NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2316 8.3144 121.7894 55.9288 33.3838 175.0364 2 E 3.9968 8.3656 125.7849 54.0534 30.5794 174.9795 3 T 4.0822 8.6536 117.8308 61.3383 72.0487 175.0292 4 A 3.9914 8.4976 123.5381 55.3024 18.4678 180.0131 5 A 4.1118 7.9675 118.6271 55.3147 18.4969 179.5909 6 A 4.3621 8.0852 120.7091 54.6083 18.3634 179.7978 7 K 4.1538 8.2354 119.6624 59.0708 32.1939 178.8610 8 F 4.0331 8.3807 121.0287 61.1569 39.1470 176.9169 9 E 4.0270 8.4792 118.2463 59.6090 29.1267 179.4062 10 R 3.8954 7.9582 117.3302 59.4768 30.2044 178.1339 11 Q 3.9709 7.9714 116.9390 57.8267 29.1222 176.2172 12 H 4.7266 7.8993 113.9671 54.2300 31.1980 173.3360 13 M 4.7681 7.9809 118.9467 53.7390 33.8971 176.2155 14 D 4.7282 9.0591 122.9913 52.9284 41.8589 175.5890 15 S 4.5395 8.5288 116.2321 58.9065 63.5984 175.4866 16 S 4.3799 8.0166 114.9827 59.8830 63.2652 174.2478 17 T 4.7516 7.4729 109.9780 59.6808 71.5084 174.0387 18 S 4.1778 8.6160 116.5252 59.7946 63.6706 173.6278 19 A 3.5869 7.0613 122.0396 51.0566 20.9431 175.4608 20 A 3.2331 8.5489 123.6021 52.6415 18.5299 178.1775 21 S 4.3604 8.4781 117.0142 59.4974 63.3565 173.2531 22 S 4.5987 7.4272 113.1828 57.3381 65.0858 175.4278 23 S 4.2820 8.6309 114.6830 60.6898 62.9763 174.6208 24 N 4.7523 8.2110 118.0816 53.4810 38.9966 176.0142 25 Y 3.9943 8.1532 121.0456 61.1286 38.7955 177.6272 26 C 4.1421 8.3230 117.0924 60.0123 39.0376 175.6914 27 N 4.3976 8.2394 117.5431 56.6342 38.0929 177.3359 28 Q 3.9084 7.8714 119.0872 59.2700 28.8193 178.7142 29 M 3.8060 7.7074 121.3345 57.7549 31.8038 178.7727 30 M 4.0356 8.2751 119.2305 57.7837 31.9233 178.7338 31 K 3.9716 7.6255 119.4888 59.3223 32.3955 179.0763 32 S 4.2229 8.2187 114.4179 60.7388 62.7073 175.4823 33 R 4.3826 7.7490 119.9230 55.1713 30.0589 175.7309 34 N 4.2354 7.8030 114.8635 54.7233 36.6514 174.7524 35 L 4.5556 8.0884 115.9493 54.9420 41.8805 177.8927 36 T 5.3857 7.5256 105.5868 59.9524 69.2017 174.8461 37 K 3.8383 7.9266 120.1345 59.8793 32.4119 177.0986 38 D 4.5946 7.7271 118.3966 54.6350 42.4295 176.5737 39 R 4.0197 7.2635 115.9145 54.7794 34.3089 174.1389 40 C 4.9693 8.5207 116.9019 55.4562 40.8278 174.0755 41 K 4.2038 8.5463 127.4500 55.7992 32.5852 174.8172 42 P 4.7337 0.0000 0.0000 64.9383 32.4559 176.4281 43 V 5.0699 7.5515 117.9902 60.9306 34.8397 174.2761 44 N 4.6738 9.2217 124.6271 52.9048 42.8706 172.8507 45 T 4.7427 8.0188 122.3644 61.8011 71.1280 173.1877 46 F 4.8242 8.9623 124.8864 55.7048 41.9768 174.6931 47 V 4.3917 8.9516 123.3269 61.1683 33.0864 175.9216 48 H 5.6839 8.8369 129.3326 53.8260 26.1947 173.2585 49 E 4.7855 7.6569 117.7513 53.4051 34.5847 176.3921 50 S 4.3718 8.3715 114.7552 58.2815 64.9256 174.9154 51 L 4.0012 8.5314 124.2646 58.3388 41.8880 179.1587 52 A 4.1495 7.9906 120.2320 55.4198 18.1664 179.2049 53 D 4.3293 8.0902 116.0403 57.3470 41.2168 178.6186 54 A 4.1895 8.1116 121.4384 55.2924 18.5563 179.7213 55 Q 3.8396 8.5035 116.7351 58.9238 28.7747 178.8105 56 A 4.0328 8.1492 121.4969 54.5908 18.2340 179.6685 57 V 3.4602 7.5217 116.9379 66.0155 31.3028 177.0056 58 C 3.7192 7.7323 114.7134 58.0124 39.8629 174.2045 59 S 4.6723 7.5012 114.1945 57.9606 63.8642 174.5770 60 Q 4.0985 7.3717 121.9881 56.0591 27.1615 177.7727 61 K 4.3503 8.2760 130.8308 56.8276 32.9546 175.0253 62 N 4.2160 8.8002 127.5156 53.5464 39.0645 174.3332 63 V 4.5938 8.3429 118.4579 59.1748 36.6868 174.9956 64 A 4.3346 8.4201 124.8867 52.3664 19.0561 178.4412 65 C 4.7324 8.7116 118.8383 55.7804 41.4316 175.3507 66 K 3.7581 8.9724 121.8057 59.6861 31.6178 178.1981 67 N 4.4918 8.0252 113.0988 53.2445 37.5225 175.8083 68 G 3.9323 8.2787 108.6027 45.4116 0.0000 174.1140 69 Q 4.2304 8.6624 119.6337 56.2743 29.2649 176.4191 70 T 4.6789 8.3428 108.2908 61.6357 69.1146 174.0583 71 N 5.1166 7.9740 118.2795 53.7227 38.5135 174.5681 72 C 5.4227 7.5115 115.9583 56.7234 44.3879 172.6740 73 Y 5.1022 8.9765 118.7132 56.2851 41.6534 173.9473 74 Q 5.1623 8.9648 125.1915 53.8727 31.3761 174.8853 75 S 4.4053 8.8597 122.3805 58.8777 62.9187 174.4921 76 Y 4.5006 9.2021 122.2097 60.2722 37.8987 176.5277 77 S 4.9160 7.8342 112.4845 56.1890 65.6290 173.5341 78 T 4.2084 8.0352 111.1502 62.0113 69.7477 173.5667 79 M 5.0608 9.0356 121.7174 53.4227 37.0443 174.5639 80 S 5.0471 9.4707 117.4419 58.3725 63.6022 173.1305 81 I 5.2682 9.1565 120.0979 59.6722 41.8050 174.1242 82 T 4.9816 8.8998 119.0051 61.9847 72.1491 172.5335 83 D 5.0121 9.2835 127.0855 53.2242 43.3193 174.2437 84 C 5.6241 9.0615 122.8748 55.3691 42.3510 173.2442 85 R 5.4238 8.8766 121.6525 54.1740 34.0787 174.7404 86 E 4.1828 9.0676 123.0534 56.8811 30.7183 177.4257 87 T 4.3675 8.1943 114.0501 60.0471 71.0259 175.8052 88 G 3.5468 8.4694 109.7366 48.5055 0.0000 174.6952 89 S 4.3719 7.4102 111.9516 58.4613 63.4151 174.1685 90 S 4.1463 7.4628 117.1441 58.0972 62.7135 173.4990 91 K 4.2697 8.6414 127.1239 55.4016 35.2456 174.0396 92 Y 4.3077 8.7439 128.0306 57.7973 39.0857 174.0773 93 P 3.3830 0.0000 0.0000 62.7272 32.2789 176.6457 94 N 4.8462 8.3591 116.6383 52.7047 37.7622 173.9767 95 C 4.5890 7.7407 115.9240 57.1044 38.5704 173.7139 96 A 4.9446 8.3562 123.4572 50.8638 22.2531 174.8667 97 Y 5.1232 9.6152 120.0321 55.9493 41.8190 175.1199 98 K 4.4760 9.1572 124.3187 55.8464 34.1396 175.3255 99 T 5.0257 8.5903 123.7271 62.3747 70.3473 174.0376 100 T 4.5269 8.9022 123.8717 61.6778 71.3671 173.1639 101 Q 4.7846 8.7202 128.0070 55.7550 30.3390 174.4044 102 A 4.6029 8.8519 126.0066 51.3689 23.7408 174.6868 103 N 5.4481 8.6638 115.8477 51.8515 41.0260 174.3925 104 K 4.7293 8.8320 122.3166 54.9437 37.7748 175.4921 105 H 4.8275 8.7428 118.5191 55.8690 30.0334 174.8156 106 I 4.7154 8.6885 115.4966 59.3358 40.7494 174.4918 107 I 4.9033 8.0631 124.0155 59.7761 40.0435 175.0559 108 V 4.8233 8.5923 119.6673 59.3097 35.7726 174.5457 109 A 5.0356 8.6210 124.6548 51.0951 20.6359 175.7613 110 C 5.2473 8.7267 119.2391 55.2440 38.0791 173.1479 111 E 4.6657 8.5960 117.7857 56.5757 33.1356 175.4192 112 G 4.0984 9.6478 106.8623 44.7798 0.0000 171.7163 113 N 5.0459 8.1416 116.0762 50.7534 40.5834 172.2695 114 P 4.3075 0.0000 0.0000 62.9354 31.8730 175.8354 115 Y 4.8217 8.2389 121.2542 56.6769 38.6961 174.4116 116 V 4.4062 7.9576 119.2009 58.2090 36.6980 173.4080 117 P 4.4167 0.0000 0.0000 62.9596 30.9928 177.0817 118 V 4.4386 8.4631 115.5408 61.2025 33.8460 175.3847 119 H 5.1407 7.8581 116.6323 54.5629 33.4602 172.1910 120 F 4.7389 8.9867 124.8763 57.3383 39.4999 174.6207 121 D 4.5707 8.5834 127.1406 56.1299 41.9969 175.6326 122 A 4.5798 6.4561 117.7277 51.7716 22.3254 174.7421 123 S 5.1017 8.8291 112.5611 56.7607 66.3868 174.5546 124 V 4.1186 8.8403 120.6307 63.2847 31.3009 174.9905 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 4.23 0.00 1.74 1.78 0.00 1.75 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 8.37 4.00 0.00 2.13 1.80 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 2.39 2.37 0.00 3 T 8.65 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 A 8.50 3.99 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 5 A 7.97 4.11 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 6 A 8.09 4.36 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 7 K 8.24 4.15 0.00 2.01 2.01 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.30 7.81 8 F 8.38 4.03 0.00 3.18 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 9 E 8.48 4.03 0.00 2.31 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 2.46 2.63 0.00 10 R 7.96 3.90 0.00 1.79 1.93 0.00 3.36 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 1.62 1.66 0.00 11 Q 7.97 3.97 0.00 1.50 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.46 0.00 0.00 0.00 0.00 0.00 2.23 2.46 0.00 12 H 7.90 4.73 0.00 1.92 2.68 0.00 5.59 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.98 4.77 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.68 0.00 14 D 9.06 4.73 0.00 2.62 2.43 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 15 S 8.53 4.54 0.00 3.93 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 16 S 8.02 4.38 0.00 3.99 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 17 T 7.47 4.75 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 1.26 0.00 0.00 18 S 8.62 4.18 0.00 3.96 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 19 A 7.06 3.59 1.12 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 20 A 8.55 3.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.48 4.36 0.00 3.82 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 22 S 7.43 4.60 0.00 4.02 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 23 S 8.63 4.28 0.00 4.04 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 24 N 8.21 4.75 0.00 2.85 2.88 0.00 0.00 6.44 7.40 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 25 Y 8.15 3.99 0.00 3.13 3.02 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 26 C 8.32 4.14 0.00 3.17 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 27 N 8.24 4.40 0.00 2.90 2.92 0.00 0.00 7.12 7.58 0.00 0.00 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 7.87 3.91 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 29 M 7.71 3.81 0.00 0.76 1.17 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.50 0.00 30 M 8.28 4.04 0.00 1.62 1.76 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.30 0.00 31 K 7.63 3.97 0.00 1.92 1.89 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.44 7.81 32 S 8.22 4.22 0.00 4.00 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 33 R 7.75 4.38 0.00 1.95 2.12 0.00 3.58 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.06 0.00 34 N 7.80 4.24 0.00 2.89 2.92 0.00 0.00 6.85 7.97 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 35 L 8.09 4.56 0.00 1.79 1.63 0.80 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.53 5.39 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 1.46 0.00 0.00 37 K 7.93 3.84 0.00 1.80 1.92 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.63 1.46 7.81 38 D 7.73 4.59 0.00 2.55 2.57 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 0.00 0.00 0.00 0.00 39 R 7.26 4.02 0.00 1.71 1.64 0.00 3.01 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.42 0.00 40 C 8.52 4.97 0.00 3.08 3.12 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 41 K 8.55 4.20 0.00 1.87 1.77 0.00 1.75 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.61 1.39 7.81 42 P 0.00 4.73 0.00 2.18 2.31 0.00 3.89 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.82 0.00 43 V 7.55 5.07 2.11 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 0.82 0.00 0.00 0.97 0.00 0.00 44 N 9.22 4.67 0.00 2.64 2.28 0.00 0.00 6.87 7.44 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 45 T 8.02 4.74 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 0.83 0.00 0.00 46 F 8.96 4.82 0.00 2.97 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.95 4.39 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 1.16 0.00 0.00 1.08 0.00 0.00 48 H 8.84 5.68 0.00 3.13 3.40 0.00 5.63 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.66 4.79 0.00 1.95 1.85 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 2.27 2.28 0.00 50 S 8.37 4.37 0.00 4.07 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 51 L 8.53 4.00 0.00 1.83 1.74 1.02 1.21 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 52 A 7.99 4.15 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 53 D 8.09 4.33 0.00 2.83 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 54 A 8.11 4.19 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 8.50 3.84 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 56 A 8.15 4.03 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 57 V 7.52 3.46 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 1.08 0.00 0.00 0.92 0.00 0.00 58 C 7.73 3.72 0.00 2.86 2.66 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 59 S 7.50 4.67 0.00 3.92 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 60 Q 7.37 4.10 0.00 1.82 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.95 0.00 0.00 0.00 0.00 0.00 1.55 2.11 0.00 61 K 8.28 4.35 0.00 2.20 1.90 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.51 1.46 7.81 62 N 8.80 4.22 0.00 2.70 2.63 0.00 0.00 7.00 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 63 V 8.34 4.59 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 0.68 0.00 0.00 0.82 0.00 0.00 64 A 8.42 4.33 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 0.00 0.00 65 C 8.71 4.73 0.00 3.11 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 66 K 8.97 3.76 0.00 1.72 1.87 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.47 7.81 67 N 8.03 4.49 0.00 2.80 2.91 0.00 0.00 6.23 7.00 0.00 0.00 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 8.28 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 69 Q 8.66 4.23 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 70 T 8.34 4.68 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 1.19 0.00 0.00 71 N 7.97 5.12 0.00 3.09 3.17 0.00 0.00 6.05 7.68 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 72 C 7.51 5.42 0.00 2.87 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 73 Y 8.98 5.10 0.00 2.79 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 74 Q 8.96 5.16 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 75 S 8.86 4.41 0.00 3.92 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 76 Y 9.20 4.50 0.00 3.01 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 77 S 7.83 4.92 0.00 3.99 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 78 T 8.04 4.21 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 1.00 0.00 0.00 79 M 9.04 5.06 0.00 1.95 2.01 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 2.54 2.50 0.00 80 S 9.47 5.05 0.00 3.88 3.95 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 81 I 9.16 5.27 1.98 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 1.41 0.66 1.09 0.00 0.00 82 T 8.90 4.98 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 1.28 0.00 0.00 83 D 9.28 5.01 0.00 2.79 2.55 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 0.00 0.00 0.00 84 C 9.06 5.62 0.00 2.97 2.85 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 85 R 8.88 5.42 0.00 1.78 1.81 0.00 3.17 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 86 E 9.07 4.18 0.00 1.84 1.69 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 1.68 2.08 0.00 87 T 8.19 4.37 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 1.23 0.00 0.00 88 G 8.47 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.41 4.37 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 90 S 7.46 4.15 0.00 3.84 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 91 K 8.64 4.27 0.00 1.80 1.59 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.37 7.81 92 Y 8.74 4.31 0.00 3.10 2.85 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 93 P 0.00 3.38 0.00 1.72 1.02 0.00 3.63 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 94 N 8.36 4.85 0.00 2.81 2.73 0.00 0.00 7.06 5.12 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 95 C 7.74 4.59 0.00 3.10 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 96 A 8.36 4.94 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 97 Y 9.62 5.12 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 98 K 9.16 4.48 0.00 1.86 1.86 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.46 7.81 99 T 8.59 5.03 4.32 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 1.35 0.00 0.00 100 T 8.90 4.53 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 1.23 0.00 0.00 101 Q 8.72 4.78 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.73 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 102 A 8.85 4.60 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 0.00 103 N 8.66 5.45 0.00 2.57 2.74 0.00 0.00 6.67 7.61 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 0.00 104 K 8.83 4.73 0.00 1.71 1.73 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.62 7.81 105 H 8.74 4.83 0.00 3.18 3.25 0.00 5.78 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.69 4.72 1.84 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.22 1.15 0.00 0.00 107 I 8.06 4.90 1.78 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 1.15 0.64 0.85 0.00 0.00 108 V 8.59 4.82 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 0.73 0.00 0.00 0.79 0.00 0.00 109 A 8.62 5.04 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 0.00 110 C 8.73 5.25 0.00 1.83 1.75 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 0.00 111 E 8.60 4.67 0.00 2.04 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 2.06 2.17 0.00 112 G 9.65 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 0.00 0.00 0.00 113 N 8.14 5.05 0.00 2.62 2.69 0.00 0.00 6.90 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 0.00 114 P 0.00 4.31 0.00 2.21 2.05 0.00 3.81 0.00 0.00 3.59 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 Y 8.24 4.82 0.00 2.82 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 0.00 116 V 7.96 4.41 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 0.69 0.00 0.00 0.83 0.00 0.00 117 P 0.00 4.42 0.00 0.49 0.75 0.00 3.30 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 118 V 8.46 4.44 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 0.63 0.00 0.00 0.93 0.00 0.00 119 H 7.86 5.14 0.00 3.08 3.18 0.00 5.60 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.99 4.74 0.00 2.70 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 D 8.58 4.57 0.00 2.59 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 6.46 4.58 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 0.00 0.00 123 S 8.83 5.10 0.00 4.10 4.09 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 0.00 124 V 8.84 4.12 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 0.78 0.00 0.00 0.94 0.00 0.00