NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.6718 8.4293 116.2013 55.1567 30.3665 173.3147 2 C 4.0668 7.6428 114.1691 57.0250 30.1561 172.1389 3 D 4.5799 8.3429 118.6744 55.0829 40.1242 175.5171 4 L 4.0664 8.0522 120.4464 56.9974 42.2562 175.6567 5 P 4.5951 0.0000 0.0000 62.1293 32.4568 175.2683 6 C 4.2630 8.4495 113.4270 57.9175 30.6376 175.0004 7 G 3.9052 8.2622 107.4436 45.3737 0.0000 172.8327 8 V 4.2887 7.1884 118.9973 61.0368 32.6663 174.3728 9 Y 4.7051 8.0378 123.6073 56.6096 42.0781 174.5334 10 D 3.6411 7.8509 117.1852 51.7434 43.7505 174.7764 11 P 4.1145 0.0000 0.0000 64.4701 31.1642 178.0924 12 A 3.9763 8.5319 120.7320 54.9169 17.8022 179.6614 13 Q 3.7639 7.9511 116.6290 59.0793 28.7632 178.8616 14 A 4.0382 7.7513 121.1825 55.0590 18.4274 179.3713 15 R 3.8377 8.1561 117.3964 59.7469 30.3022 178.7445 16 I 3.6984 8.0569 119.8525 64.5425 37.0760 178.3459 17 E 4.0103 8.0061 118.7835 59.3219 29.2719 179.2789 18 A 4.0696 8.2580 120.9115 55.0891 18.3018 179.5745 19 E 3.9713 8.4643 117.6441 59.6189 29.4518 179.6995 20 S 4.1158 8.0431 114.9766 61.3337 62.8455 176.7288 21 V 3.5591 7.6862 121.0279 66.0488 31.3054 178.0837 22 K 4.1400 8.0896 119.0290 59.4128 32.1067 178.5203 23 A 4.0348 8.3101 121.3720 55.3113 18.2601 179.7298 24 I 3.7331 8.2338 118.6873 64.6150 37.1175 178.6435 25 Q 4.0296 8.0668 118.9512 59.0835 28.3794 178.8410 26 E 4.0440 8.3995 119.6132 59.3440 29.4813 179.5708 27 K 4.1169 8.1018 118.4814 59.6336 31.9105 179.3153 28 M 4.4471 8.2727 117.9883 57.9089 31.9063 177.9417 29 A 4.2834 7.7225 119.4437 53.2143 18.9200 177.6313 30 A 4.4573 7.5655 118.5191 51.6975 19.6099 176.5384 31 N 4.5590 7.8302 115.7223 53.2134 39.9697 173.1481 32 D 4.7886 8.6034 124.8839 53.1562 40.1187 176.6776 33 D 4.4161 8.5565 120.7396 54.5489 42.4533 176.1960 34 L 3.9339 8.7011 128.5406 59.0471 42.1555 179.0399 35 H 4.1288 8.3208 115.3020 58.6878 28.6569 177.5240 36 F 4.2123 8.8369 122.7097 61.3630 39.2801 177.1828 37 Q 3.8981 8.4306 117.8875 58.8974 28.3941 178.9850 38 I 3.6281 7.8946 120.7893 64.5345 37.1371 178.6547 39 R 3.8169 7.9817 118.5330 59.1928 29.7968 179.0201 40 A 3.7142 7.9559 120.8247 55.2961 18.2632 179.8660 41 T 3.7279 7.7997 114.1760 66.6202 68.4160 177.0414 42 V 3.5200 7.8605 120.2537 66.2548 31.5182 178.2319 43 I 4.0056 7.8889 121.0505 63.5766 36.8267 178.3170 44 K 3.8806 8.3669 121.0312 59.3395 31.9664 178.4103 45 E 3.8929 8.1383 119.6298 59.4320 29.5697 178.9200 46 Q 3.9754 7.8582 117.7878 59.0778 28.8012 178.9962 47 R 4.0326 8.2742 119.0606 59.1228 30.0789 178.9799 48 A 4.0179 8.3089 120.9463 55.0567 18.3729 179.2817 49 E 3.8806 8.2063 117.9030 59.4115 29.6396 179.0977 50 L 3.9556 7.9467 118.7261 57.6727 41.6592 179.3102 51 A 4.0608 8.1153 120.7655 55.1027 18.2568 179.8540 52 K 3.9186 8.2467 117.0647 59.7217 32.0884 178.9823 53 H 4.1328 8.3077 118.4603 59.7308 29.9334 176.9626 54 H 4.1880 8.2891 118.0016 58.9146 28.5206 177.8714 55 L 4.0759 8.0346 120.7569 57.9021 41.4918 179.1040 56 D 4.5643 8.5547 119.3265 57.5474 40.7279 179.1822 57 V 3.7404 8.0631 118.6758 65.9590 31.4602 178.0692 58 L 3.9162 7.9438 118.3666 57.5119 41.2497 179.3732 59 W 4.6057 8.4328 127.3932 60.6848 30.8261 177.8353 60 S 3.9793 8.8355 113.2995 60.4937 62.8455 175.1498 61 D 4.6974 8.3184 120.9641 55.9071 41.8092 177.4156 62 Y 3.4667 7.4906 118.3546 60.0798 39.0552 175.5504 63 F 4.0123 7.8411 118.2058 57.3006 39.5666 175.1614 64 K 4.5680 8.1363 123.5633 53.5417 35.2110 175.1520 65 P 4.4733 0.0000 0.0000 65.9406 31.0391 177.0860 66 P 4.2639 0.0000 0.0000 65.8409 31.1093 178.4188 67 H 4.3428 7.9927 115.0723 58.9626 28.4111 177.9235 68 F 4.3128 7.7009 117.7945 60.2821 38.8026 177.1005 69 E 4.2256 7.9490 117.4532 59.3700 29.4590 179.0132 70 S 4.3116 8.0314 114.3111 59.8259 63.9416 173.9495 71 Y 4.6049 7.9897 119.7682 54.6890 37.9051 174.0307 72 P 4.3224 0.0000 0.0000 64.8440 31.9664 177.2905 73 E 4.3883 8.1691 114.3174 56.6355 30.7546 177.7991 74 L 3.8931 8.3027 122.7169 58.7791 42.1131 178.2077 75 H 4.3997 8.4233 115.4801 59.4809 28.7311 177.6582 76 T 3.8151 7.9602 116.7286 66.4408 68.2861 176.1196 77 L 3.8492 8.2708 122.5802 58.3402 42.0988 179.3205 78 V 3.5338 7.8624 118.0388 65.8642 31.4294 177.4652 79 N 4.0165 8.0519 116.8513 56.6922 38.7019 176.7988 80 E 3.7317 8.5490 120.0586 58.8788 29.4419 179.2185 81 A 3.6696 7.5527 121.0267 55.2168 18.5024 180.1902 82 V 3.5877 7.7881 110.9829 64.3452 31.5550 179.0442 83 K 3.9685 7.9732 118.2439 59.1823 31.8271 179.2568 84 A 4.0743 8.0702 121.4496 55.0916 18.2764 179.7150 85 L 4.0147 7.8404 117.5389 57.9779 41.3997 179.8462 86 S 4.1192 8.1362 115.0404 61.4854 62.5017 176.5883 87 A 3.9906 7.9037 122.5083 55.0608 18.5292 179.2837 88 A 4.1756 7.9714 120.6852 54.4895 18.1644 179.9685 89 K 3.9396 7.7872 116.3914 59.3340 32.1755 178.3637 90 A 4.4841 7.3392 117.8730 51.2404 18.9060 176.6545 91 S 4.6316 7.2872 112.1723 57.6556 65.6382 173.9404 92 T 4.3577 8.3298 113.3016 61.2746 69.5726 173.8246 93 D 4.5303 8.2375 124.2688 53.2318 41.3965 175.0798 94 P 4.7673 0.0000 0.0000 64.7010 31.2650 178.3166 95 A 4.0067 8.7065 120.6412 55.1360 17.6648 179.7288 96 T 4.0083 8.2537 108.8546 64.8682 68.9569 177.2707 97 G 3.6267 8.0485 108.1815 47.5571 0.0000 175.3468 98 Q 3.9922 8.2962 122.1436 58.7037 29.1435 178.0916 99 K 3.7878 8.2475 120.6032 59.3396 32.2163 178.6403 100 A 4.1924 7.9502 120.5524 55.3118 18.3454 179.6079 101 L 4.0107 7.9430 117.4352 58.0039 41.7117 179.5573 102 D 4.3257 8.2567 119.1085 57.5402 40.7266 178.4347 103 Y 4.2411 7.8336 117.0224 61.2065 37.8890 178.5775 104 I 3.7850 8.1340 120.5669 64.3366 37.1829 178.3449 105 A 4.1447 8.2745 121.7146 55.2121 18.2468 179.7423 106 Q 4.0176 7.9769 116.1457 59.2074 28.7902 179.0523 107 I 3.7820 8.0321 120.9075 64.3436 37.1384 177.9068 108 D 4.4026 8.7000 119.3839 57.2026 40.9571 178.2599 109 K 4.1040 8.2688 120.0727 59.7514 32.2517 178.9047 110 I 3.5372 7.6600 119.5974 64.0299 36.7719 177.8975 111 F 4.0223 8.6819 122.0018 61.4873 38.9881 177.4656 112 W 4.2227 8.2453 117.9820 59.5160 28.7952 178.4994 113 E 4.1244 8.1154 119.0640 59.4450 28.7072 179.1411 114 T 4.1078 7.7666 108.6664 64.0825 69.0441 176.5181 115 K 4.0688 7.4096 120.6800 58.3934 32.1957 178.4714 116 K 4.2991 7.6669 117.4548 57.6806 32.6458 176.4748 117 A 4.2044 7.9511 125.9407 52.7359 18.3079 176.9401 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 H 8.43 4.67 0.00 3.28 3.35 0.00 5.48 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.64 4.07 0.00 3.10 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 3 D 8.34 4.58 0.00 2.86 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 4 L 8.05 4.07 0.00 1.59 1.74 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.60 0.00 2.28 2.09 0.00 3.81 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 1.98 1.98 0.00 6 C 8.45 4.26 0.00 3.00 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 7 G 8.26 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 0.00 0.00 0.00 8 V 7.19 4.29 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 0.87 0.00 0.00 0.91 0.00 0.00 9 Y 8.04 4.71 0.00 2.81 2.38 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 10 D 7.85 3.64 0.00 2.58 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 0.00 0.00 0.00 0.00 11 P 0.00 4.11 0.00 2.24 1.87 0.00 2.99 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.06 0.00 12 A 8.53 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 13 Q 7.95 3.76 0.00 1.83 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 14 A 7.75 4.04 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 15 R 8.16 3.84 0.00 1.89 2.08 0.00 3.12 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 16 I 8.06 3.70 1.86 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 1.52 1.16 0.91 0.00 0.00 17 E 8.01 4.01 0.00 2.16 2.21 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 2.55 2.56 0.00 18 A 8.26 4.07 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 19 E 8.46 3.97 0.00 2.20 2.02 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 2.34 2.60 0.00 20 S 8.04 4.12 0.00 4.10 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 21 V 7.69 3.56 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 1.00 0.00 0.00 0.99 0.00 0.00 22 K 8.09 4.14 0.00 1.90 1.80 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.15 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.62 7.81 23 A 8.31 4.03 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 24 I 8.23 3.73 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.79 0.90 0.00 0.00 25 Q 8.07 4.03 0.00 2.29 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.64 0.00 26 E 8.40 4.04 0.00 2.20 2.02 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 2.34 2.60 0.00 27 K 8.10 4.12 0.00 2.20 2.16 0.00 1.80 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.77 7.81 28 M 8.27 4.45 0.00 2.03 2.33 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.44 0.00 29 A 7.72 4.28 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 30 A 7.57 4.46 1.26 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 0.00 0.00 31 N 7.83 4.56 0.00 2.32 2.32 0.00 0.00 7.07 8.47 0.00 0.00 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 D 8.60 4.79 0.00 2.85 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 33 D 8.56 4.42 0.00 2.86 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 34 L 8.70 3.93 0.00 1.79 1.65 0.89 1.02 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 35 H 8.32 4.13 0.00 3.49 3.40 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.84 4.21 0.00 3.15 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 37 Q 8.43 3.90 0.00 2.29 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.68 2.59 0.00 38 I 7.89 3.63 1.99 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 0.88 0.00 0.00 39 R 7.98 3.82 0.00 1.84 1.91 0.00 3.16 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 40 A 7.96 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.80 3.73 4.33 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 1.17 0.00 0.00 42 V 7.86 3.52 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 1.01 0.00 0.00 0.92 0.00 0.00 43 I 7.89 4.01 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 1.37 0.91 0.89 0.00 0.00 44 K 8.37 3.88 0.00 1.81 1.97 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.14 3.89 0.00 2.30 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 2.29 2.38 0.00 46 Q 7.86 3.98 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 47 R 8.27 4.03 0.00 1.81 1.98 0.00 3.32 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.79 0.00 48 A 8.31 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 49 E 8.21 3.88 0.00 2.20 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 0.00 2.29 2.38 0.00 50 L 7.95 3.96 0.00 1.95 1.70 0.98 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.12 4.06 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.25 3.92 0.00 2.00 1.86 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.64 7.81 53 H 8.31 4.13 0.00 3.22 3.43 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 H 8.29 4.19 0.00 3.35 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.03 4.08 0.00 1.88 1.75 0.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.55 4.56 0.00 2.89 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 57 V 8.06 3.74 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 1.25 0.00 0.00 0.92 0.00 0.00 58 L 7.94 3.92 0.00 2.08 1.70 0.75 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.43 4.61 0.00 3.45 3.60 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 60 S 8.84 3.98 0.00 4.03 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 61 D 8.32 4.70 0.00 2.96 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 62 Y 7.49 3.47 0.00 1.43 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 63 F 7.84 4.01 0.00 2.92 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 0.00 0.00 0.00 64 K 8.14 4.57 0.00 1.46 1.56 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.78 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.27 1.15 7.81 65 P 0.00 4.47 0.00 2.15 2.18 0.00 3.56 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 66 P 0.00 4.26 0.00 1.96 2.02 0.00 3.42 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 2.00 2.12 0.00 67 H 7.99 4.34 0.00 2.91 3.13 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 7.70 4.31 0.00 3.18 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 E 7.95 4.23 0.00 2.13 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 2.63 2.51 0.00 70 S 8.03 4.31 0.00 3.83 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 71 Y 7.99 4.60 0.00 2.99 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 72 P 0.00 4.32 0.00 2.08 2.17 0.00 3.70 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 73 E 8.17 4.39 0.00 2.17 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 0.00 2.39 2.30 0.00 74 L 8.30 3.89 0.00 1.85 1.92 0.48 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.42 4.40 0.00 3.26 3.34 0.00 5.68 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.96 3.82 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 1.19 0.00 0.00 77 L 8.27 3.85 0.00 1.85 1.89 1.10 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 78 V 7.86 3.53 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 0.92 0.00 0.00 1.15 0.00 0.00 79 N 8.05 4.02 0.00 2.70 2.76 0.00 0.00 7.23 7.10 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 80 E 8.55 3.73 0.00 1.54 1.18 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 2.34 2.35 0.00 81 A 7.55 3.67 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 82 V 7.79 3.59 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 0.90 0.00 0.00 0.87 0.00 0.00 83 K 7.97 3.97 0.00 1.90 1.79 0.00 1.55 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.45 7.81 84 A 8.07 4.07 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 0.00 0.00 0.00 0.00 0.00 85 L 7.84 4.01 0.00 1.91 1.73 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.14 4.12 0.00 4.03 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 87 A 7.90 3.99 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 88 A 7.97 4.18 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 89 K 7.79 3.94 0.00 1.98 2.01 0.00 1.69 0.00 0.00 1.92 0.00 0.00 3.21 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.63 7.81 90 A 7.34 4.48 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 91 S 7.29 4.63 0.00 3.81 3.75 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 92 T 8.33 4.36 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 1.21 0.00 0.00 93 D 8.24 4.53 0.00 2.70 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 94 P 0.00 4.77 0.00 2.20 2.11 0.00 3.94 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.93 0.00 95 A 8.71 4.01 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 96 T 8.25 4.01 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 97 G 8.05 3.63 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 0.00 0.00 0.00 98 Q 8.30 3.99 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 99 K 8.25 3.79 0.00 1.96 1.98 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.28 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.31 7.81 100 A 7.95 4.19 1.44 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 0.00 0.00 0.00 101 L 7.94 4.01 0.00 1.91 1.74 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.26 4.33 0.00 2.61 2.54 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 0.00 103 Y 7.83 4.24 0.00 3.23 2.91 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 0.00 104 I 8.13 3.79 2.07 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.78 0.94 0.00 0.00 105 A 8.27 4.14 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 0.00 106 Q 7.98 4.02 0.00 2.46 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 107 I 8.03 3.78 2.10 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.79 1.07 0.00 0.00 108 D 8.70 4.40 0.00 2.92 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 0.00 109 K 8.27 4.10 0.00 1.97 2.03 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.18 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.58 7.81 110 I 7.66 3.54 1.82 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.41 -0.14 0.00 0.00 111 F 8.68 4.02 0.00 2.99 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 0.00 112 W 8.25 4.22 0.00 3.56 3.24 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 0.00 113 E 8.12 4.12 0.00 2.24 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 0.00 2.44 2.71 0.00 114 T 7.77 4.11 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 1.31 0.00 0.00 115 K 7.41 4.07 0.00 1.90 1.93 0.00 1.48 0.00 0.00 0.86 0.00 0.00 2.87 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.50 0.32 7.81 116 K 7.67 4.30 0.00 1.76 1.91 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.74 7.81 117 A 7.95 4.20 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