NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 A 4.3314 8.2493 123.5843 52.6288 19.4369 177.0817 4 S 4.3163 8.4729 107.3767 57.9012 64.2690 174.6248 5 S 4.0016 9.1208 118.8496 62.0458 63.2455 177.1471 6 E 3.7494 8.2868 121.7624 59.3821 29.0994 179.5373 7 R 4.0249 7.9520 118.3247 59.3162 30.1763 178.1298 8 E 3.7406 7.7924 118.7241 58.6352 29.6470 178.3244 9 L 3.7194 8.3343 121.8503 58.2310 41.9132 178.6063 10 Y 4.2103 7.7795 116.7227 60.9114 37.6411 177.7386 11 E 3.9241 8.5508 120.4296 59.5482 29.6735 178.8289 12 A 4.1039 8.0177 119.9625 54.1194 18.4450 179.4333 13 W 4.2749 8.0497 127.6113 60.4130 30.8029 178.1581 14 V 3.2104 7.6946 118.2612 65.9529 30.8618 177.6962 15 E 3.5314 7.4075 117.3417 58.9483 29.4714 178.1797 16 L 2.4660 6.8470 120.2327 57.8721 41.9529 178.9944 17 L 3.6583 6.9779 118.5379 57.6122 41.4738 179.4232 18 S 3.9963 7.5854 113.0595 61.2286 62.2070 176.3673 19 W 4.5744 8.0513 121.8153 59.8508 28.7507 178.4821 20 M 4.3688 8.0597 118.8514 58.7930 31.5388 179.1100 21 R 3.7172 8.1079 117.9875 58.7930 30.0865 178.6411 22 E 3.9774 8.1431 119.1454 59.3753 29.6988 177.7859 23 Y 4.2210 8.6307 119.5806 60.8953 38.6330 178.3047 24 A 4.1715 8.4719 121.3609 55.3868 18.6045 179.4171 25 Q 3.8751 8.1589 117.4487 59.6789 28.9790 177.4975 26 A 3.9564 8.3207 120.2933 55.7191 18.3246 178.5019 27 K 4.2363 8.3744 114.6982 54.7499 33.6246 177.9669 28 G 4.0801 7.7114 107.4133 46.5497 0.0000 173.7732 29 V 4.6664 8.2363 115.9082 59.5540 35.4521 177.7368 30 R 4.0427 8.2843 122.1676 57.0347 31.0161 175.1438 31 F 5.1081 8.9142 126.4232 56.6328 41.0638 174.2893 32 E 4.5644 8.1908 126.6122 53.7912 32.4962 174.3738 33 K 4.0131 8.8765 128.9339 57.0599 32.1098 175.7273 34 E 4.2629 9.0836 130.0730 58.5820 30.6339 176.4016 35 A 4.4739 7.4615 117.0733 51.1481 22.3128 175.6018 36 D 5.5040 8.5004 120.4738 52.3020 43.0653 176.4193 37 F 4.3230 8.5300 119.4357 57.2551 39.3799 175.0796 38 P 4.3143 0.0000 0.0000 65.2027 31.5136 177.6722 39 D 4.8947 8.4447 115.2815 53.7579 38.9511 175.6148 40 F 4.3950 8.6801 121.4874 60.3089 41.2249 177.1510 41 I 3.5430 8.2055 119.2281 64.3249 36.7319 176.4924 42 Y 4.6848 7.7612 114.1454 57.4799 38.3865 175.9685 43 R 4.1811 7.4513 120.9065 56.5900 32.0958 173.4510 44 M 4.3146 8.6568 122.5069 55.4174 30.9056 178.7173 45 E 3.8692 9.3157 128.7877 58.8962 30.3805 177.8729 46 R 4.0892 7.0936 119.1553 55.4091 30.6725 174.7433 47 P 4.4554 0.0000 0.0000 62.9992 32.1507 175.7392 48 Y 4.3921 8.2815 121.2101 56.8621 40.4601 174.0010 49 D 4.8073 8.0130 125.7022 52.4294 40.8445 176.1626 50 L 3.7449 6.7685 121.5477 54.9284 42.4647 175.0203 51 P 4.4094 0.0000 0.0000 64.7174 31.5770 176.1835 52 T 4.7547 7.7786 105.6472 60.0998 71.8381 173.2909 53 T 4.5493 8.2959 107.4701 61.0289 69.0315 172.3369 54 I 4.4939 7.9196 122.3124 60.1470 39.2630 174.3885 55 M 3.7572 9.1091 129.4111 55.8845 34.7216 175.2751 56 T 5.0460 7.7272 114.7509 61.6822 71.9327 173.2828 57 A 5.1184 9.0611 128.3180 50.3949 22.7886 174.6982 58 S 4.6667 7.6848 111.7696 57.3979 67.1823 173.8193 59 L 4.7643 8.1916 121.1607 53.3705 42.8838 176.2404 60 S 4.6753 8.4431 120.6802 56.8799 65.4021 173.8884 61 D 5.2023 8.2488 121.9726 52.9541 40.7477 177.8434 62 G 3.6360 8.8544 105.7302 49.1117 0.0000 174.9069 63 L 4.0158 8.2771 119.2349 55.8949 41.6886 178.3531 64 G 3.9280 7.7933 106.3247 44.8985 0.0000 173.5695 65 E 3.9539 7.6950 120.4327 55.5363 29.9543 174.7300 66 P 4.6216 0.0000 0.0000 62.2396 32.1677 175.9381 67 F 4.9830 7.5974 114.4601 56.6277 39.4342 175.0851 68 L 4.6818 7.1297 121.8586 53.7150 45.6873 174.1942 69 L 5.2668 8.8850 125.1810 52.8806 45.4510 175.3804 70 A 5.4773 9.0518 124.4754 50.5579 22.8638 174.5135 71 D 5.1719 8.8194 117.8150 53.1105 42.9750 174.7646 72 V 4.5804 6.9564 119.1744 59.5035 34.5575 175.0802 73 S 4.5786 8.0709 117.0334 56.9210 64.5936 172.3113 74 P 4.9979 0.0000 0.0000 63.0383 31.1882 176.0169 75 R 4.1013 8.1066 116.5652 57.9524 30.0103 176.2942 76 H 4.7946 8.1015 112.0486 55.4998 29.4439 174.3263 77 A 4.6033 7.7056 122.3357 50.5554 20.5125 176.7058 78 K 4.3150 8.3053 120.6638 55.8416 33.9100 175.8987 79 L 3.6372 8.4135 119.0948 55.2291 38.8378 176.0265 80 K 4.4261 8.2968 116.1329 56.4728 32.7253 177.0365 81 R 4.6846 8.2239 118.8651 54.3780 33.6011 173.4292 82 I 4.3812 8.3456 120.3717 59.2606 40.4210 174.5356 83 G 4.4247 9.2841 115.6905 44.3114 0.0000 171.5633 84 L 5.4414 8.4423 121.4085 52.6722 45.5332 175.6256 85 R 4.9206 8.8034 123.5511 54.5730 33.9514 174.0937 86 L 4.7485 8.7167 127.0623 52.3994 42.2712 174.0607 87 P 4.4621 0.0000 0.0000 64.0062 31.7331 177.1631 88 R 4.1843 9.1451 121.2108 55.7807 28.0511 176.3397 89 A 4.4722 7.5848 118.1355 50.9517 19.7733 176.3856 90 H 4.0575 8.1742 108.2610 56.5940 26.9813 173.0658 91 I 4.6103 7.2225 123.4230 61.3379 41.3522 173.8380 92 H 5.4803 9.1324 124.0448 53.9348 31.5788 173.5565 93 L 5.0002 9.1278 121.1066 53.4968 45.9769 175.8492 94 H 4.9470 8.7553 117.1948 54.3854 31.8095 172.2679 95 A 4.6687 9.0225 126.7625 51.4542 19.9231 176.1421 96 H 5.1416 8.9048 122.2058 54.7589 32.4790 172.9641 97 Y 4.8380 8.4556 120.8292 57.1452 41.1870 175.4410 98 E 4.6146 8.3143 126.9685 53.8812 32.1383 174.1222 99 P 4.5034 0.0000 0.0000 63.8858 32.1715 175.0033 100 G 4.3411 9.0800 114.4075 45.7376 0.0000 174.6612 101 K 3.9525 7.4406 117.9228 58.7765 33.0880 176.3882 102 G 3.6462 7.3875 105.0481 43.6873 0.0000 171.9418 103 L 4.6825 8.8281 123.4585 55.4627 43.1668 177.7700 104 V 4.9638 8.3976 118.3205 59.6665 35.7286 175.5647 105 T 4.1161 8.6189 116.0736 61.1886 66.2675 174.0940 106 G 3.8103 8.8807 118.5977 45.5589 0.0000 171.4429 107 K 4.4539 8.3658 121.9012 55.4213 35.6219 176.3798 108 I 4.2755 7.5478 120.4509 58.8003 37.9479 173.3564 109 P 4.7202 0.0000 0.0000 63.1334 31.7371 177.0594 110 L 4.5300 8.6088 127.0690 54.1303 40.5725 176.4634 111 T 4.4064 7.7085 114.4430 59.9576 71.6925 175.2320 112 K 2.0000 7.8588 121.6099 59.3214 31.8375 177.8729 113 E 3.8248 8.0008 117.8601 59.9454 29.4194 179.5195 114 R 3.9469 8.0085 118.0688 59.2517 30.0175 178.4329 115 F 4.2120 8.5185 120.6463 61.4491 39.4707 176.9976 116 F 3.7453 9.0289 117.5775 60.4189 38.6471 177.4455 117 A 4.0128 8.2405 120.2795 55.1564 18.1772 179.4637 118 L 3.7939 7.6532 117.9671 58.2766 42.1948 178.9694 119 A 3.7145 7.6011 120.8462 54.9864 17.9575 179.3549 120 D 4.5584 8.0933 118.6772 57.1250 40.9943 178.7569 121 R 3.8643 8.0299 118.3008 59.4751 30.1724 178.6733 122 A 3.9220 8.2217 120.3787 55.2428 18.1232 179.5275 123 R 2.5100 7.9023 117.2612 59.2578 29.8634 178.5776 124 E 3.8740 7.9931 116.7692 59.2474 29.5370 179.0579 125 A 4.0709 7.6618 119.4355 55.0267 18.6277 179.1118 126 L 4.4627 8.1409 115.6598 55.8222 42.3552 177.3938 127 A 4.4417 7.0992 121.8453 52.5721 18.4460 177.3496 128 F 4.2684 9.6518 122.8975 60.2662 39.3397 175.7711 129 A 4.3032 7.8995 126.7551 52.3423 19.1641 175.3569 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 A 8.25 4.33 1.29 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 0.00 0.00 0.00 4 S 8.47 4.32 0.00 4.08 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 9.12 4.00 0.00 4.17 4.27 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 6 E 8.29 3.75 0.00 2.05 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 0.00 2.39 2.41 0.00 7 R 7.95 4.02 0.00 1.89 1.98 0.00 3.06 0.00 0.00 3.07 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 8 E 7.79 3.74 0.00 1.86 1.20 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 2.15 1.99 0.00 9 L 8.33 3.72 0.00 1.51 1.56 0.86 0.53 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 10 Y 7.78 4.21 0.00 3.17 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.55 3.92 0.00 2.14 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 2.29 2.33 0.00 12 A 8.02 4.10 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 13 W 8.05 4.27 0.00 3.43 3.45 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.69 3.21 2.13 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 0.82 0.00 0.00 1.03 0.00 0.00 15 E 7.41 3.53 0.00 1.94 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 2.25 1.83 0.00 16 L 6.85 2.47 0.00 1.23 1.32 0.69 -0.12 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 17 L 6.98 3.66 0.00 1.54 1.38 0.30 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 18 S 7.59 4.00 0.00 3.73 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 19 W 8.05 4.57 0.00 3.17 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 M 8.06 4.37 0.00 2.42 2.58 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.91 0.00 21 R 8.11 3.72 0.00 1.67 1.71 0.00 2.77 0.00 0.00 2.47 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.92 0.00 22 E 8.14 3.98 0.00 2.30 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.52 0.00 23 Y 8.63 4.22 0.00 2.58 2.97 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 24 A 8.47 4.17 1.66 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 0.00 0.00 25 Q 8.16 3.88 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.66 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 26 A 8.32 3.96 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 27 K 8.37 4.24 0.00 1.40 1.64 0.00 1.69 0.00 0.00 1.53 0.00 0.00 2.99 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.80 0.40 7.81 28 G 7.71 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 0.00 0.00 0.00 29 V 8.24 4.67 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 1.11 0.00 0.00 1.32 0.00 0.00 30 R 8.28 4.04 0.00 1.84 1.94 0.00 3.32 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 31 F 8.91 5.11 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 32 E 8.19 4.56 0.00 1.91 1.74 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 2.15 2.19 0.00 33 K 8.88 4.01 0.00 1.93 1.77 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.75 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.46 7.81 34 E 9.08 4.26 0.00 1.90 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 2.20 2.23 0.00 35 A 7.46 4.47 1.13 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 36 D 8.50 5.50 0.00 2.52 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 37 F 8.53 4.32 0.00 3.21 3.26 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 38 P 0.00 4.31 0.00 2.41 2.43 0.00 3.80 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 39 D 8.44 4.89 0.00 2.90 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 40 F 8.68 4.40 0.00 2.71 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 41 I 8.21 3.54 1.34 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 0.72 0.07 0.00 0.00 42 Y 7.76 4.68 0.00 3.12 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 43 R 7.45 4.18 0.00 1.90 1.98 0.00 2.98 0.00 0.00 2.96 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.83 0.00 44 M 8.66 4.31 0.00 2.09 1.39 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.51 0.00 45 E 9.32 3.87 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 46 R 7.09 4.09 0.00 1.68 1.93 0.00 3.19 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.58 0.00 47 P 0.00 4.46 0.00 2.17 2.05 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 48 Y 8.28 4.39 0.00 2.88 2.83 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 49 D 8.01 4.81 0.00 2.70 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 L 6.77 3.74 0.00 0.44 1.32 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.41 0.00 2.12 2.09 0.00 3.65 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 52 T 7.78 4.75 4.44 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 1.19 0.00 0.00 53 T 8.30 4.55 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 0.32 0.00 0.00 54 I 7.92 4.49 1.89 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.98 0.96 0.00 0.00 55 M 9.11 3.76 0.00 1.49 0.57 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 56 T 7.73 5.05 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 57 A 9.06 5.12 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.68 4.67 0.00 3.77 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 59 L 8.19 4.76 0.00 0.92 1.14 0.80 1.23 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 60 S 8.44 4.68 0.00 3.70 3.68 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 61 D 8.25 5.20 0.00 3.09 3.07 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 62 G 8.85 3.64 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 0.00 0.00 0.00 63 L 8.28 4.02 0.00 1.78 1.70 0.97 1.39 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 64 G 7.79 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 65 E 7.70 3.95 0.00 1.66 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.84 0.00 66 P 0.00 4.62 0.00 1.89 1.76 0.00 3.51 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.93 0.00 67 F 7.60 4.98 0.00 2.95 3.16 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 68 L 7.13 4.68 0.00 1.65 1.17 0.95 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 69 L 8.88 5.27 0.00 1.71 1.45 0.86 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 70 A 9.05 5.48 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 71 D 8.82 5.17 0.00 2.54 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 72 V 6.96 4.58 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 0.00 0.00 -0.73 0.00 0.00 0.57 0.00 0.00 73 S 8.07 4.58 0.00 3.92 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 74 P 0.00 5.00 0.00 2.30 2.38 0.00 3.82 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 2.07 2.07 0.00 75 R 8.11 4.10 0.00 1.33 1.74 0.00 2.60 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.36 0.00 76 H 8.10 4.79 0.00 3.21 3.29 0.00 5.74 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 77 A 7.71 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 78 K 8.31 4.31 0.00 1.72 1.72 0.00 1.83 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.52 7.81 79 L 8.41 3.64 0.00 1.81 1.73 0.93 0.90 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 80 K 8.30 4.43 0.00 1.66 1.62 0.00 1.70 0.00 0.00 2.44 0.00 0.00 3.14 0.00 0.00 3.43 0.00 0.00 0.00 0.00 1.44 1.48 7.81 81 R 8.22 4.68 0.00 1.63 1.93 0.00 3.07 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 1.42 1.54 0.00 82 I 8.35 4.38 1.76 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.89 0.95 0.00 0.00 83 G 9.28 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 84 L 8.44 5.44 0.00 1.60 1.62 1.16 1.34 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 85 R 8.80 4.92 0.00 1.79 1.67 0.00 3.17 0.00 0.00 3.02 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.62 0.00 86 L 8.72 4.75 0.00 1.64 1.64 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.46 0.00 2.15 2.03 0.00 3.84 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.94 0.00 88 R 9.15 4.18 0.00 1.99 2.45 0.00 3.41 0.00 0.00 3.45 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 89 A 7.58 4.47 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 H 8.17 4.06 0.00 3.34 3.43 0.00 5.71 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 91 I 7.22 4.61 1.89 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 1.41 0.80 0.95 0.00 0.00 92 H 9.13 5.48 0.00 3.04 3.26 0.00 5.66 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 L 9.13 5.00 0.00 1.80 1.58 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 94 H 8.76 4.95 0.00 2.94 3.17 0.00 5.88 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 9.02 4.67 1.29 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 0.00 0.00 0.00 96 H 8.90 5.14 0.00 3.11 3.30 0.00 5.57 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.46 4.84 0.00 2.93 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.31 4.61 0.00 1.76 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.33 0.00 99 P 0.00 4.50 0.00 2.19 2.13 0.00 3.72 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 1.96 1.97 0.00 100 G 9.08 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 0.00 101 K 7.44 3.95 0.00 1.62 1.79 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.33 7.81 102 G 7.39 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.83 4.68 0.00 1.93 1.70 1.12 0.91 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 0.00 104 V 8.40 4.96 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 0.71 0.00 0.00 0.98 0.00 0.00 105 T 8.62 4.12 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 1.30 0.00 0.00 106 G 8.88 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 0.00 107 K 8.37 4.45 0.00 1.72 1.83 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.42 7.81 108 I 7.55 4.28 1.91 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 1.44 0.54 0.95 0.00 0.00 109 P 0.00 4.72 0.00 2.08 2.04 0.00 3.69 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 110 L 8.61 4.53 0.00 1.68 1.76 1.18 1.08 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 0.00 111 T 7.71 4.41 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 1.26 0.00 0.00 112 K 7.86 2.00 0.00 0.82 1.39 0.00 1.50 0.00 0.00 1.56 0.00 0.00 3.19 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.20 0.92 7.81 113 E 8.00 3.82 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 0.00 114 R 8.01 3.95 0.00 1.95 2.02 0.00 3.15 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 115 F 8.52 4.21 0.00 3.41 3.29 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 0.00 116 F 9.03 3.75 0.00 3.25 3.18 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 0.00 117 A 8.24 4.01 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 0.00 118 L 7.65 3.79 0.00 1.73 1.67 0.93 1.45 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 0.00 119 A 7.60 3.71 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 D 8.09 4.56 0.00 3.02 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 0.00 121 R 8.03 3.86 0.00 1.94 1.98 0.00 3.29 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 1.90 1.77 0.00 122 A 8.22 3.92 1.48 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 0.00 0.00 123 R 7.90 2.51 0.00 1.56 1.86 0.00 3.09 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.05 0.00 124 E 7.99 3.87 0.00 1.91 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 2.29 2.47 0.00 125 A 7.66 4.07 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 0.00 126 L 8.14 4.46 0.00 1.84 1.92 1.05 1.01 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 0.00 127 A 7.10 4.44 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 0.00 128 F 9.65 4.27 0.00 2.92 3.16 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 0.00 129 A 7.90 4.30 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