NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2192 8.3144 121.7893 55.6046 33.3918 175.1063 2 E 3.8071 8.7088 125.2583 56.0887 30.0753 174.7385 3 S 4.7294 8.3645 120.4237 57.7352 65.7815 169.6815 4 A 3.8272 8.0553 119.3381 53.6553 17.6252 179.7072 5 A 4.4952 7.9786 114.9123 53.8788 19.3293 179.6528 6 A 4.0177 7.7988 118.6320 54.9715 18.3214 179.7229 7 K 3.8410 8.0487 117.6863 59.6153 32.3187 178.2692 8 F 4.1937 8.4887 121.3172 61.4729 39.2508 176.3491 9 E 3.5991 8.5319 118.9306 59.4563 29.1431 178.8673 10 R 3.9022 7.9852 116.6342 59.7150 30.3189 178.9788 11 Q 4.1784 8.1519 116.2508 58.2300 28.8910 176.2560 12 H 4.1419 8.1376 117.1311 57.7694 32.1168 173.2211 13 M 4.6750 7.1073 118.5839 53.8379 30.5595 176.6186 14 D 4.5362 7.4717 125.5002 52.9985 40.6690 176.4927 15 S 4.6059 7.5078 118.3800 57.7656 60.9459 173.6719 16 G 4.1063 7.2799 111.9376 43.6822 0.0000 170.5110 17 N 4.6629 8.6114 118.8189 52.3561 39.9519 175.5697 18 S 4.1248 8.6113 116.2676 58.1435 63.2919 173.2444 19 P 4.3181 0.0000 0.0000 62.9404 31.7254 175.7287 20 S 4.3746 8.8654 113.0820 58.8821 65.7948 174.5317 21 S 3.7040 8.7866 120.8258 58.7219 60.7595 172.8506 22 S 4.0651 7.9783 118.7702 62.2607 62.8435 175.6906 23 S 4.2366 8.2190 118.0974 60.9037 62.3190 175.7406 24 N 4.2401 8.1176 120.0512 55.9336 38.3175 175.9369 25 Y 4.0261 8.4451 121.2486 61.2452 38.6974 177.6729 26 C 4.1341 8.3076 118.8104 59.3172 41.1316 174.7607 27 N 4.2593 8.4060 118.6218 56.5476 38.2309 176.5885 28 L 3.8610 8.3305 121.4327 58.7971 42.0436 178.4842 29 M 3.8992 8.0488 118.3330 59.1620 31.9420 178.8769 30 M 4.1459 8.3754 116.8271 58.2245 31.2954 178.0424 31 C 4.0355 8.2838 119.6280 62.5725 31.8417 174.7507 32 C 4.2030 8.2573 119.1506 62.5760 31.1965 175.1892 33 R 3.9793 8.0866 119.5420 57.5522 29.8117 177.3618 34 K 4.0261 8.4855 116.1764 57.2780 29.9277 177.4862 35 M 4.2813 8.0125 118.3891 57.3828 31.8535 177.2997 36 T 4.3552 7.8053 108.2543 62.0196 69.4886 173.9803 37 Q 4.1167 7.9625 124.8986 58.0088 29.3067 175.2556 38 G 4.3875 9.3967 119.5664 45.0739 0.0000 173.3911 39 K 4.5894 7.3328 120.2050 54.3837 35.3749 174.4118 40 C 4.7411 8.9531 119.2955 55.3398 41.1610 173.8335 41 K 4.0846 8.9699 124.5509 56.5968 32.4635 174.9771 42 P 4.7571 0.0000 0.0000 65.0199 32.2675 176.3836 43 V 5.1182 7.7095 117.7000 60.7456 35.1009 173.9501 44 N 4.6816 9.2380 124.3715 51.7689 42.0012 174.8149 45 T 4.6668 7.5328 125.5040 61.3557 66.7547 175.1376 46 F 4.4476 7.8463 120.7344 57.1797 40.9076 176.6647 47 V 3.9229 8.2213 124.8095 62.6596 31.8186 176.0508 48 H 4.8277 8.3822 131.6484 53.2609 26.1948 174.5968 49 E 4.6561 7.6430 117.4487 54.3290 33.3876 174.3252 50 S 4.1351 8.7644 118.6903 59.0701 63.5977 175.6325 51 L 3.9804 8.8702 125.5942 59.1199 39.7821 179.3134 52 A 3.9827 8.0339 120.8656 54.9515 18.2229 178.7784 53 D 4.2604 8.0880 116.3583 57.7041 41.2660 178.7519 54 V 3.6645 7.7879 118.0850 65.8560 31.3298 177.9711 55 K 3.9094 8.4167 117.5412 59.2865 32.1488 178.6378 56 A 4.0944 8.2441 121.4081 55.3828 18.2432 179.4624 57 V 3.5268 8.0425 116.8103 66.6931 31.3211 177.3875 58 C 4.0972 8.1169 116.2444 58.3613 43.4094 173.4863 59 S 4.3366 7.8166 114.9774 57.9281 64.1635 174.4696 60 Q 4.2746 8.5728 122.1051 55.8841 26.7967 178.8156 61 K 4.4422 6.3179 135.0000 55.0380 33.3830 174.1930 62 K 3.5525 8.3676 129.0704 56.6327 31.8449 176.1701 63 V 4.4580 8.6124 118.9314 59.5374 36.3363 175.5023 64 T 4.1056 8.4152 119.8610 63.2756 67.7974 175.5106 65 C 4.4632 8.4032 124.3371 56.6597 41.3135 174.6126 66 K 4.5298 8.1495 120.0926 55.9479 30.7713 176.8519 67 D 4.6661 7.8153 117.3885 54.9435 47.3800 177.3062 68 G 3.8901 8.0315 105.3978 46.1154 0.0000 173.7252 69 Q 4.6692 7.9321 119.3450 56.9966 36.2430 174.2980 70 T 3.8202 7.7824 107.7258 62.1596 69.3001 173.1945 71 N 4.9063 8.7010 121.8954 51.9492 40.3736 172.2493 72 C 5.6703 8.2316 115.7879 53.6749 45.7683 172.5787 73 Y 5.2274 9.1409 117.9873 56.2276 41.4332 174.9305 74 Q 4.6881 9.0109 126.0480 55.8135 30.7519 174.9453 75 S 4.4607 8.9195 121.3072 57.8292 63.1840 174.1214 76 K 4.0625 9.5442 127.8545 59.1443 32.2204 177.4903 77 S 4.4611 7.8777 111.6369 58.1703 63.8998 173.1375 78 T 4.7072 8.0011 111.6679 61.2289 70.6044 173.4881 79 M 4.9173 8.8074 118.8483 53.9587 35.3130 174.2706 80 R 4.5839 8.8664 117.5367 56.4950 30.3688 175.1247 81 I 4.6057 8.7716 119.3690 60.0741 40.2293 175.2571 82 T 4.4334 8.6502 123.2383 61.8935 68.9847 171.9396 83 D 4.8777 9.1480 125.6501 54.1150 41.3314 172.9334 84 C 5.1437 9.3720 123.4455 55.9665 37.9327 172.5115 85 R 5.2085 9.0337 125.1738 54.1222 32.4028 175.1134 86 E 3.8394 9.0169 125.1607 57.0292 27.1122 176.7465 87 T 4.5469 7.3651 120.9814 61.7005 71.6673 174.3314 88 G 3.7975 7.8314 110.7811 45.0981 0.0000 173.9592 89 S 3.7931 7.8546 107.5658 58.9491 61.0937 173.4643 90 S 4.1446 7.8791 114.8530 58.9417 62.8339 173.5129 91 K 4.5931 9.1431 127.7169 54.5223 32.9077 172.5977 92 Y 3.9587 8.2902 123.2431 56.5758 39.0561 174.7083 93 P 3.5117 0.0000 0.0000 63.7551 32.7347 176.3817 94 N 4.5817 8.1499 120.0085 52.8345 37.1085 174.6961 95 C 4.5735 7.5708 115.2849 56.5749 42.5826 173.8103 96 A 4.9595 8.1606 125.9378 50.5338 21.8294 173.9380 97 Y 4.8166 9.6575 121.1627 56.2452 40.3917 175.8690 98 K 4.1786 9.2157 125.4489 56.1249 33.2134 175.9070 99 T 4.6064 8.4529 126.2581 63.0178 68.1080 172.5727 100 T 4.5442 9.0620 122.0285 62.3156 69.2958 173.5087 101 Q 4.6861 8.4637 125.8688 55.7874 29.6799 175.8920 102 V 4.4933 9.0675 122.1559 60.3779 35.4758 173.6448 103 E 4.9896 8.6594 122.2639 54.5117 30.6365 174.7808 104 K 4.5277 7.9944 123.2720 55.3572 37.4240 174.8307 105 H 5.0454 8.8564 118.1635 56.1138 29.8785 175.2732 106 I 4.7682 8.9150 115.7104 59.4582 40.9216 174.8395 107 I 4.7869 8.5630 124.7941 59.8769 39.2711 174.5679 108 V 4.5589 8.7224 121.2123 59.7088 33.8179 175.4750 109 A 4.6402 8.7598 127.9212 51.3930 19.3619 175.7172 110 C 4.8751 8.8616 123.3413 56.6561 43.5510 173.0895 111 G 3.8125 9.1632 110.1683 46.8338 0.0000 173.4711 112 G 4.1920 9.0196 108.5165 44.8124 0.0000 172.9582 113 K 4.4416 8.1472 117.0446 53.4859 34.3312 175.0170 114 P 4.3979 0.0000 0.0000 61.9311 31.9615 176.0536 115 S 4.3962 8.4333 113.2261 59.0601 62.8597 173.8025 116 V 4.6429 8.7891 119.0599 58.3008 35.5660 173.4944 117 P 4.8048 0.0000 0.0000 63.0545 31.6470 176.8448 118 V 4.1631 8.4449 123.7435 61.8352 33.7773 175.1806 119 H 4.0133 7.0825 116.1886 53.8034 33.8024 172.2745 120 F 4.9229 8.5978 122.6640 57.2915 39.2388 175.0364 121 D 4.3347 8.6532 126.8484 56.2815 41.5235 175.6692 122 A 4.1575 6.2743 116.7979 51.8261 22.9167 174.1214 123 S 5.0844 8.5946 110.0277 57.4957 66.9043 174.7207 124 V 4.1436 8.9962 119.4908 62.2329 31.4010 174.3345 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 8.31 4.22 0.00 1.74 1.78 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.71 3.81 0.00 2.05 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 2.32 2.37 0.00 3 S 8.36 4.73 0.00 3.83 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 4 A 8.06 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 5 A 7.98 4.50 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 6 A 7.80 4.02 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 7 K 8.05 3.84 0.00 1.92 1.96 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.47 7.81 8 F 8.49 4.19 0.00 3.27 3.30 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 9 E 8.53 3.60 0.00 2.17 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 0.00 2.25 2.32 0.00 10 R 7.99 3.90 0.00 1.98 1.99 0.00 3.38 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 1.80 1.83 0.00 11 Q 8.15 4.18 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 12 H 8.14 4.14 0.00 2.85 2.42 0.00 5.77 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 13 M 7.11 4.68 0.00 1.87 1.61 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.56 0.00 14 D 7.47 4.54 0.00 2.79 2.30 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 15 S 7.51 4.61 0.00 4.00 3.76 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 16 G 7.28 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 0.00 0.00 0.00 17 N 8.61 4.66 0.00 2.67 2.76 0.00 0.00 6.77 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 18 S 8.61 4.12 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 19 P 0.00 4.32 0.00 2.08 1.88 0.00 3.80 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.89 0.00 20 S 8.87 4.37 0.00 3.84 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 21 S 8.79 3.70 0.00 4.02 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 22 S 7.98 4.07 0.00 3.97 4.02 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 0.00 0.00 0.00 23 S 8.22 4.24 0.00 4.10 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 24 N 8.12 4.24 0.00 2.79 3.04 0.00 0.00 6.59 7.55 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 25 Y 8.45 4.03 0.00 3.12 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 26 C 8.31 4.13 0.00 2.91 3.01 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 27 N 8.41 4.26 0.00 2.95 2.93 0.00 0.00 6.70 6.63 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 28 L 8.33 3.86 0.00 1.68 1.88 0.87 0.88 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 29 M 8.05 3.90 0.00 1.93 2.08 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.61 0.00 30 M 8.38 4.15 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.63 0.00 31 C 8.28 4.04 0.00 2.98 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 32 C 8.26 4.20 0.00 2.94 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 33 R 8.09 3.98 0.00 2.05 2.09 0.00 3.51 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.74 0.00 34 K 8.49 4.03 0.00 2.03 1.96 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.69 7.81 35 M 8.01 4.28 0.00 2.01 2.14 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 2.63 2.71 0.00 36 T 7.81 4.36 4.28 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 1.35 0.00 0.00 37 Q 7.96 4.12 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 5.72 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 38 G 9.40 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 0.00 0.00 0.00 0.00 39 K 7.33 4.59 0.00 2.02 1.84 0.00 1.36 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.42 7.81 40 C 8.95 4.74 0.00 3.24 3.32 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 41 K 8.97 4.08 0.00 1.85 1.84 0.00 1.80 0.00 0.00 1.80 0.00 0.00 3.14 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.66 1.42 7.81 42 P 0.00 4.76 0.00 2.17 2.35 0.00 3.87 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.85 0.00 43 V 7.71 5.12 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 1.00 0.00 0.00 44 N 9.24 4.68 0.00 2.55 2.21 0.00 0.00 5.87 6.03 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 45 T 7.53 4.67 3.39 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 1.19 0.00 0.00 46 F 7.85 4.45 0.00 2.79 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 47 V 8.22 3.92 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 1.13 0.00 0.00 1.07 0.00 0.00 48 H 8.38 4.83 0.00 3.11 3.20 0.00 5.87 0.00 0.00 0.00 0.00 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.64 4.66 0.00 1.89 1.78 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 2.21 2.34 0.00 50 S 8.76 4.14 0.00 3.93 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 51 L 8.87 3.98 0.00 1.98 1.98 0.93 0.58 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 52 A 8.03 3.98 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 53 D 8.09 4.26 0.00 2.76 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 54 V 7.79 3.66 2.25 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 1.34 0.00 0.00 1.05 0.00 0.00 55 K 8.42 3.91 0.00 1.95 1.84 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.60 7.81 56 A 8.24 4.09 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 57 V 8.04 3.53 2.36 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 1.22 0.00 0.00 1.06 0.00 0.00 58 C 8.12 4.10 0.00 3.15 3.01 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 59 S 7.82 4.34 0.00 3.61 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 60 Q 8.57 4.27 0.00 2.27 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.63 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 61 K 6.32 4.44 0.00 2.00 1.73 0.00 1.51 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.37 7.81 62 K 8.37 3.55 0.00 0.85 1.33 0.00 1.56 0.00 0.00 1.60 0.00 0.00 2.71 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.03 0.68 7.81 63 V 8.61 4.46 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 0.84 0.00 0.00 0.89 0.00 0.00 64 T 8.42 4.11 4.19 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 1.17 0.00 0.00 65 C 8.40 4.46 0.00 2.94 2.96 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 0.00 0.00 0.00 66 K 8.15 4.53 0.00 1.71 1.78 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.37 7.81 67 D 7.82 4.67 0.00 2.57 2.60 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 68 G 8.03 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 0.00 0.00 0.00 69 Q 7.93 4.67 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.84 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 70 T 7.78 3.82 4.21 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 1.17 0.00 0.00 71 N 8.70 4.91 0.00 2.73 2.86 0.00 0.00 6.91 7.65 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 72 C 8.23 5.67 0.00 3.07 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 73 Y 9.14 5.23 0.00 2.77 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 74 Q 9.01 4.69 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 75 S 8.92 4.46 0.00 4.01 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 76 K 9.54 4.06 0.00 1.72 2.00 0.00 1.70 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.46 7.81 77 S 7.88 4.46 0.00 4.05 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 78 T 8.00 4.71 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 0.92 0.00 0.00 79 M 8.81 4.92 0.00 2.19 2.25 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 80 R 8.87 4.58 0.00 1.92 2.14 0.00 2.78 0.00 0.00 3.24 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 81 I 8.77 4.61 1.90 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.28 1.04 0.00 0.00 82 T 8.65 4.43 4.20 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 0.93 0.00 0.00 83 D 9.15 4.88 0.00 2.75 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 84 C 9.37 5.14 0.00 3.03 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 85 R 9.03 5.21 0.00 2.09 1.79 0.00 3.14 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 86 E 9.02 3.84 0.00 1.58 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 2.41 2.19 0.00 87 T 7.37 4.55 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 1.20 0.00 0.00 88 G 7.83 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 89 S 7.85 3.79 0.00 4.02 3.96 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 0.00 0.00 0.00 90 S 7.88 4.14 0.00 3.89 3.92 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 91 K 9.14 4.59 0.00 1.76 1.67 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.45 7.81 92 Y 8.29 3.96 0.00 3.02 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 93 P 0.00 3.51 0.00 2.06 2.06 0.00 3.85 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 94 N 8.15 4.58 0.00 2.81 2.79 0.00 0.00 7.29 7.33 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 95 C 7.57 4.57 0.00 2.97 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 96 A 8.16 4.96 1.22 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 0.00 0.00 97 Y 9.66 4.82 0.00 2.94 2.96 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 0.00 0.00 0.00 98 K 9.22 4.18 0.00 1.76 1.74 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.57 7.81 99 T 8.45 4.61 4.17 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 1.08 0.00 0.00 100 T 9.06 4.54 4.36 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 1.22 0.00 0.00 101 Q 8.46 4.69 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.12 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 102 V 9.07 4.49 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 0.83 0.00 0.00 0.94 0.00 0.00 103 E 8.66 4.99 0.00 1.84 1.94 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 2.20 2.26 0.00 104 K 7.99 4.53 0.00 1.66 1.80 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.44 7.81 105 H 8.86 5.05 0.00 3.28 3.37 0.00 5.78 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 0.00 106 I 8.92 4.77 2.14 0.00 0.00 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 1.34 1.39 1.15 0.00 0.00 107 I 8.56 4.79 1.79 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 1.16 1.03 0.86 0.00 0.00 108 V 8.72 4.56 2.16 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 0.90 0.00 0.00 1.03 0.00 0.00 109 A 8.76 4.64 1.15 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 0.00 0.00 110 C 8.86 4.88 0.00 3.04 3.05 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 0.00 111 G 9.16 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 0.00 112 G 9.02 4.19 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 0.00 0.00 0.00 113 K 8.15 4.44 0.00 1.70 1.71 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.33 7.81 114 P 0.00 4.40 0.00 2.16 2.07 0.00 3.77 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 1.98 1.95 0.00 115 S 8.43 4.40 0.00 3.81 3.96 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 0.00 0.00 0.00 116 V 8.79 4.64 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 0.92 0.00 0.00 1.02 0.00 0.00 117 P 0.00 4.80 0.00 2.40 2.28 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.06 0.00 118 V 8.44 4.16 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 0.81 0.00 0.00 0.83 0.00 0.00 119 H 7.08 4.01 0.00 2.92 3.01 0.00 5.80 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.60 4.92 0.00 3.06 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 0.00 121 D 8.65 4.33 0.00 2.62 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 0.00 122 A 6.27 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.59 5.08 0.00 4.07 4.10 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 0.00 124 V 9.00 4.14 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 0.73 0.00 0.00 0.95 0.00 0.00