 4.1482 8.3825 134.5498 64.5716 34.0546 173.5843 15 G 3.8758 8.6884 105.6926 45.9535 0.0000 172.9234 16 V 4.4336 7.5633 112.4005 58.6795 34.5830 175.3563 17 G 3.9533 8.1835 109.3521 44.9275 0.0000 175.0757 18 K 3.8566 8.4535 119.0704 59.1328 32.3751 179.3407 19 R 3.9088 8.0665 114.7127 58.4139 29.4712 176.9819 20 K 4.2775 7.1940 120.2688 54.6028 31.5082 175.1144 21 V 3.8567 7.6051 124.9620 60.1559 32.9414 174.7422 22 W 4.3438 9.1155 122.3679 56.5833 27.8839 173.7644 23 L 4.6578 8.0313 118.5276 53.8069 44.0898 174.2438 24 D 4.4053 8.3742 119.9797 56.6799 41.4375 176.1261 25 P 4.5852 0.0000 0.0000 62.2160 33.2030 176.1376 26 N 4.5621 8.9254 114.6650 53.6036 35.9394 174.4576 27 E 5.2607 7.3521 116.8811 54.2816 29.3261 175.4249 28 T 4.5672 7.6818 114.2209 63.3871 71.2469 176.1498 29 S 4.2068 8.0221 116.9683 61.0141 63.0482 173.6123 30 E 4.2217 7.9994 118.7527 56.4528 30.3115 173.4657 31 I 3.0274 9.2024 117.9974 63.4785 38.0560 170.0933 32 A 4.1233 9.0424 130.7972 51.4494 14.1910 177.8750 33 Q 4.2072 5.7400 129.3104 54.9765 30.4242 174.5787 34 A 4.6737 7.8576 130.0292 50.8127 18.7290 176.3348 35 N 4.5483 10.9700 117.6013 55.1487 37.5484 172.6993 36 S 4.6788 7.3613 109.3832 57.1072 65.4517 175.1376 37 R 3.8397 8.6818 125.9577 59.2468 30.1692 178.0192 38 N 4.4495 8.1929 114.2143 55.6250 37.4838 176.1061 39 A 4.0519 8.0672 121.6345 54.6876 18.5720 176.6296 40 I 4.2936 8.7812 118.9961 60.9007 36.0412 173.0762 41 R 3.6935 7.9881 122.7071 53.4896 28.5340 173.6543 42 K 4.3575 7.5089 132.9565 57.2499 35.0404 176.6129 43 L 4.0415 7.2757 118.7946 58.0271 40.8568 179.7458 44 V 3.5556 7.8317 118.8012 64.4552 31.7184 177.4361 45 K 3.8255 7.8677 120.4523 58.9995 32.1005 176.6573 46 N 4.3525 8.1651 121.5428 52.1795 37.4409 173.3283 47 G 3.7324 8.4059 114.9934 46.1855 0.0000 170.8240 48 T 4.5664 7.9720 116.9665 60.7876 69.8371 174.1493 49 I 2.5972 7.0057 120.9592 58.1342 37.3289 173.4149 50 V 3.5118 6.2586 121.0682 61.0320 34.5121 173.0802 51 K 5.1345 8.3005 127.2289 55.0464 36.4555 175.9109 52 K 4.0953 8.5256 124.1712 55.6370 36.7369 176.2423 53 A 3.6754 8.9068 113.2384 52.8734 15.3822 177.9837 54 V 3.9197 7.5616 119.6724 61.8903 32.8136 176.4038 55 T 4.2268 8.1383 111.7116 61.4111 69.6880 173.5944 56 V 4.5320 7.7474 120.8126 60.5898 34.7958 174.8028 57 H 4.4123 8.5845 119.0576 55.3576 29.0761 175.7971 58 S 4.0442 8.8871 117.1495 61.3651 62.9365 174.9891 59 K 3.9813 7.9183 118.4434 55.7910 30.4033 172.3166 60 S 4.6571 7.9683 123.3089 60.2406 70.0800 177.8881 61 R 4.0048 8.2066 117.6781 58.1199 30.2389 176.7342 62 T 4.4830 8.7347 112.8418 58.8713 69.4452 173.9348 63 R 5.1541 8.3391 132.2766 57.2255 27.6376 175.8524 64 A 4.0545 8.3086 122.7149 54.7171 19.7028 179.2658 65 H 4.3586 8.5412 110.2645 58.0392 28.7990 177.5073 66 A 3.9057 8.1269 121.8972 54.3360 18.3062 177.3726 67 Q 4.4255 8.0558 116.6582 53.5528 26.8479 175.0121 68 S 4.7030 7.7845 124.9852 59.1069 66.3133 178.9906 69 K 4.3346 7.6847 120.8419 55.6953 32.8964 178.0702 70 R 4.0167 9.2974 119.8221 56.4870 28.6878 174.7242 71 E 4.6726 7.6133 114.7802 55.0615 32.9472 174.4655 72 G 3.7400 8.4810 111.8369 44.0436 0.0000 173.2899 73 R 4.9002 9.5863 125.4928 56.2821 32.0917 173.3066 74 H 4.0894 8.3126 114.9025 56.6151 26.5971 174.2533 75 S 4.3949 7.9991 112.9887 56.9414 65.5555 170.1942 76 G 3.8268 7.3167 103.8096 45.0292 0.0000 171.7771 77 Y 4.5121 8.5590 122.2900 57.3987 40.1344 177.2661 78 G 3.8655 9.0580 118.5700 45.3679 0.0000 172.4753 79 K 4.3380 7.4461 122.8313 56.9472 39.4685 175.1493 80 R 3.9500 8.0566 118.4424 56.1374 30.4329 175.3669 81 K 4.5019 8.4956 123.3653 55.3253 35.4373 176.2431 82 G 4.0254 8.5885 102.7540 45.9279 0.0000 173.4358 83 T 4.3298 7.8249 113.1529 60.8324 69.4637 173.8150 84 R 3.9527 8.5950 120.2870 59.4877 30.1845 177.0212 85 E 4.1494 7.8892 117.5742 56.1856 30.7098 176.4702 86 A 3.9691 9.4504 120.6089 52.2484 17.5218 178.4695 87 R 4.4812 7.8556 113.9038 56.0618 34.7441 175.1478 88 L 3.6059 8.5720 121.4122 56.3129 38.8938 172.2093 89 P 4.5238 0.0000 0.0000 62.8813 32.9152 176.1953 90 S 4.7024 8.3110 114.8771 57.6985 64.9873 174.1750 91 Q 3.8926 9.0821 115.2103 56.9640 26.1459 174.5504 92 V 4.7289 7.8354 109.8710 63.0709 39.1495 177.3699 93 V 3.6357 7.8575 118.3402 65.6223 31.6530 178.0803 94 W 4.3743 8.5425 128.6521 59.6339 30.7374 175.9180 95 I 3.5058 6.8112 112.5353 58.4036 35.5470 174.0105 96 R 4.4853 8.4106 124.7817 57.1945 35.7783 174.6954 97 R 4.4027 7.2072 114.2441 54.2207 34.1194 174.1385 98 L 3.4575 7.7079 118.1144 54.5543 39.6759 174.0305 99 R 4.9727 6.9625 133.2868 57.2359 30.9003 176.2909 100 V 3.6396 6.9785 111.0812 64.2056 31.3436 178.4759 101 L 3.8268 7.5328 117.1863 57.8041 41.5882 179.0108 102 R 3.8283 7.7674 116.7746 59.2798 30.2775 178.0300 103 R 4.0807 7.5433 117.2632 58.8884 30.1449 177.4888 104 L 4.8925 7.6529 117.2426 54.1292 43.0961 177.5460 105 L 4.8395 8.1113 115.7709 53.1465 43.1506 176.7786 106 A 4.7381 8.2280 118.2679 52.3343 23.5433 177.4676 107 K 4.4551 8.1949 115.5988 56.1283 33.5358 174.8545 108 Y 4.6943 7.8355 115.3508 57.6429 40.3130 175.1934 109 R 3.8478 8.6186 121.1285 54.0351 27.8364 174.9146 110 D 5.0215 7.7127 129.1086 55.4360 41.8827 177.5384 111 A 3.9419 7.6439 121.6388 54.0855 18.4109 178.5869 112 G 4.0668 8.4354 101.5161 45.1397 0.0000 174.4645 113 K 4.0928 8.1173 120.5684 58.6467 32.3403 176.5130 114 I 4.4502 7.6790 118.4046 58.9422 38.9452 174.6989 115 D 4.4568 8.4310 128.1715 54.6759 41.1177 177.4009 116 K 5.6236 7.0149 133.1348 58.3135 32.8615 174.7380 117 H 5.0219 7.8466 116.4584 55.8210 30.9737 174.7651 118 L 4.9007 8.3188 117.0474 54.4112 41.8554 176.1151 119 Y 4.7062 7.9467 117.7781 57.7643 40.1384 177.5521 120 H 3.0583 7.1499 119.9553 58.6044 29.7362 177.1545 121 V 3.5432 6.8867 118.5888 66.1561 31.7889 177.9092 122 L 4.1438 7.8715 117.7707 57.2142 41.2444 178.6151 123 Y 3.0672 7.5741 119.0539 59.9753 38.5625 177.8472 124 K 4.9463 7.6388 116.2209 56.0794 33.1640 176.4315 125 E 4.7397 7.7277 118.3338 55.7548 30.0237 177.4094 126 S 4.9546 7.8685 110.7071 56.8802 65.2446 173.9495 127 K 4.5093 7.2760 122.3031 55.4254 31.7259 176.2359 128 G 4.1559 8.1857 98.6905 45.5315 0.0000 172.9422 129 N 3.8928 8.9298 112.2830 53.8648 36.4138 174.9941 130 A 4.4221 8.2996 121.5773 51.3144 19.3044 176.6419 131 F 4.6899 6.9916 116.2627 57.7725 38.5725 172.5941 132 K 4.1974 8.1950 119.3401 57.0027 34.2263 175.9286 133 H 5.1324 7.7651 115.4294 53.2376 33.8992 174.1686 134 K 3.9657 8.4166 119.4660 59.9905 32.1532 179.1194 135 R 3.9332 8.1619 116.7159 59.0289 29.3956 178.5035 136 A 4.0730 8.0924 121.1120 54.6176 18.4221 179.1214 137 L 4.0086 8.1733 119.0490 58.4108 42.1211 179.4241 138 V 3.4242 8.2002 118.4256 65.8541 31.2150 177.5430 139 E 3.8955 8.3818 118.6568 59.5716 29.5946 178.2621 140 H 4.3553 7.9957 113.9955 58.5458 28.5778 177.2267 141 I 3.6296 7.1032 121.9197 63.2297 37.0269 176.0156 142 I 3.5397 7.6888 123.7447 61.7644 37.5071 173.2816 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 2 N 8.42 4.63 0.00 2.69 1.86 0.00 0.00 6.90 6.89 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 3 L 7.97 4.50 0.00 1.64 1.60 0.97 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 4 R 7.48 4.07 0.00 2.05 2.15 0.00 3.00 0.00 0.00 3.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 5 T 7.83 3.89 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 1.20 0.00 0.00 6 Q 8.01 3.97 0.00 2.39 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 7 K 7.68 3.91 0.00 1.63 2.07 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.24 1.49 7.81 8 R 7.88 4.02 0.00 2.04 1.97 0.00 3.34 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 9 L 7.84 4.43 0.00 1.78 1.59 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.50 3.75 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 11 A 8.41 4.17 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 12 S 8.98 5.45 0.00 4.20 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.69 4.12 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 0.77 0.00 0.00 0.95 0.00 0.00 14 V 8.38 4.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.43 0.00 0.00 15 G 8.69 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 16 V 7.56 4.43 2.20 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 0.86 0.00 0.00 1.16 0.00 0.00 17 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 18 K 8.45 3.86 0.00 1.71 1.82 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.34 7.81 19 R 8.07 3.91 0.00 1.86 2.03 0.00 3.05 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 20 K 7.19 4.28 0.00 2.10 1.90 0.00 1.78 0.00 0.00 1.81 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.40 7.81 21 V 7.61 3.86 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 0.34 0.00 0.00 -2.20 0.00 0.00 22 W 9.12 4.34 0.00 3.48 3.74 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 23 L 8.03 4.66 0.00 1.51 1.57 0.90 1.19 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 24 D 8.37 4.41 0.00 2.83 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.59 0.00 2.10 2.02 0.00 3.82 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 2.03 2.08 0.00 26 N 8.93 4.56 0.00 3.03 3.11 0.00 0.00 5.71 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 27 E 7.35 5.26 0.00 1.92 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 2.49 2.44 0.00 28 T 7.68 4.57 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 29 S 8.02 4.21 0.00 3.86 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 30 E 8.00 4.22 0.00 2.17 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 0.00 2.39 2.25 0.00 31 I 9.20 3.03 1.97 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 1.43 0.56 1.03 0.00 0.00 32 A 9.04 4.12 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 33 Q 5.74 4.21 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 34 A 7.86 4.67 0.98 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 35 N 10.97 4.55 0.00 2.89 3.03 0.00 0.00 6.56 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 36 S 7.36 4.68 0.00 3.85 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 37 R 8.68 3.84 0.00 1.83 2.00 0.00 3.33 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 38 N 8.19 4.45 0.00 2.83 2.96 0.00 0.00 5.97 7.26 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 39 A 8.07 4.05 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 40 I 8.78 4.29 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 1.37 0.58 1.09 0.00 0.00 41 R 7.99 3.69 0.00 2.06 2.13 0.00 3.42 0.00 0.00 3.11 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.33 0.00 42 K 7.51 4.36 0.00 1.91 1.91 0.00 1.72 0.00 0.00 1.86 0.00 0.00 3.15 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.24 1.15 7.81 43 L 7.28 4.04 0.00 1.90 1.92 0.99 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.83 3.56 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 0.63 0.00 0.00 0.76 0.00 0.00 45 K 7.87 3.83 0.00 1.69 2.06 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.39 7.81 46 N 8.17 4.35 0.00 2.66 2.72 0.00 0.00 7.25 8.11 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 47 G 8.41 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 48 T 7.97 4.57 4.38 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 1.27 0.00 0.00 49 I 7.01 2.60 1.59 0.00 0.00 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 1.33 1.02 0.53 0.00 0.00 50 V 6.26 3.51 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 0.60 0.00 0.00 0.61 0.00 0.00 51 K 8.30 5.13 0.00 2.47 2.09 0.00 1.82 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.40 1.57 7.81 52 K 8.53 4.10 0.00 1.87 1.37 0.00 1.82 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.27 1.33 7.81 53 A 8.91 3.68 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 54 V 7.56 3.92 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 0.79 0.00 0.00 0.94 0.00 0.00 55 T 8.14 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 1.21 0.00 0.00 56 V 7.75 4.53 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 0.80 0.00 0.00 0.92 0.00 0.00 57 H 8.58 4.41 0.00 3.31 3.29 0.00 5.59 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.89 4.04 0.00 4.00 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 59 K 7.92 3.98 0.00 2.00 2.05 0.00 1.03 0.00 0.00 0.61 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.33 1.50 7.81 60 S 7.97 4.66 0.00 3.81 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 61 R 8.21 4.00 0.00 1.78 1.96 0.00 3.30 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 62 T 8.73 4.48 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 63 R 8.34 5.15 0.00 2.12 2.02 0.00 3.32 0.00 0.00 3.33 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.30 0.00 64 A 8.31 4.05 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 65 H 8.54 4.36 0.00 3.15 3.38 0.00 5.65 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.13 3.91 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 67 Q 8.06 4.43 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.96 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 68 S 7.78 4.70 0.00 4.14 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 69 K 7.68 4.33 0.00 1.89 1.83 0.00 1.67 0.00 0.00 1.85 0.00 0.00 3.16 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.38 7.81 70 R 9.30 4.02 0.00 1.99 2.26 0.00 3.29 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 71 E 7.61 4.67 0.00 1.94 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 2.41 0.00 72 G 8.48 3.74 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 0.00 0.00 0.00 73 R 9.59 4.90 0.00 2.18 1.98 0.00 3.28 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.37 0.00 74 H 8.31 4.09 0.00 3.27 3.34 0.00 5.67 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.00 4.39 0.00 3.93 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 76 G 7.32 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 77 Y 8.56 4.51 0.00 2.91 2.92 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 78 G 9.06 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 79 K 7.45 4.34 0.00 1.62 1.73 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.46 1.41 7.81 80 R 8.06 3.95 0.00 1.82 1.84 0.00 3.47 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 81 K 8.50 4.50 0.00 1.86 1.78 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.33 7.81 82 G 8.59 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 83 T 7.82 4.33 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 1.31 0.00 0.00 84 R 8.60 3.95 0.00 1.82 1.96 0.00 3.47 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 85 E 7.89 4.15 0.00 2.02 1.84 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 2.40 2.26 0.00 86 A 9.45 3.97 1.46 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 0.00 0.00 87 R 7.86 4.48 0.00 1.76 1.82 0.00 3.33 0.00 0.00 3.52 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 88 L 8.57 3.61 0.00 1.89 1.77 0.95 0.73 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 89 P 0.00 4.52 0.00 2.26 2.04 0.00 3.61 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 2.14 2.09 0.00 90 S 8.31 4.70 0.00 4.04 4.05 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 91 Q 9.08 3.89 0.00 2.28 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.84 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 92 V 7.84 4.73 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 0.92 0.00 0.00 1.04 0.00 0.00 93 V 7.86 3.64 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 0.99 0.00 0.00 1.03 0.00 0.00 94 W 8.54 4.37 0.00 3.38 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 I 6.81 3.51 1.25 0.00 0.00 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 0.94 0.73 -1.64 0.00 0.00 96 R 8.41 4.49 0.00 1.69 2.00 0.00 3.22 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 97 R 7.21 4.40 0.00 2.01 1.70 0.00 3.55 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 1.50 1.51 0.00 98 L 7.71 3.46 0.00 1.63 1.61 1.48 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 99 R 6.96 4.97 0.00 1.63 1.69 0.00 3.11 0.00 0.00 3.13 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.23 0.00 100 V 6.98 3.64 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.80 0.00 0.00 101 L 7.53 3.83 0.00 1.20 1.41 0.82 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.77 3.83 0.00 1.68 1.90 0.00 3.55 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.71 0.00 103 R 7.54 4.08 0.00 2.10 2.02 0.00 3.11 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 104 L 7.65 4.89 0.00 1.71 1.88 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.11 4.84 0.00 1.83 1.85 0.96 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 106 A 8.23 4.74 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 0.00 107 K 8.19 4.46 0.00 1.70 1.54 0.00 1.61 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.21 1.32 7.81 108 Y 7.84 4.69 0.00 3.09 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 0.00 109 R 8.62 3.85 0.00 2.02 1.85 0.00 2.83 0.00 0.00 2.25 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.18 0.00 110 D 7.71 5.02 0.00 2.85 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.64 3.94 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 0.00 112 G 8.44 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 0.00 0.00 0.00 113 K 8.12 4.09 0.00 1.94 2.25 0.00 1.86 0.00 0.00 1.89 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.52 7.81 114 I 7.68 4.45 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 1.65 1.26 1.15 0.00 0.00 115 D 8.43 4.46 0.00 2.74 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.01 5.62 0.00 1.95 1.79 0.00 0.96 0.00 0.00 1.46 0.00 0.00 2.93 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.09 1.18 7.81 117 H 7.85 5.02 0.00 3.25 3.33 0.00 5.59 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 8.32 4.90 0.00 1.68 1.71 1.03 0.83 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 0.00 119 Y 7.95 4.71 0.00 3.34 3.28 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 0.00 120 H 7.15 3.06 0.00 2.62 3.04 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 6.89 3.54 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 0.98 0.00 0.00 122 L 7.87 4.14 0.00 1.78 1.74 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 7.57 3.07 0.00 3.21 3.17 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 0.00 124 K 7.64 4.95 0.00 1.81 1.85 0.00 1.87 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.57 1.65 7.81 125 E 7.73 4.74 0.00 2.11 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 2.15 2.22 0.00 126 S 7.87 4.95 0.00 3.72 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 0.00 127 K 7.28 4.51 0.00 1.76 1.84 0.00 1.94 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.49 1.47 7.81 128 G 8.19 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 0.00 0.00 0.00 0.00 129 N 8.93 3.89 0.00 2.80 2.76 0.00 0.00 6.90 7.35 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 0.00 130 A 8.30 4.42 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 0.00 131 F 6.99 4.69 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 0.00 132 K 8.20 4.20 0.00 1.69 1.80 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.36 1.39 7.81 133 H 7.77 5.13 0.00 3.19 3.16 0.00 5.73 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 0.00 134 K 8.42 3.97 0.00 2.01 1.99 0.00 1.59 0.00 0.00 1.89 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.55 7.81 135 R 8.16 3.93 0.00 2.08 2.27 0.00 2.96 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 136 A 8.09 4.07 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 8.17 4.01 0.00 1.88 1.96 0.85 0.94 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 0.00 138 V 8.20 3.42 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 0.96 0.00 0.00 0.96 0.00 0.00 139 E 8.38 3.90 0.00 1.96 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 2.32 0.00 140 H 8.00 4.36 0.00 3.35 3.43 0.00 5.63 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.10 3.63 1.85 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 1.31 0.47 0.74 0.00 0.00 142 I 7.69 3.54 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 1.39 0.62 0.90 0.00 0.00