NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1539 8.1727 122.0468 56.2616 34.1243 174.0620 2 V 4.6198 8.1056 126.8681 60.5564 32.5447 174.4270 3 F 4.4313 10.0073 129.1493 57.6759 40.1644 174.8651 4 E 4.2490 9.2081 121.2161 55.4091 31.1850 176.5252 5 R 3.7933 9.0263 120.0884 61.1565 29.9289 179.3857 6 C 4.4059 8.0940 115.4027 59.6872 39.8846 175.7432 7 E 3.9609 8.2253 120.7775 59.2815 29.2578 178.5108 8 L 3.6804 8.2085 120.1059 57.8448 42.0681 178.5551 9 A 3.9972 8.0114 120.7666 55.5300 18.2665 179.9378 10 R 3.9040 8.1275 116.3751 59.4995 30.2119 179.4827 11 T 3.8745 7.9943 115.6166 66.7344 68.5095 176.7445 12 L 3.8848 8.1771 121.2747 57.4459 41.5971 179.4995 13 K 3.9191 8.2315 119.7416 59.6664 31.9569 179.1322 14 R 3.9973 8.0412 117.3746 58.9933 30.0279 178.1720 15 L 4.3275 7.4464 115.6306 54.5303 41.6249 177.2999 16 G 3.8700 7.8531 106.9733 46.7014 0.0000 174.9495 17 M 3.9211 7.8065 120.4587 56.1948 32.2959 175.7347 18 D 4.3884 7.9492 117.9035 55.9392 40.7412 175.5631 19 G 3.9427 9.4365 115.5621 45.3453 0.0000 171.0291 20 Y 4.2363 8.2138 121.6565 58.6902 38.9910 176.4707 21 R 3.5301 8.9136 127.3072 57.2981 27.7897 177.1532 22 G 3.8030 8.1167 102.5183 45.9131 0.0000 173.9194 23 I 4.0791 7.6490 122.1508 59.3250 37.8473 175.9285 24 S 4.6177 8.3259 120.9532 57.9127 64.9313 174.7500 25 L 4.2207 8.5073 124.6866 58.5836 41.7833 179.3203 26 A 4.1249 8.1569 120.1336 55.2626 18.3082 179.2287 27 N 4.3971 8.0190 115.0481 56.3632 38.5597 177.6634 28 W 4.2435 7.8761 120.0174 60.0068 29.0378 178.4922 29 M 4.0453 8.4900 118.8854 58.5876 31.4476 177.9742 30 C 3.1258 8.0865 118.6567 59.0161 43.9236 175.4015 31 L 3.9664 8.0458 121.7356 58.1956 41.7170 178.8271 32 A 4.0841 8.2988 120.9362 54.8989 18.3959 179.3728 33 K 3.6279 8.0537 118.2431 59.6392 32.0624 179.0707 34 W 4.2992 7.7996 117.1437 59.1364 29.0707 178.3182 35 E 4.3781 8.4251 118.8615 58.7249 29.2711 177.8390 36 S 4.4961 8.2325 108.8793 57.0675 65.3786 175.0338 37 G 3.6381 8.3930 108.7489 46.4046 0.0000 174.3858 38 G 3.6853 8.0892 105.7883 45.5293 0.0000 172.8557 39 N 5.1231 7.5887 119.5224 51.7460 39.0939 176.0324 40 T 3.9958 9.0790 118.3118 63.9010 69.1113 175.9525 41 R 4.3498 7.9496 116.8517 55.5813 30.0397 176.1576 42 A 4.3578 7.6350 122.2222 52.8359 19.4012 177.2051 43 T 5.0863 8.2666 110.3121 60.1586 72.3816 172.9247 44 N 4.8894 8.7741 121.9107 52.1921 41.8593 172.4036 45 Y 4.6457 8.7172 127.9492 57.2020 40.9398 173.8640 46 N 4.7019 8.3200 124.4971 51.1751 39.0659 175.3709 47 A 3.7983 8.3353 127.7641 54.6684 19.0578 179.2430 48 G 3.7118 8.1281 104.5327 48.2420 0.0000 174.1348 49 D 4.7861 7.6836 117.1074 51.8960 39.8404 175.9841 50 R 3.7560 7.9571 115.8281 56.8380 28.2609 175.8321 51 S 4.9698 7.1633 108.0691 56.9420 66.6970 172.6745 52 T 5.1184 8.7773 115.5334 61.9864 72.8141 172.9160 53 D 5.3664 8.9277 125.4409 53.3732 43.0751 175.1098 54 Y 4.8650 9.1768 120.8891 57.4010 41.7659 177.4840 55 G 4.5281 8.8293 111.6247 45.9123 0.0000 173.5143 56 I 3.7881 8.2033 116.8699 62.8994 37.8771 177.4311 57 F 4.7123 7.8793 115.4959 56.3930 39.8646 175.2982 58 Q 3.5734 7.9535 119.1963 57.0972 26.5718 174.0959 59 I 4.3951 8.2611 118.9868 60.9884 39.2688 176.9351 60 N 5.3688 9.2004 126.3002 53.4931 39.7141 175.7483 61 S 4.6539 9.1675 120.6035 60.2739 63.3941 175.4541 62 R 3.7460 8.8487 122.4613 58.7413 30.2620 177.7527 63 Y 4.4736 7.7528 114.1164 57.3460 40.7096 176.8288 64 W 4.9093 8.1198 119.0342 57.6873 31.1950 174.0358 65 C 5.6378 8.0938 112.1894 53.6806 46.5356 172.4537 66 N 4.9939 8.9568 119.4902 52.2106 39.9856 174.8612 67 D 4.8609 8.7201 123.7532 52.2847 40.3980 178.1779 68 G 4.0418 8.3413 107.4504 46.1376 0.0000 174.7479 69 K 4.4855 8.0035 116.9811 56.6005 32.9986 175.6712 70 T 4.5906 7.6688 117.0611 61.3433 69.4374 172.2485 71 P 4.2878 0.0000 0.0000 64.2289 31.6418 176.1664 72 G 3.9350 8.8352 110.1500 46.2776 0.0000 173.0332 73 A 4.2907 7.4651 119.7025 51.4456 19.5210 177.5455 74 V 4.3331 8.4713 112.3280 59.2336 35.5441 176.1879 75 N 4.9417 7.9712 116.8669 52.0317 37.5585 174.5173 76 A 3.9550 8.7983 124.8517 54.9585 19.1244 178.5295 77 C 4.5557 8.4668 111.2102 57.3820 41.1277 173.0290 78 H 4.0472 7.8737 116.2446 56.7085 26.2488 174.2753 79 L 4.8434 8.1725 117.6426 52.8418 46.3849 176.7558 80 S 4.6177 8.3453 115.4237 57.9541 63.3336 175.9937 81 C 4.0629 8.6811 124.0998 59.6601 40.1001 176.4337 82 S 3.9341 7.8448 114.7267 61.2573 61.6730 175.9341 83 A 4.0173 7.8052 122.5183 54.5563 18.2080 177.9991 84 L 4.4017 7.7945 116.0427 55.2851 41.8254 177.6696 85 L 5.0611 7.9373 117.7982 54.5454 42.2829 176.6651 86 Q 4.3763 7.8193 117.5163 55.3187 29.5943 176.0131 87 D 4.3937 8.5498 120.2376 57.1372 41.1381 176.7354 88 N 4.5740 8.0085 118.2212 53.1385 39.2042 174.7187 89 I 4.1768 8.4757 118.8033 61.0264 37.9667 176.9588 90 A 3.9437 8.4182 124.7576 56.0891 18.1365 180.0104 91 D 4.2816 8.0888 116.3267 57.3759 40.8754 178.7263 92 A 4.0747 7.9610 120.9434 55.1376 18.3933 179.7363 93 V 3.4151 8.2563 117.0092 65.9204 31.7140 178.0816 94 A 3.8272 8.0783 120.6857 55.3271 18.1155 178.8552 95 C 4.2546 8.4607 116.8419 59.6424 39.6459 175.5932 96 A 3.9436 8.3087 122.8746 55.0939 17.6131 179.8025 97 K 3.8515 7.7193 116.3668 59.3656 32.2195 179.2563 98 R 4.0826 7.7394 118.7155 59.3042 29.8819 178.6441 99 V 2.4925 7.6143 118.2052 65.7656 30.9161 177.9770 100 V 3.8997 7.7607 110.0583 62.7552 31.3456 178.1652 101 R 4.1539 7.6409 117.4119 57.5050 30.4066 176.5526 102 D 4.6967 7.4293 119.3376 52.7225 41.7941 175.3154 103 P 4.2082 0.0000 0.0000 66.3858 30.9550 177.8919 104 Q 3.9923 8.1785 117.6183 56.2587 29.9109 177.4050 105 G 3.7070 7.9825 107.1752 46.8046 0.0000 175.8386 106 I 3.4645 7.7462 119.6483 63.4530 37.9630 177.9267 107 R 4.2292 7.1923 117.5766 57.5540 30.0199 177.2905 108 A 4.0722 7.6710 121.5004 54.4927 18.7174 177.9884 109 W 4.6380 8.0204 115.9040 55.6205 29.9360 177.6857 110 V 3.7481 8.7363 123.4438 65.9663 31.0060 177.6349 111 A 4.0491 8.3277 120.2019 54.8394 18.0659 179.2887 112 W 3.9734 8.2837 126.5622 60.6509 30.3344 178.4174 113 R 3.8013 8.2210 117.5505 59.3747 29.3683 178.7231 114 N 4.2476 8.3150 115.3037 55.6839 38.7166 176.8705 115 R 4.1013 7.8824 116.0612 55.9036 31.3909 176.0127 116 C 4.5058 7.6731 115.8859 57.5319 42.5856 174.4009 117 Q 3.1166 5.9184 117.0296 57.0679 28.7771 175.5115 118 N 4.1445 8.5284 121.7548 54.6440 36.2855 173.7355 119 R 4.5126 7.2464 114.1405 54.0826 33.5233 175.9118 120 D 4.5640 8.4045 118.8889 53.9056 40.0693 175.9031 121 V 4.5361 8.1071 118.4608 61.2918 32.5322 178.4356 122 R 4.0225 7.9976 121.5463 59.3792 29.5724 178.5748 123 Q 3.9588 8.0464 116.0612 59.6465 28.2489 178.2652 124 Y 4.3035 7.7548 117.6984 59.8583 38.3397 176.7697 125 V 4.3858 7.7471 110.8736 60.7687 32.9605 175.5442 126 Q 4.2179 7.9356 120.2468 57.1749 28.8718 176.8578 127 G 3.9786 8.9310 110.4563 45.9042 0.0000 174.5712 128 C 4.4303 8.0072 115.6625 56.9264 40.6004 174.0213 129 G 3.8717 8.1633 107.2015 46.7271 0.0000 174.1327 130 V 4.0181 7.8980 118.0841 61.0861 32.0665 175.8362 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 K 8.17 4.15 0.00 1.95 1.64 0.00 1.25 0.00 0.00 1.05 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.87 1.07 7.81 2 V 8.11 4.62 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 0.84 0.00 0.00 0.92 0.00 0.00 3 F 10.01 4.43 0.00 2.87 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 4 E 9.21 4.25 0.00 1.97 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 2.28 2.23 0.00 5 R 9.03 3.79 0.00 1.90 1.92 0.00 3.37 0.00 0.00 3.38 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.84 0.00 6 C 8.09 4.41 0.00 3.04 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 7 E 8.23 3.96 0.00 2.10 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 0.00 2.68 2.45 0.00 8 L 8.21 3.68 0.00 1.67 1.76 -0.20 0.87 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 9 A 8.01 4.00 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 10 R 8.13 3.90 0.00 1.92 2.01 0.00 3.15 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 11 T 7.99 3.87 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 1.26 0.00 0.00 12 L 8.18 3.88 0.00 1.74 1.57 0.93 0.32 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 13 K 8.23 3.92 0.00 1.95 1.94 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.51 7.81 14 R 8.04 4.00 0.00 1.96 1.97 0.00 3.22 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 15 L 7.45 4.33 0.00 1.66 1.57 0.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.85 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 17 M 7.81 3.92 0.00 1.27 1.95 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.20 0.00 18 D 7.95 4.39 0.00 2.68 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 19 G 9.44 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 0.00 0.00 0.00 20 Y 8.21 4.24 0.00 3.38 3.19 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 0.00 0.00 0.00 21 R 8.91 3.53 0.00 1.86 1.82 0.00 3.25 0.00 0.00 2.98 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.34 0.00 22 G 8.12 3.80 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 0.00 0.00 0.00 23 I 7.65 4.08 1.89 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.61 -0.29 0.00 0.00 24 S 8.33 4.62 0.00 4.11 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 25 L 8.51 4.22 0.00 2.05 1.82 1.02 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.16 4.12 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.02 4.40 0.00 2.77 2.72 0.00 0.00 6.99 7.57 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 28 W 7.88 4.24 0.00 3.52 3.09 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 0.00 0.00 0.00 0.00 29 M 8.49 4.05 0.00 2.07 2.32 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.94 0.00 30 C 8.09 3.13 0.00 2.59 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 31 L 8.05 3.97 0.00 1.85 1.85 0.64 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.30 4.08 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 33 K 8.05 3.63 0.00 1.69 1.78 0.00 1.08 0.00 0.00 1.44 0.00 0.00 2.63 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.15 0.34 7.81 34 W 7.80 4.30 0.00 3.47 3.31 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 35 E 8.43 4.38 0.00 2.13 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 2.58 2.43 0.00 36 S 8.23 4.50 0.00 4.04 4.01 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 0.00 0.00 0.00 37 G 8.39 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 38 G 8.09 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.59 5.12 0.00 2.78 2.87 0.00 0.00 6.98 7.09 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 40 T 9.08 4.00 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 1.42 0.00 0.00 41 R 7.95 4.35 0.00 2.00 2.08 0.00 3.07 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.57 0.00 42 A 7.64 4.36 1.34 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 43 T 8.27 5.09 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 1.24 0.00 0.00 44 N 8.77 4.89 0.00 2.92 2.86 0.00 0.00 6.81 7.71 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 45 Y 8.72 4.65 0.00 2.99 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 46 N 8.32 4.70 0.00 2.58 2.58 0.00 0.00 6.66 7.69 0.00 0.00 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 A 8.34 3.80 1.34 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 48 G 8.13 3.71 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 0.00 0.00 0.00 49 D 7.68 4.79 0.00 2.74 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 50 R 7.96 3.76 0.00 2.02 2.14 0.00 3.11 0.00 0.00 3.19 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.53 0.00 51 S 7.16 4.97 0.00 3.92 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 52 T 8.78 5.12 4.14 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 0.72 0.00 0.00 53 D 8.93 5.37 0.00 2.74 2.75 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 54 Y 9.18 4.86 0.00 2.92 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 55 G 8.83 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.20 3.79 1.62 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.66 0.06 0.00 0.00 57 F 7.88 4.71 0.00 3.21 2.93 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 58 Q 7.95 3.57 0.00 2.53 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.83 0.00 0.00 0.00 0.00 0.00 2.51 2.69 0.00 59 I 8.26 4.40 2.14 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.12 1.12 0.00 0.00 60 N 9.20 5.37 0.00 3.09 3.04 0.00 0.00 6.97 7.37 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 61 S 9.17 4.65 0.00 4.05 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 0.00 62 R 8.85 3.75 0.00 1.55 1.16 0.00 2.67 0.00 0.00 2.86 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.01 0.00 63 Y 7.75 4.47 0.00 1.67 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 0.00 0.00 0.00 64 W 8.12 4.91 0.00 3.55 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 65 C 8.09 5.64 0.00 3.04 3.19 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 0.00 0.00 0.00 66 N 8.96 4.99 0.00 2.84 2.70 0.00 0.00 7.03 8.63 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 67 D 8.72 4.86 0.00 2.90 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 68 G 8.34 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 0.00 0.00 0.00 69 K 8.00 4.49 0.00 1.84 1.89 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.46 7.81 70 T 7.67 4.59 4.22 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 1.18 0.00 0.00 71 P 0.00 4.29 0.00 2.01 2.01 0.00 3.81 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.84 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 73 A 7.47 4.29 1.24 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 0.00 0.00 0.00 74 V 8.47 4.33 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 0.62 0.00 0.00 0.84 0.00 0.00 75 N 7.97 4.94 0.00 2.74 2.57 0.00 0.00 6.77 8.23 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 76 A 8.80 3.96 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 77 C 8.47 4.56 0.00 3.30 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 78 H 7.87 4.05 0.00 3.32 3.38 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.17 4.84 0.00 1.69 1.49 1.00 0.67 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 80 S 8.35 4.62 0.00 3.83 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 C 8.68 4.06 0.00 2.26 1.19 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 0.00 0.00 0.00 82 S 7.84 3.93 0.00 3.89 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 83 A 7.81 4.02 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 84 L 7.79 4.40 0.00 1.94 1.82 1.07 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.94 5.06 0.00 1.76 1.70 1.12 1.38 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 86 Q 7.82 4.38 0.00 2.21 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.35 7.09 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 87 D 8.55 4.39 0.00 2.62 2.67 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 88 N 8.01 4.57 0.00 2.69 2.74 0.00 0.00 6.97 7.94 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 89 I 8.48 4.18 1.75 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.94 0.95 0.00 0.00 90 A 8.42 3.94 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 91 D 8.09 4.28 0.00 2.74 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 92 A 7.96 4.07 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 93 V 8.26 3.42 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 0.77 0.00 0.00 0.91 0.00 0.00 94 A 8.08 3.83 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 95 C 8.46 4.25 0.00 3.15 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 96 A 8.31 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.72 3.85 0.00 1.59 1.32 0.00 1.27 0.00 0.00 0.69 0.00 0.00 2.34 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.30 0.96 7.81 98 R 7.74 4.08 0.00 2.01 2.15 0.00 3.29 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.99 0.00 99 V 7.61 2.49 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 -0.29 0.00 0.00 -0.67 0.00 0.00 100 V 7.76 3.90 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 1.18 0.00 0.00 1.41 0.00 0.00 101 R 7.64 4.15 0.00 2.02 2.05 0.00 3.26 0.00 0.00 3.33 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.09 0.00 102 D 7.43 4.70 0.00 2.95 2.63 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 0.00 103 P 0.00 4.21 0.00 2.15 2.21 0.00 3.78 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 1.98 2.02 0.00 104 Q 8.18 3.99 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.86 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.98 3.71 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 0.00 0.00 0.00 106 I 7.75 3.46 1.00 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.35 -0.69 0.00 0.00 107 R 7.19 4.23 0.00 1.96 2.02 0.00 3.22 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.52 0.00 108 A 7.67 4.07 0.76 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 0.00 0.00 109 W 8.02 4.64 0.00 3.59 3.27 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 0.00 110 V 8.74 3.75 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 1.21 0.00 0.00 1.00 0.00 0.00 111 A 8.33 4.05 1.54 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 0.00 0.00 0.00 112 W 8.28 3.97 0.00 3.49 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.22 3.80 0.00 2.18 2.00 0.00 3.44 0.00 0.00 3.71 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.14 0.00 114 N 8.31 4.25 0.00 2.63 2.72 0.00 0.00 6.95 7.31 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 0.00 115 R 7.88 4.10 0.00 0.93 0.76 0.00 2.76 0.00 0.00 2.82 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.86 0.00 116 C 7.67 4.51 0.00 1.49 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 0.00 117 Q 5.92 3.12 0.00 0.93 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 118 N 8.53 4.14 0.00 2.78 2.80 0.00 0.00 6.86 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 0.00 119 R 7.25 4.51 0.00 1.75 1.78 0.00 3.23 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 120 D 8.40 4.56 0.00 2.63 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 0.00 121 V 8.11 4.54 2.40 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 0.84 0.00 0.00 1.05 0.00 0.00 122 R 8.00 4.02 0.00 1.96 2.01 0.00 3.15 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 123 Q 8.05 3.96 0.00 1.95 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.12 0.00 0.00 0.00 0.00 0.00 2.00 1.42 0.00 124 Y 7.75 4.30 0.00 3.16 3.08 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 0.00 125 V 7.75 4.39 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 1.02 0.00 0.00 1.05 0.00 0.00 126 Q 7.94 4.22 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.73 0.00 0.00 0.00 0.00 0.00 2.49 2.30 0.00 127 G 8.93 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 0.00 0.00 0.00 128 C 8.01 4.43 0.00 3.13 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 0.00 129 G 8.16 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 0.00 130 V 7.90 4.02 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 0.81 0.00 0.00 0.97 0.00 0.00