NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 H 4.8422 8.4449 116.3323 55.9010 29.6853 173.7883 12 H 4.4679 8.4565 121.2180 53.3579 29.9931 167.3981 13 E 4.3576 8.4905 121.4160 54.5184 30.4644 174.7455 14 V 4.3605 8.0074 126.0580 60.7924 33.4301 175.5672 15 V 3.8827 8.1305 126.2763 62.0691 32.4535 175.5111 16 K 4.1886 8.4462 127.2532 56.0111 33.2484 176.8655 17 F 4.0338 9.2204 128.4281 62.2091 39.1091 177.3795 18 M 4.1213 8.3926 117.2703 58.5081 31.6624 178.3177 19 D 4.4138 8.0445 119.0854 56.8878 41.1787 178.9213 20 V 3.5384 7.5306 118.6470 66.0371 31.5401 177.5694 21 Y 3.9232 7.5178 120.1427 60.1782 38.5397 177.5152 22 Q 4.0624 7.8171 118.0651 58.5819 28.8934 178.1692 23 R 4.2914 7.8606 117.4223 57.1566 30.3114 177.9330 24 S 4.4244 7.6999 113.5791 58.5586 63.8606 173.8305 25 Y 3.9153 7.2254 123.3746 57.5566 38.7801 173.5285 26 C 3.7742 7.3858 127.6889 57.0761 39.6808 172.1192 27 H 4.9165 8.3638 124.7291 53.7518 34.0270 170.3560 28 P 4.6032 0.0000 0.0000 62.5470 31.6355 176.0061 29 I 4.6587 9.0646 124.6270 58.6338 42.0555 173.8246 30 E 4.3369 8.7825 128.8348 56.8598 30.0787 176.0989 31 T 4.7216 8.7619 122.9023 61.8733 73.3212 172.9738 32 L 4.6829 8.5228 125.5422 54.1249 42.9523 176.2598 33 V 4.4425 8.6889 123.4866 60.8758 34.7550 174.2134 34 D 4.8055 8.5287 125.8390 53.7487 42.2936 177.3281 35 I 3.9433 8.4476 127.3371 64.5876 36.8258 178.8647 36 F 4.8669 8.4584 118.0715 60.5474 38.7443 177.1457 37 Q 4.2031 7.8866 118.7943 58.6609 28.8853 177.3094 38 E 4.3282 8.1724 118.2560 57.3316 31.6138 176.4037 39 Y 4.5597 8.4013 118.9349 55.6473 37.0445 174.3763 40 P 4.6788 0.0000 0.0000 65.0385 32.2512 177.7542 41 D 4.8607 8.1737 117.6852 54.1324 40.6677 176.4121 42 E 4.8241 8.0904 118.2447 54.8747 31.1276 174.6205 43 I 4.6598 8.2690 124.0201 62.4406 39.5908 178.2136 44 E 3.7278 8.2702 116.4833 58.5365 29.3062 176.1834 45 Y 4.3125 6.9651 116.7769 55.8660 38.1235 175.2230 46 I 3.6856 8.0558 125.6368 61.5020 38.2661 175.1211 47 F 5.3318 8.5217 125.4655 55.7972 41.2431 175.5043 48 K 4.6475 8.8106 122.0016 53.8750 35.2204 174.4873 49 P 4.9474 0.0000 0.0000 62.3468 32.5461 176.5799 50 S 4.3867 8.7125 113.1229 59.2506 63.6641 173.0292 51 C 5.2111 7.5308 114.6202 56.7766 33.1318 173.5690 52 V 4.4664 8.6958 112.2113 58.7879 35.6925 173.0780 53 P 4.7653 0.0000 0.0000 62.5042 32.2525 175.4771 54 L 4.7513 8.8974 123.6385 53.0528 46.7661 175.8312 55 M 4.7444 8.6041 122.0510 54.9826 32.8784 175.3872 56 R 4.7470 8.3781 122.0488 54.1055 34.7428 174.0788 57 C 5.0499 8.6858 117.5325 56.4660 39.5531 173.8644 58 G 4.1428 8.9669 109.6385 44.7794 0.0000 170.6611 59 G 4.2219 8.1866 106.9418 43.9783 0.0000 172.9791 60 C 4.6624 8.6529 118.8828 57.1734 32.8931 172.2919 61 C 5.2301 8.2213 117.3334 55.1507 42.1924 173.8559 62 N 4.5223 8.8416 117.1420 55.8767 38.0068 174.6923 63 D 5.0226 7.7056 115.4234 51.7831 44.7619 175.6100 64 E 3.9775 8.8025 122.0763 58.9401 29.9017 177.4770 65 G 3.8625 8.2745 105.5842 45.8763 0.0000 172.6215 66 L 5.1386 7.2449 119.9471 53.2568 44.4314 175.7688 67 E 4.5190 8.6431 117.3986 55.3728 32.9017 173.8779 68 C 4.6414 8.9493 125.2464 56.5010 39.8895 172.5381 69 V 4.7791 8.3180 118.9611 58.5476 35.7552 173.3888 70 P 4.9420 0.0000 0.0000 62.8612 31.8940 175.7790 71 T 4.4336 8.4794 111.2923 62.2909 70.8550 174.4084 72 E 4.6960 7.9613 121.9316 54.3831 33.3929 174.2817 73 E 5.1536 8.2333 124.5411 55.1308 33.4432 174.2309 74 S 4.5805 8.0829 112.6226 58.3860 66.4466 174.3110 75 N 5.5934 8.7901 120.1426 51.7176 41.5661 174.3476 76 I 4.5691 8.6460 121.2707 60.1937 41.5274 174.3871 77 T 4.8794 8.6533 126.0114 63.8612 69.8095 173.7802 78 M 4.9031 8.8153 122.0901 54.3368 37.3465 173.7209 79 Q 4.9877 8.5774 119.8397 54.9587 30.2856 175.3951 80 I 4.6395 8.6413 124.3062 59.6020 41.8552 174.4366 81 M 4.7824 8.8583 126.1283 54.4800 33.2757 174.7203 82 R 4.8357 9.2251 128.7452 55.4885 31.8473 175.0262 83 I 4.9980 8.7909 127.2149 59.4274 40.8228 174.5179 84 K 4.7419 8.3845 125.3806 53.5939 34.8720 174.3226 85 P 4.3647 0.0000 0.0000 64.2971 31.7244 176.4478 86 H 4.3166 9.0439 117.4859 56.3753 27.6094 174.8041 87 Q 4.7669 7.6186 120.5148 56.1506 29.8655 176.6400 88 G 4.1431 8.2720 108.8095 44.1576 0.0000 172.2262 89 Q 5.0830 8.2595 121.8377 55.6672 31.6296 172.9508 90 H 4.7909 8.9494 114.5505 55.0471 33.9351 173.2544 91 I 4.5583 8.5927 123.3552 61.0532 37.9847 175.5157 92 G 4.2697 9.4324 113.2563 44.4444 0.0000 170.9783 93 E 5.1257 8.6538 120.4185 55.1403 31.0816 175.5947 94 M 4.6870 8.8871 124.1314 53.3736 35.3709 174.8752 95 S 5.1850 8.5193 118.3007 57.3360 65.1394 173.5188 96 F 4.8753 9.1149 119.8753 55.7289 43.4007 173.3092 97 L 4.9700 7.9792 120.9984 54.2905 43.1356 175.5333 98 Q 4.7793 9.3852 124.1101 54.4859 33.4104 173.4973 99 H 5.0560 8.5734 117.3001 54.9587 29.6253 175.0923 100 N 4.5913 9.3930 122.1035 55.4800 39.2020 175.7793 101 K 4.7613 7.9395 116.6834 54.6988 35.9943 175.7552 102 C 5.3593 8.4117 118.5283 55.7089 38.4344 173.0990 103 E 4.7663 8.7756 119.7935 55.8324 34.4192 173.2215 104 C 5.2215 8.6760 118.8638 55.8252 40.6920 173.5187 105 R 4.8932 8.3725 121.0442 53.4798 34.4509 172.9939 106 P 4.8768 0.0000 0.0000 62.2288 32.2217 176.6974 107 K 4.5169 8.7747 124.0700 56.3309 32.2424 177.2082 108 K 4.4001 8.7783 124.4972 55.5563 33.5375 176.3456 109 D 4.4011 8.3139 119.3781 54.5633 41.5071 175.3129 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 11 H 8.44 4.84 0.00 3.28 3.38 0.00 5.47 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.46 4.47 0.00 3.18 3.21 0.00 5.70 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 13 E 8.49 4.36 0.00 1.95 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 2.25 2.30 0.00 14 V 8.01 4.36 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 0.97 0.00 0.00 0.97 0.00 0.00 15 V 8.13 3.88 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 0.78 0.00 0.00 0.95 0.00 0.00 16 K 8.45 4.19 0.00 1.83 1.88 0.00 1.87 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.41 7.81 17 F 9.22 4.03 0.00 3.17 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 18 M 8.39 4.12 0.00 2.26 2.19 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 2.75 2.72 0.00 19 D 8.04 4.41 0.00 2.93 2.71 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 20 V 7.53 3.54 1.97 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 0.90 0.00 0.00 0.95 0.00 0.00 21 Y 7.52 3.92 0.00 2.66 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.82 4.06 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.66 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 23 R 7.86 4.29 0.00 1.89 1.96 0.00 3.15 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 24 S 7.70 4.42 0.00 4.00 4.12 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 25 Y 7.23 3.92 0.00 2.45 2.72 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 0.00 0.00 0.00 0.00 26 C 7.39 3.77 0.00 2.88 2.42 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 27 H 8.36 4.92 0.00 3.16 3.04 0.00 5.66 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.60 0.00 1.91 1.93 0.00 3.27 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.95 0.00 29 I 9.06 4.66 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.46 0.95 0.00 0.00 30 E 8.78 4.34 0.00 2.00 1.83 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 2.26 2.31 0.00 31 T 8.76 4.72 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 1.18 0.00 0.00 32 L 8.52 4.68 0.00 1.49 1.55 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.69 4.44 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 0.89 0.00 0.00 0.92 0.00 0.00 34 D 8.53 4.81 0.00 2.77 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 35 I 8.45 3.94 1.60 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.40 0.52 0.00 0.00 36 F 8.46 4.87 0.00 3.32 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 37 Q 7.89 4.20 0.00 2.08 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 38 E 8.17 4.33 0.00 2.17 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 2.38 2.63 0.00 39 Y 8.40 4.56 0.00 3.12 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 40 P 0.00 4.68 0.00 2.24 2.25 0.00 3.78 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 2.03 2.01 0.00 41 D 8.17 4.86 0.00 2.77 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 42 E 8.09 4.82 0.00 2.40 2.29 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 2.48 2.65 0.00 43 I 8.27 4.66 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.21 0.74 0.00 0.00 44 E 8.27 3.73 0.00 1.72 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 2.22 1.78 0.00 45 Y 6.97 4.31 0.00 2.67 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 46 I 8.06 3.69 1.92 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 1.24 0.63 0.93 0.00 0.00 47 F 8.52 5.33 0.00 2.77 2.79 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 48 K 8.81 4.65 0.00 1.85 1.70 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.37 7.81 49 P 0.00 4.95 0.00 2.04 2.05 0.00 3.75 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 2.04 1.93 0.00 50 S 8.71 4.39 0.00 4.00 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 0.00 51 C 7.53 5.21 0.00 3.03 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 52 V 8.70 4.47 1.60 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 0.24 0.00 0.00 -0.13 0.00 0.00 53 P 0.00 4.77 0.00 2.01 1.99 0.00 3.56 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 54 L 8.90 4.75 0.00 1.46 1.47 0.80 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 55 M 8.60 4.74 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 56 R 8.38 4.75 0.00 1.58 1.58 0.00 2.76 0.00 0.00 3.01 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.59 0.00 57 C 8.69 5.05 0.00 2.87 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 58 G 8.97 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 0.00 0.00 0.00 0.00 59 G 8.19 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 0.00 0.00 0.00 0.00 60 C 8.65 4.66 0.00 3.08 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 61 C 8.22 5.23 0.00 2.98 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 62 N 8.84 4.52 0.00 2.85 2.99 0.00 0.00 6.88 8.04 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 63 D 7.71 5.02 0.00 2.74 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.80 3.98 0.00 1.97 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 2.30 2.38 0.00 65 G 8.27 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.24 5.14 0.00 1.74 1.65 1.02 0.86 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 67 E 8.64 4.52 0.00 1.99 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 2.36 2.25 0.00 68 C 8.95 4.64 0.00 2.92 3.03 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 69 V 8.32 4.78 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 0.71 0.00 0.00 0.97 0.00 0.00 70 P 0.00 4.94 0.00 1.84 1.69 0.00 3.65 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.45 0.00 71 T 8.48 4.43 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 1.19 0.00 0.00 72 E 7.96 4.70 0.00 1.96 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 2.25 2.25 0.00 73 E 8.23 5.15 0.00 1.84 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 2.17 2.21 0.00 74 S 8.08 4.58 0.00 3.84 3.72 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 0.00 0.00 0.00 0.00 75 N 8.79 5.59 0.00 2.60 2.69 0.00 0.00 6.60 7.42 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 76 I 8.65 4.57 2.05 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 1.27 1.57 1.09 0.00 0.00 77 T 8.65 4.88 4.26 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 1.22 0.00 0.00 78 M 8.82 4.90 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 79 Q 8.58 4.99 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 80 I 8.64 4.64 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.90 0.98 0.00 0.00 81 M 8.86 4.78 0.00 2.14 1.98 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 2.56 2.49 0.00 82 R 9.23 4.84 0.00 1.96 1.83 0.00 2.84 0.00 0.00 3.32 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.49 0.00 83 I 8.79 5.00 1.86 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 1.23 1.10 0.96 0.00 0.00 84 K 8.38 4.74 0.00 1.69 1.63 0.00 0.89 0.00 0.00 1.54 0.00 0.00 2.68 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.15 1.55 7.81 85 P 0.00 4.36 0.00 1.93 1.91 0.00 3.64 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.04 0.00 86 H 9.04 4.32 0.00 3.25 3.42 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 Q 7.62 4.77 0.00 1.99 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.70 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 88 G 8.27 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 0.00 0.00 0.00 0.00 89 Q 8.26 5.08 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.66 0.00 0.00 0.00 0.00 0.00 2.20 2.34 0.00 90 H 8.95 4.79 0.00 3.09 3.15 0.00 5.63 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 91 I 8.59 4.56 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 1.31 0.76 0.92 0.00 0.00 92 G 9.43 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 0.00 0.00 0.00 93 E 8.65 5.13 0.00 1.83 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 2.25 2.31 0.00 94 M 8.89 4.69 0.00 1.39 1.91 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.33 0.00 95 S 8.52 5.18 0.00 3.82 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 96 F 9.11 4.88 0.00 2.98 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 97 L 7.98 4.97 0.00 1.70 1.57 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 9.39 4.78 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.56 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 99 H 8.57 5.06 0.00 2.98 3.17 0.00 5.66 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 N 9.39 4.59 0.00 2.57 2.85 0.00 0.00 6.87 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 0.00 101 K 7.94 4.76 0.00 1.61 1.64 0.00 1.62 0.00 0.00 1.80 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.36 7.81 102 C 8.41 5.36 0.00 2.69 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 0.00 103 E 8.78 4.77 0.00 1.89 1.79 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 2.27 2.28 0.00 104 C 8.68 5.22 0.00 2.92 3.04 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 0.00 105 R 8.37 4.89 0.00 1.62 1.76 0.00 3.29 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.71 0.00 106 P 0.00 4.88 0.00 1.94 1.99 0.00 3.69 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 2.03 2.13 0.00 107 K 8.77 4.52 0.00 1.61 1.77 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.48 1.45 7.81 108 K 8.78 4.40 0.00 1.74 1.73 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.59 7.81 109 D 8.31 4.40 0.00 2.57 2.46 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