NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 F 4.6151 8.2829 119.4899 57.1237 41.6067 177.3662 4 K 3.9522 8.2434 125.3459 58.8074 32.1589 182.9911 5 K 4.1549 8.2079 125.1510 59.5445 32.0123 180.5578 6 V 3.7170 7.8041 118.8724 65.8682 31.4688 177.6838 7 A 4.0630 7.6157 122.5653 55.7069 18.1405 180.4902 8 K 3.9321 8.2248 122.0206 60.0683 31.8268 181.2173 9 E 4.1744 8.2612 120.3521 59.5166 29.3767 179.7461 10 T 3.8018 8.4007 115.8100 66.5638 68.5398 176.5455 11 A 4.0112 8.1181 122.7739 55.1387 18.3769 179.7088 12 I 3.6487 8.3551 118.5355 64.8423 37.1393 178.6208 13 T 3.8714 8.0638 116.5934 66.9048 68.2617 176.5777 14 L 3.7642 8.5201 120.9344 57.9501 41.5499 179.2187 15 Q 3.9661 8.1898 119.6692 58.9270 29.1294 177.7569 16 S 4.6434 8.5735 115.7848 61.1495 62.3525 176.0107 17 Y 4.1124 8.8540 122.8353 60.8504 38.5183 177.9638 18 L 3.9467 8.3722 120.1529 57.8534 41.5540 179.5157 19 T 3.7936 7.9189 115.8292 66.7899 68.4259 175.4371 20 Y 3.9430 7.6816 121.0397 61.1258 38.7534 178.2696 21 Q 3.4368 8.0812 120.0691 58.9960 28.8916 178.0070 22 A 3.8286 8.1146 122.2277 54.7071 18.4638 179.3923 23 V 3.4403 7.8689 116.2264 66.4404 31.5670 177.8436 24 R 3.5970 7.7755 118.1133 59.8382 29.6149 177.7294 25 L 3.8675 7.7870 119.2956 58.2541 42.0992 179.2431 26 I 3.6565 7.9959 119.8801 64.4721 37.0218 178.2908 27 S 4.1812 8.7463 116.6687 62.0229 61.9591 176.5890 28 Q 4.0036 8.0085 122.1721 60.3194 27.9561 180.4594 29 A 4.3240 7.7719 122.5812 55.0408 18.4491 179.6171 30 L 3.9754 8.3975 118.1992 58.1303 41.4513 180.0582 31 S 4.2332 8.4594 116.1355 61.9506 63.0945 176.7778 32 E 4.1786 7.9860 120.8761 60.2939 29.4671 179.6404 33 T 4.6379 7.6917 110.0045 64.8176 71.6800 174.2563 34 N 4.9501 8.2075 120.6792 49.9934 38.6844 172.8129 35 P 4.3518 0.0000 0.0000 65.8354 31.4002 178.5935 36 G 3.6018 8.0681 104.6126 47.5863 0.0000 175.2747 37 Q 3.9650 8.0738 121.6600 58.7574 29.1892 177.5489 38 A 4.1271 8.2010 124.2802 56.2630 18.4010 180.2088 39 I 3.7092 8.1123 118.4927 65.0814 35.4039 180.0270 40 W 4.3261 8.3570 130.0863 60.1533 30.5354 177.7030 41 L 3.7416 8.7305 120.9503 58.3850 41.4763 178.6283 42 G 3.8228 8.4143 107.7669 48.8119 0.0000 175.5155 43 E 3.9139 8.2709 120.6307 60.5381 29.7587 181.4281 44 F 3.9502 7.8572 121.8535 61.1351 39.1018 177.2702 45 S 4.4207 8.1010 115.8322 62.2425 62.6934 177.1624 46 K 4.0740 7.5584 124.8858 60.0726 31.5330 181.1875 47 R 4.1734 7.2330 117.6962 57.0467 30.1339 176.7841 48 H 4.6606 7.2939 115.4640 52.8218 31.8608 171.2489 49 P 4.4510 0.0000 0.0000 62.0104 31.3771 176.8773 50 I 3.0001 8.5498 127.0570 64.2803 37.9279 177.3919 51 Q 4.1341 8.0546 116.7597 56.6473 28.6002 179.5662 52 E 4.8446 7.9995 116.4780 56.3344 29.7843 177.0604 53 S 4.2492 7.8993 119.2419 62.3203 63.4538 176.7432 54 D 4.4328 8.2276 120.5787 57.4384 40.6019 178.9843 55 L 4.0509 7.9099 118.8960 57.9411 41.6843 178.3056 56 Y 4.2613 8.5514 118.8005 60.9121 38.8537 178.2990 57 L 4.2235 9.0062 120.5088 57.8966 41.7701 179.0369 58 E 3.9612 8.0750 117.8715 59.4161 29.2597 179.1190 59 A 4.0163 8.5403 121.0405 55.6584 18.4411 179.1532 60 M 3.9217 7.9983 115.3490 57.7283 32.0957 177.7993 61 M 4.2426 7.5622 117.4144 58.1315 32.4631 176.9557 62 L 4.4334 7.4755 116.8370 55.2513 42.1543 176.8981 63 E 4.4807 7.7083 115.8920 57.4820 33.2983 176.1273 64 N 4.7829 8.5840 116.1265 50.6824 40.2105 174.4384 65 K 3.7919 8.0878 122.3645 59.9494 32.1588 178.2765 66 E 3.9154 8.0208 118.7075 58.9433 29.5519 178.5834 67 L 3.9172 8.2239 120.5834 58.0078 42.2630 178.6254 68 V 3.5523 7.8004 117.8487 66.5228 31.2243 177.8560 69 L 4.0314 7.8561 117.9167 57.6026 41.3000 179.7353 70 R 3.8554 7.6206 118.1130 59.3541 30.1034 178.2587 71 I 3.6847 8.0960 120.1179 64.6457 36.8636 178.0272 72 L 4.0005 7.9388 119.3599 58.4268 41.4042 179.9560 73 T 3.8944 7.7190 115.1351 66.5159 68.3682 177.1134 74 V 3.5797 8.0721 120.6154 65.8824 31.6348 178.1712 75 R 3.8922 8.4312 116.3702 59.5038 29.1615 178.4491 76 E 4.1053 7.9842 119.6486 58.7465 29.5583 178.6274 77 N 4.3172 7.9095 116.5037 56.1485 38.6823 177.2040 78 L 3.9426 7.8838 120.0549 57.9028 41.8635 179.1408 79 A 4.0262 8.3851 120.9509 55.7536 18.0011 179.5859 80 E 4.1010 8.0727 115.5743 59.0758 29.7262 179.1192 81 G 3.8740 7.9816 103.9385 46.0653 0.0000 174.2819 82 V 4.4641 7.6479 118.5700 64.3159 34.2258 177.1724 83 L 3.9720 7.9734 119.5398 58.0006 41.7968 178.9747 84 E 3.7183 8.1750 117.3600 59.4148 29.6069 177.4918 85 F 4.7646 7.5138 115.7384 57.8953 39.0730 177.1353 86 L 4.2024 7.9526 124.4154 57.2975 42.1967 176.7708 87 P 4.2953 0.0000 0.0000 66.1842 31.2520 178.9674 88 E 3.9810 8.1700 116.4307 61.4391 29.6695 180.5357 89 M 4.2401 7.5966 119.2925 58.2749 32.1177 179.1474 90 V 3.5428 8.0357 118.2496 65.8898 31.7910 177.7552 91 L 3.9011 7.8085 119.9866 58.1441 41.9604 178.7249 92 S 4.1013 8.3183 115.4736 62.3212 62.3866 176.6566 93 Q 4.0627 8.6363 123.6194 60.3318 27.5810 180.8152 94 I 3.8797 8.3099 121.6042 64.3350 37.1606 178.3194 95 K 3.9286 7.8853 119.3064 59.8416 31.9893 178.9996 96 Q 3.9004 8.1125 119.2623 59.2502 28.9817 178.0706 97 S 4.0511 8.1477 114.1591 61.3462 62.3292 175.5795 98 N 4.4218 9.1696 120.5686 56.4143 38.2784 177.4706 99 G 3.6056 8.2670 106.8468 47.8925 0.0000 175.1909 100 N 4.2866 7.9687 119.3966 56.3385 38.5759 177.0916 101 H 4.1673 8.4265 117.5980 58.9959 28.8219 177.8784 102 R 3.9120 8.2520 119.8655 59.4169 29.9366 179.0822 103 R 3.8718 8.2767 117.8517 59.5038 30.1499 178.6327 104 S 4.0621 8.4203 112.9765 61.5998 62.2757 175.8971 105 L 3.9340 8.3041 122.7768 58.4631 40.5177 179.0998 106 L 4.1090 8.6893 121.3875 58.2002 41.5046 180.2430 107 E 3.9521 8.3741 118.4573 61.3301 29.5563 182.5341 108 R 4.1380 7.8300 118.0833 59.2212 30.1760 178.6099 109 L 4.1314 7.7123 117.9457 57.8191 41.7964 179.0203 110 T 4.3690 7.3694 106.9400 63.1515 69.4644 175.9409 111 Q 4.3433 7.7539 128.1640 57.3496 28.4732 180.5623 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 3 F 8.28 4.62 0.00 3.07 3.22 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 4 K 8.24 3.95 0.00 1.84 1.79 0.00 1.80 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.13 7.81 5 K 8.21 4.15 0.00 1.75 1.86 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.45 1.08 7.81 6 V 7.80 3.72 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 0.82 0.00 0.00 0.90 0.00 0.00 7 A 7.62 4.06 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 8 K 8.22 3.93 0.00 1.78 1.83 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.35 7.81 9 E 8.26 4.17 0.00 2.13 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 2.33 2.53 0.00 10 T 8.40 3.80 4.33 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 1.17 0.00 0.00 11 A 8.12 4.01 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 12 I 8.36 3.65 2.01 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 1.54 0.55 0.93 0.00 0.00 13 T 8.06 3.87 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 1.19 0.00 0.00 14 L 8.52 3.76 0.00 1.92 1.78 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 8.19 3.97 0.00 2.31 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.67 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 16 S 8.57 4.64 0.00 4.08 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 8.85 4.11 0.00 3.09 3.14 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 18 L 8.37 3.95 0.00 1.93 1.71 0.97 1.08 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 19 T 7.92 3.79 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 1.21 0.00 0.00 20 Y 7.68 3.94 0.00 2.94 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 Q 8.08 3.44 0.00 1.81 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 22 A 8.11 3.83 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 23 V 7.87 3.44 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 1.04 0.00 0.00 0.99 0.00 0.00 24 R 7.78 3.60 0.00 1.22 1.74 0.00 3.13 0.00 0.00 2.94 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.41 0.00 25 L 7.79 3.87 0.00 1.95 1.67 0.88 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 26 I 8.00 3.66 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 1.40 0.34 0.93 0.00 0.00 27 S 8.75 4.18 0.00 3.89 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 8.01 4.00 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.27 0.00 29 A 7.77 4.32 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.40 3.98 0.00 1.83 1.78 1.01 0.86 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 31 S 8.46 4.23 0.00 4.01 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 7.99 4.18 0.00 2.05 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 2.26 2.22 0.00 33 T 7.69 4.64 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 1.21 0.00 0.00 34 N 8.21 4.95 0.00 2.75 2.66 0.00 0.00 7.05 7.25 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 35 P 0.00 4.35 0.00 2.31 2.36 0.00 3.89 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 2.10 2.09 0.00 36 G 8.07 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 8.07 3.96 0.00 2.18 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.43 2.56 0.00 38 A 8.20 4.13 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 39 I 8.11 3.71 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 1.41 0.70 0.91 0.00 0.00 40 W 8.36 4.33 0.00 3.45 3.47 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 41 L 8.73 3.74 0.00 2.08 1.98 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.41 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 0.00 0.00 0.00 43 E 8.27 3.91 0.00 2.00 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 2.25 2.22 0.00 44 F 7.86 3.95 0.00 1.70 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.10 4.42 0.00 4.09 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 46 K 7.56 4.07 0.00 1.84 1.73 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.36 7.81 47 R 7.23 4.17 0.00 1.48 1.72 0.00 3.00 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.73 0.00 48 H 7.29 4.66 0.00 2.49 3.04 0.00 5.65 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 49 P 0.00 4.45 0.00 2.22 2.20 0.00 3.76 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 2.10 1.95 0.00 50 I 8.55 3.00 1.56 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.15 0.86 0.00 0.00 51 Q 8.05 4.13 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.22 0.00 0.00 0.00 0.00 0.00 2.28 1.96 0.00 52 E 8.00 4.84 0.00 2.14 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 2.23 2.40 0.00 53 S 7.90 4.25 0.00 4.04 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.23 4.43 0.00 2.81 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 55 L 7.91 4.05 0.00 1.77 1.77 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 8.55 4.26 0.00 2.99 3.20 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 57 L 9.01 4.22 0.00 1.83 1.76 1.01 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.08 3.96 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 59 A 8.54 4.02 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 60 M 8.00 3.92 0.00 2.02 1.69 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.32 0.00 61 M 7.56 4.24 0.00 2.01 2.28 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 62 L 7.48 4.43 0.00 1.83 1.73 0.99 1.12 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 63 E 7.71 4.48 0.00 2.03 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 2.35 2.40 0.00 64 N 8.58 4.78 0.00 1.92 2.40 0.00 0.00 7.14 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.09 3.79 0.00 1.77 1.85 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.61 7.81 66 E 8.02 3.92 0.00 1.96 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 67 L 8.22 3.92 0.00 1.90 1.63 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 68 V 7.80 3.55 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 1.03 0.00 0.00 0.95 0.00 0.00 69 L 7.86 4.03 0.00 1.91 1.70 0.91 0.71 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 70 R 7.62 3.86 0.00 2.06 1.99 0.00 3.11 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 71 I 8.10 3.68 2.07 0.00 0.00 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 1.58 0.46 0.96 0.00 0.00 72 L 7.94 4.00 0.00 1.86 1.75 0.94 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.72 3.89 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 74 V 8.07 3.58 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 1.03 0.00 0.00 0.98 0.00 0.00 75 R 8.43 3.89 0.00 2.02 2.17 0.00 2.84 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.65 0.00 76 E 7.98 4.11 0.00 2.06 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 0.00 2.31 2.35 0.00 77 N 7.91 4.32 0.00 2.91 2.85 0.00 0.00 6.93 8.09 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 78 L 7.88 3.94 0.00 1.87 1.73 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.39 4.03 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 80 E 8.07 4.10 0.00 2.11 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 2.33 2.31 0.00 81 G 7.98 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 82 V 7.65 4.46 2.31 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 1.10 0.00 0.00 1.02 0.00 0.00 83 L 7.97 3.97 0.00 2.01 1.70 0.95 0.81 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 84 E 8.18 3.72 0.00 1.60 1.17 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 2.03 2.13 0.00 85 F 7.51 4.76 0.00 3.22 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.95 4.20 0.00 1.98 1.66 1.00 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 87 P 0.00 4.30 0.00 2.20 2.09 0.00 3.81 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 88 E 8.17 3.98 0.00 1.97 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 2.32 1.98 0.00 89 M 7.60 4.24 0.00 2.21 2.39 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.57 0.00 90 V 8.04 3.54 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 0.88 0.00 0.00 0.96 0.00 0.00 91 L 7.81 3.90 0.00 1.85 1.74 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.32 4.10 0.00 3.94 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 93 Q 8.64 4.06 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.59 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 94 I 8.31 3.88 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.74 0.90 0.00 0.00 95 K 7.89 3.93 0.00 2.01 1.90 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.69 7.81 96 Q 8.11 3.90 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 97 S 8.15 4.05 0.00 3.95 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 98 N 9.17 4.42 0.00 2.84 2.88 0.00 0.00 6.93 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 99 G 8.27 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 0.00 100 N 7.97 4.29 0.00 2.81 2.81 0.00 0.00 7.10 8.13 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 0.00 101 H 8.43 4.17 0.00 3.36 3.33 0.00 5.63 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 0.00 102 R 8.25 3.91 0.00 2.09 1.99 0.00 3.30 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 103 R 8.28 3.87 0.00 1.90 1.98 0.00 3.15 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 104 S 8.42 4.06 0.00 3.85 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.30 3.93 0.00 1.77 2.02 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.69 4.11 0.00 1.74 1.71 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.37 3.95 0.00 1.98 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 2.24 2.22 0.00 108 R 7.83 4.14 0.00 1.84 2.05 0.00 3.31 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 109 L 7.71 4.13 0.00 1.84 1.75 0.92 0.92 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 0.00 110 T 7.37 4.37 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 0.00 111 Q 7.75 4.34 0.00 2.20 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00