NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5023 8.3049 120.3470 55.1759 34.3002 174.2093 2 L 3.8735 9.2024 120.3586 54.6042 40.4067 174.7506 3 T 4.0786 9.0417 123.9778 62.8625 72.6708 171.5615 4 D 4.5562 7.1183 118.4822 51.7335 42.6949 173.7622 5 P 4.2757 0.0000 0.0000 65.4539 31.6668 177.4368 6 I 3.5088 7.7732 117.5287 64.6777 36.9978 177.9621 7 A 3.9611 8.9108 121.3766 55.2665 18.2694 178.8447 8 D 4.4208 8.3644 118.2202 57.1253 41.2627 178.5865 9 M 3.9991 8.1272 118.3017 58.6868 32.3225 178.2648 10 L 4.0638 8.0127 119.2606 57.4386 41.5082 179.5506 11 T 3.9838 8.3370 110.3904 64.6525 68.9390 177.1372 12 R 3.8838 8.3961 121.5124 58.7853 30.0016 178.6474 13 I 4.1717 7.6179 118.4270 63.1095 37.2714 177.4685 14 R 4.0763 7.5492 116.2329 56.8754 29.6866 176.4073 15 N 4.8851 8.1595 111.5497 51.7036 42.4028 175.2321 16 A 4.5220 7.4670 119.6432 53.9427 20.3561 178.7818 17 T 4.6575 7.6249 108.5958 64.7704 68.6360 176.2975 18 R 3.4608 7.8213 119.4656 58.4478 30.1828 178.4401 19 V 3.9796 6.9070 107.5053 59.9318 32.2884 173.9651 20 Y 3.6449 7.2281 120.8175 58.0124 36.3363 169.6353 21 K 4.1015 8.7620 125.6790 56.2453 31.4276 175.8622 22 E 4.8723 8.2432 130.3529 56.3895 37.4300 175.9465 23 S 5.1280 8.0067 114.3122 56.8507 66.7303 172.5336 24 T 4.5263 8.8228 115.4226 61.0133 70.7425 172.2678 25 D 5.8500 9.1498 129.3649 52.0293 41.0488 174.7260 26 V 4.1064 7.8870 121.7604 59.3889 33.1478 174.3517 27 P 3.8676 0.0000 0.0000 62.6131 32.3792 176.2315 28 A 4.7127 9.4433 125.7384 51.7476 18.3901 178.2034 29 S 4.3351 7.5541 113.8372 59.1814 64.0238 175.6261 30 R 3.8650 8.7267 121.4347 59.5963 29.9149 178.8753 31 F 4.2458 8.3234 117.7425 60.7102 39.5085 175.2111 32 K 4.6356 7.5903 120.0814 54.8856 33.0334 175.6808 33 E 4.4607 7.8331 118.1294 55.6481 34.5645 175.4463 34 E 4.0277 7.7335 120.5335 59.2945 29.4941 178.2200 35 I 3.6482 7.5981 120.2960 64.0068 37.4888 178.0532 36 L 4.2526 7.3528 119.5376 57.6976 41.1074 179.3608 37 R 4.1508 7.9749 119.5540 58.6214 29.9789 177.1115 38 I 4.1229 7.7258 117.2811 61.7004 36.9884 175.9915 39 L 3.7633 7.6379 121.0735 54.6677 41.6266 176.9721 40 A 5.3395 7.3150 114.4016 52.1238 20.2300 175.1371 41 R 4.5481 8.3848 120.0792 56.2800 32.7159 175.4752 42 E 4.4597 9.1035 114.6983 55.4162 31.0720 174.8733 43 G 3.1321 6.1780 110.7849 44.6609 0.0000 172.4813 44 F 4.8613 7.4604 123.7119 57.3252 42.7919 175.5999 45 I 4.6711 7.0521 114.4594 59.9359 41.2938 176.4288 46 K 4.2785 8.5196 118.8072 56.6525 32.8172 177.0418 47 G 3.6070 7.2014 104.3962 44.0217 0.0000 171.8862 48 Y 4.8372 7.2628 120.0461 56.9041 41.0265 172.8389 49 E 4.9054 8.3421 117.5176 54.5019 33.7415 176.1522 50 R 4.4849 8.5962 120.2104 56.3405 31.3580 176.6143 51 V 4.3407 7.8312 119.3575 62.4177 33.8946 174.6228 52 D 4.4668 8.4825 120.1770 54.1473 42.8782 175.4711 53 V 4.1468 7.8722 124.4589 61.9977 31.9828 171.0345 54 D 4.1624 9.2017 124.2604 54.2706 38.7724 175.2140 55 G 3.8126 8.8246 113.8832 46.0504 0.0000 172.8770 56 K 4.3644 8.7774 126.0448 54.4935 33.2845 176.1668 57 P 4.7293 0.0000 0.0000 62.1523 33.0463 175.3374 58 Y 4.7390 8.5676 122.3601 57.6086 39.4190 178.1580 59 L 4.1439 8.3179 126.0428 55.1825 45.6120 175.5266 60 R 4.4806 8.1380 127.3910 55.8016 28.1549 177.6815 61 V 3.5547 7.5152 120.0097 63.4034 33.1601 175.6442 62 Y 5.0788 7.5761 121.6624 56.7749 40.6026 175.6736 63 L 4.4456 8.2258 120.1046 53.0478 42.3294 175.8327 64 K 4.2048 8.0914 124.1778 55.1512 33.4760 173.7160 65 Y 4.5790 9.3409 121.4411 56.5930 40.2213 177.8419 66 G 4.3411 7.6398 110.1278 46.1075 0.0000 168.7634 67 P 4.8157 0.0000 0.0000 63.1713 30.6625 174.8291 68 R 4.9300 8.1247 116.2578 53.5379 34.2542 174.2274 69 R 4.6491 8.1559 117.1125 55.2615 34.0694 175.3945 70 Q 4.0409 8.7882 123.5741 54.6621 29.3156 177.0280 71 G 3.6219 8.4552 111.2844 44.5558 0.0000 169.8565 72 P 4.0280 0.0000 0.0000 63.6397 30.9068 172.0055 73 D 4.3491 8.7411 131.8527 52.6742 40.0091 172.0197 74 P 4.6949 0.0000 0.0000 62.8020 32.0629 175.9217 75 R 4.5317 8.2771 120.8401 53.8393 35.0746 172.4365 76 P 4.4454 0.0000 0.0000 62.8257 31.5516 176.2858 77 E 4.1840 9.0009 126.2067 56.4537 30.6682 176.1808 78 Q 4.6267 8.4302 122.7691 54.1790 30.7849 175.4829 79 V 3.6847 8.2384 124.9737 65.3032 31.7616 176.2722 80 I 4.5503 7.5971 118.4915 59.8028 38.9081 174.7414 81 H 4.7639 8.2929 122.3780 56.0629 31.5407 172.5180 82 H 4.7554 7.4818 113.6645 54.5621 32.7827 171.9142 83 I 3.9774 7.3345 117.3842 60.6908 40.1116 173.5175 84 R 4.4623 8.4608 122.7568 55.5282 31.8662 173.8610 85 R 4.0341 8.8262 126.2175 57.3198 30.2523 175.9417 86 I 4.1468 9.0094 126.3439 62.3707 38.5150 176.6702 87 S 4.5806 7.5316 116.0654 56.3427 60.5921 173.3441 88 K 4.1843 7.6051 123.9209 54.6757 33.0513 174.9540 89 P 4.2151 0.0000 0.0000 64.6173 31.5041 175.2056 90 G 4.3392 9.2218 117.5411 45.9980 0.0000 174.6277 91 R 4.3119 7.0461 120.5638 54.6216 29.0814 176.3551 92 R 4.0746 7.5614 118.8599 56.7046 31.8816 176.5262 93 V 4.4836 8.2639 123.7752 61.5699 34.8851 173.9895 94 Y 5.7587 8.5434 124.1492 55.3244 41.4308 175.2092 95 V 4.2146 8.4323 115.9389 60.8448 33.6688 173.5462 96 G 4.2591 8.5659 113.0481 45.2959 0.0000 172.9104 97 V 3.6216 8.5073 117.9967 64.8354 31.2049 177.8341 98 K 4.1562 7.9413 119.7589 57.8771 32.0067 178.1149 99 E 4.4617 7.6950 116.9219 56.4656 29.2982 176.3651 100 I 4.0509 7.1869 120.4479 60.1815 37.5482 174.3681 101 P 4.3774 0.0000 0.0000 63.5329 31.6653 176.1483 102 R 4.7816 8.3269 118.4206 55.6706 31.8048 174.9903 103 V 3.6500 7.8519 116.8994 64.5914 32.0377 176.7455 104 R 3.7913 8.9560 121.2971 55.9144 28.7448 175.3611 105 R 3.8110 8.6894 116.3691 56.9781 28.1793 176.0229 106 G 4.1847 8.1244 105.7387 45.4826 0.0000 171.7703 107 L 4.4972 7.4162 121.9274 55.1130 40.1451 180.5614 108 G 4.2598 9.2290 113.3450 44.1056 0.0000 173.0104 109 I 3.8915 7.5018 113.7768 61.4797 38.3836 176.9265 110 A 4.6045 8.1505 124.2680 50.2967 18.8980 175.9312 111 I 4.1260 7.9902 121.3642 61.6303 38.2245 175.8917 112 L 4.8016 7.9776 122.3263 52.5389 45.5235 176.3894 113 S 4.2528 8.7452 116.8582 58.6184 60.9811 173.7026 114 T 4.1046 8.6174 118.1059 61.8705 68.6892 175.4441 115 S 4.3846 9.0493 117.5890 60.5875 63.2325 173.4352 116 K 4.5159 7.3177 120.7610 54.6939 32.0513 178.0210 117 G 3.9116 8.6071 115.6209 45.6746 0.0000 172.3456 118 V 4.3864 8.1756 123.2977 61.1344 34.1588 174.4522 119 L 4.6651 8.1474 125.5649 53.4553 45.8693 175.4710 120 T 4.3768 8.2008 111.4291 60.8341 70.3946 175.3534 121 D 4.4320 8.5427 120.3419 56.1504 39.8241 178.7713 122 R 4.0369 8.0633 117.3527 57.9358 30.0994 176.4292 123 E 4.4992 7.5616 115.0486 55.6040 31.4438 176.1823 124 A 4.3521 7.7769 122.3295 50.9189 16.8929 177.9822 125 R 4.5856 6.9234 118.3046 54.0084 31.9679 174.0163 126 K 4.3765 7.2326 110.1791 55.4807 33.5978 173.7266 127 L 4.2864 8.4701 121.6312 53.8968 44.9519 170.8001 128 G 3.6659 8.5193 110.0993 46.0724 0.0000 172.5265 129 V 4.7972 7.3810 118.4136 57.7032 35.3634 174.3046 130 G 3.8959 8.7916 106.8443 46.6843 0.0000 175.6925 131 G 4.4162 7.8380 122.2152 44.7386 0.0000 177.0905 132 E 4.4435 8.5628 128.6145 54.1103 30.8859 174.3757 133 L 4.8282 7.7795 119.0929 53.2070 45.5413 174.7255 134 I 4.2541 7.5802 119.7545 60.5891 39.7651 175.4309 135 C 4.7974 7.9773 112.5532 57.8023 32.6048 174.6806 136 E 4.3068 8.7891 123.5771 56.0904 30.2325 176.2746 137 V 4.6255 8.2383 119.3566 61.0324 34.3641 175.4525 138 W 4.7409 8.7993 122.9165 56.7262 28.2268 174.8318 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 8.30 4.50 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.54 0.00 2 L 9.20 3.87 0.00 1.77 1.39 0.91 0.42 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 3 T 9.04 4.08 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 4 D 7.12 4.56 0.00 2.66 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.28 0.00 2.47 2.28 0.00 3.86 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 6 I 7.77 3.51 1.76 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.75 0.79 0.00 0.00 7 A 8.91 3.96 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 8 D 8.36 4.42 0.00 2.97 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 9 M 8.13 4.00 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 10 L 8.01 4.06 0.00 1.73 1.69 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.34 3.98 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 1.22 0.00 0.00 12 R 8.40 3.88 0.00 1.95 2.03 0.00 3.11 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 13 I 7.62 4.17 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 1.39 0.71 0.91 0.00 0.00 14 R 7.55 4.08 0.00 2.11 1.96 0.00 3.20 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 15 N 8.16 4.89 0.00 2.69 2.74 0.00 0.00 6.70 7.46 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 16 A 7.47 4.52 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 17 T 7.62 4.66 4.54 0.00 0.00 0.00 0.00 0.00 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 18 R 7.82 3.46 0.00 1.60 1.82 0.00 3.16 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.60 0.00 19 V 6.91 3.98 2.05 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 0.67 0.00 0.00 0.99 0.00 0.00 20 Y 7.23 3.64 0.00 3.05 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 21 K 8.76 4.10 0.00 1.82 1.63 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.38 7.81 22 E 8.24 4.87 0.00 2.07 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 2.32 0.00 23 S 8.01 5.13 0.00 4.02 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.82 4.53 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 25 D 9.15 5.85 0.00 2.62 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 26 V 7.89 4.11 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 0.56 0.00 0.00 0.90 0.00 0.00 27 P 0.00 3.87 0.00 1.89 1.73 0.00 3.42 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 1.49 0.00 28 A 9.44 4.71 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 7.55 4.34 0.00 3.94 3.94 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 30 R 8.73 3.87 0.00 1.95 2.08 0.00 3.32 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.59 0.00 31 F 8.32 4.25 0.00 2.80 3.10 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 32 K 7.59 4.64 0.00 1.70 1.63 0.00 1.76 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.35 7.81 33 E 7.83 4.46 0.00 1.80 1.92 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 2.13 1.90 0.00 34 E 7.73 4.03 0.00 2.16 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 2.29 2.36 0.00 35 I 7.60 3.65 1.77 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.33 0.80 0.00 0.00 36 L 7.35 4.25 0.00 1.89 1.79 0.53 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.97 4.15 0.00 1.91 1.97 0.00 3.12 0.00 0.00 3.08 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 38 I 7.73 4.12 1.67 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 1.25 0.75 0.85 0.00 0.00 39 L 7.64 3.76 0.00 1.93 1.71 0.97 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.31 5.34 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 41 R 8.38 4.55 0.00 2.13 2.08 0.00 3.30 0.00 0.00 3.28 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 42 E 9.10 4.46 0.00 1.80 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 2.21 2.21 0.00 43 G 6.18 3.13 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 44 F 7.46 4.86 0.00 3.16 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 I 7.05 4.67 2.01 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.96 1.06 0.00 0.00 46 K 8.52 4.28 0.00 1.79 1.89 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.74 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.43 7.81 47 G 7.20 3.61 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 0.00 0.00 0.00 48 Y 7.26 4.84 0.00 2.87 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 49 E 8.34 4.91 0.00 1.97 1.93 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 2.54 2.38 0.00 50 R 8.60 4.48 0.00 1.74 1.89 0.00 3.19 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 51 V 7.83 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 0.84 0.00 0.00 0.96 0.00 0.00 52 D 8.48 4.47 0.00 2.65 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 53 V 7.87 4.15 2.32 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 0.90 0.00 0.00 0.90 0.00 0.00 54 D 9.20 4.16 0.00 2.86 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 55 G 8.82 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 56 K 8.78 4.36 0.00 1.60 1.75 0.00 1.62 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.47 7.81 57 P 0.00 4.73 0.00 2.14 2.37 0.00 3.68 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 58 Y 8.57 4.74 0.00 2.80 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 59 L 8.32 4.14 0.00 1.74 1.26 0.70 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.14 4.48 0.00 1.59 1.78 0.00 3.38 0.00 0.00 3.30 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 61 V 7.52 3.55 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 1.03 0.00 0.00 0.72 0.00 0.00 62 Y 7.58 5.08 0.00 3.05 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 63 L 8.23 4.45 0.00 1.95 1.65 1.02 1.02 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 64 K 8.09 4.20 0.00 1.74 1.95 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.39 7.81 65 Y 9.34 4.58 0.00 3.04 3.10 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 66 G 7.64 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.82 0.00 2.22 1.98 0.00 3.66 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.98 0.00 68 R 8.12 4.93 0.00 1.62 1.81 0.00 3.21 0.00 0.00 2.25 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.42 0.00 69 R 8.16 4.65 0.00 1.62 1.77 0.00 3.20 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 70 Q 8.79 4.04 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.13 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 71 G 8.46 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 0.00 0.00 0.00 72 P 0.00 4.03 0.00 2.19 2.12 0.00 3.89 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 1.99 0.00 73 D 8.74 4.35 0.00 2.85 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 74 P 0.00 4.69 0.00 2.02 2.02 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 75 R 8.28 4.53 0.00 1.68 1.73 0.00 3.17 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 76 P 0.00 4.45 0.00 1.33 1.68 0.00 2.76 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.54 0.00 77 E 9.00 4.18 0.00 1.95 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 2.34 2.31 0.00 78 Q 8.43 4.63 0.00 2.06 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.79 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 79 V 8.24 3.68 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 0.62 0.00 0.00 0.93 0.00 0.00 80 I 7.60 4.55 1.92 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.75 1.01 0.00 0.00 81 H 8.29 4.76 0.00 2.95 3.30 0.00 5.92 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.48 4.76 0.00 2.93 3.12 0.00 5.99 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.33 3.98 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.54 0.91 0.00 0.00 84 R 8.46 4.46 0.00 1.84 1.87 0.00 3.35 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.45 0.00 85 R 8.83 4.03 0.00 1.76 1.83 0.00 3.20 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 86 I 9.01 4.15 1.85 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 1.19 1.02 0.90 0.00 0.00 87 S 7.53 4.58 0.00 3.70 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 88 K 7.61 4.18 0.00 1.90 1.71 0.00 1.81 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.52 1.48 7.81 89 P 0.00 4.22 0.00 2.21 2.13 0.00 3.75 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 2.00 2.07 0.00 90 G 9.22 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.05 4.31 0.00 1.76 1.88 0.00 3.44 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 92 R 7.56 4.07 0.00 1.92 1.94 0.00 3.25 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 93 V 8.26 4.48 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 0.91 0.00 0.00 0.96 0.00 0.00 94 Y 8.54 5.76 0.00 2.81 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 95 V 8.43 4.21 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 0.76 0.00 0.00 1.02 0.00 0.00 96 G 8.57 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 0.00 0.00 0.00 0.00 97 V 8.51 3.62 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 0.76 0.00 0.00 0.94 0.00 0.00 98 K 7.94 4.16 0.00 1.85 1.90 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.46 7.81 99 E 7.70 4.46 0.00 2.32 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 2.33 2.29 0.00 100 I 7.19 4.05 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.79 0.92 0.00 0.00 101 P 0.00 4.38 0.00 2.18 2.07 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 102 R 8.33 4.78 0.00 1.84 1.89 0.00 3.17 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 103 V 7.85 3.65 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 0.84 0.00 0.00 0.93 0.00 0.00 104 R 8.96 3.79 0.00 2.08 2.10 0.00 3.57 0.00 0.00 3.31 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 105 R 8.69 3.81 0.00 1.89 1.90 0.00 3.36 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 106 G 8.12 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 0.00 107 L 7.42 4.50 0.00 1.79 0.94 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 108 G 9.23 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 0.00 0.00 0.00 0.00 109 I 7.50 3.89 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.71 1.03 0.00 0.00 110 A 8.15 4.60 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 0.00 111 I 7.99 4.13 1.90 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.65 0.95 0.00 0.00 112 L 7.98 4.80 0.00 1.45 1.62 1.00 0.86 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 0.00 113 S 8.75 4.25 0.00 3.83 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 0.00 114 T 8.62 4.10 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 1.32 0.00 0.00 115 S 9.05 4.38 0.00 4.07 4.30 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 0.00 116 K 7.32 4.52 0.00 1.87 1.80 0.00 2.08 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.39 1.50 7.81 117 G 8.61 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 0.00 118 V 8.18 4.39 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 0.86 0.00 0.00 0.93 0.00 0.00 119 L 8.15 4.67 0.00 1.63 1.50 0.93 1.00 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 0.00 120 T 8.20 4.38 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 121 D 8.54 4.43 0.00 2.98 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 0.00 122 R 8.06 4.04 0.00 1.84 2.06 0.00 3.16 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 123 E 7.56 4.50 0.00 2.03 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 2.21 2.22 0.00 124 A 7.78 4.35 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 0.00 125 R 6.92 4.59 0.00 1.72 1.82 0.00 3.28 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.51 0.00 126 K 7.23 4.38 0.00 1.69 1.70 0.00 1.88 0.00 0.00 1.64 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.23 1.32 7.81 127 L 8.47 4.29 0.00 1.59 1.59 0.93 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.52 3.67 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 0.00 0.00 0.00 129 V 7.38 4.80 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 0.98 0.00 0.00 0.95 0.00 0.00 130 G 8.79 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 0.00 0.00 0.00 131 G 7.84 4.42 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 0.00 132 E 8.56 4.44 0.00 1.68 1.71 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 1.95 1.49 0.00 133 L 7.78 4.83 0.00 1.60 1.36 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 134 I 7.58 4.25 1.97 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 1.39 0.80 0.86 0.00 0.00 135 C 7.98 4.80 0.00 3.13 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 0.00 136 E 8.79 4.31 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 2.31 0.00 137 V 8.24 4.63 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 1.20 0.00 0.00 1.08 0.00 0.00 138 W 8.80 4.74 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