NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3724 8.1776 115.2806 58.1498 63.8113 174.5262 2 I 3.5237 7.9745 120.7059 62.9707 37.9992 176.6069 3 Q 4.1124 8.1343 120.5449 58.0367 29.6187 178.1889 4 A 4.2013 7.0815 119.7956 53.4251 19.4146 177.7573 5 E 3.6609 7.6286 117.2670 55.8484 29.6498 178.1610 6 E 3.9504 8.3530 121.5512 58.4070 30.0209 177.5420 7 W 4.5924 7.1528 115.2178 56.4701 28.7905 174.7588 8 Y 5.1593 7.6291 121.6211 57.0065 37.7243 174.7351 9 F 4.5787 9.1499 126.4432 56.4651 40.5109 178.3831 10 G 3.3551 5.8832 110.6186 46.8061 0.0000 176.3748 11 K 4.2782 8.5324 121.1375 54.7257 30.5558 175.2946 12 I 4.6799 7.5413 115.7538 57.7666 40.9051 176.6657 13 T 4.3514 8.1276 112.8047 61.1671 71.1206 175.6609 14 R 3.8188 8.6508 120.8075 59.4363 29.9721 178.4182 15 R 3.8971 7.8945 118.2015 59.3329 30.1556 178.0100 16 E 3.9970 8.2661 119.5025 59.1674 29.6775 178.8153 17 S 4.1748 8.3821 114.6424 61.6748 62.9550 176.4489 18 E 4.0250 8.3607 122.1548 58.7959 28.9367 179.1752 19 R 3.9051 7.7908 118.2438 59.5077 30.2450 178.3310 20 L 4.1877 7.8729 117.4775 57.8316 41.7427 179.1976 21 L 4.1978 7.9513 117.6449 56.5250 42.8767 178.3813 22 L 4.4691 7.8048 121.0666 52.8337 39.0366 176.0999 23 N 4.9185 7.2500 117.7663 51.2553 41.5281 174.8229 24 A 4.0785 8.7762 128.4663 55.0338 18.5587 177.9657 25 E 4.1664 8.7048 114.2078 57.6583 29.9529 176.6341 26 N 4.5081 7.9348 118.0681 52.0535 39.1231 173.5220 27 P 4.5538 0.0000 0.0000 61.2517 32.8358 175.5072 28 R 3.9637 8.1961 117.4619 58.2270 30.2997 177.6266 29 G 4.1209 9.1758 109.7890 46.4055 0.0000 173.3690 30 T 4.6584 7.5897 117.1484 64.1312 69.6927 173.3334 31 F 5.4677 8.7815 119.6512 56.1360 42.2848 172.6158 32 L 4.3991 8.6463 117.1867 54.5977 43.7992 174.1299 33 V 5.1375 9.0014 121.3618 61.3282 34.3829 174.6142 34 R 5.0099 9.1643 123.1688 54.1301 33.5554 174.1305 35 E 4.5721 8.9886 119.2669 56.2174 30.2040 177.2496 36 S 4.2655 8.5197 117.8572 58.1374 62.6844 175.0095 37 E 3.9266 9.1834 127.8127 59.1078 29.4045 177.8385 38 T 4.4815 7.4104 104.6950 60.7118 70.4338 173.7111 39 T 4.3694 8.3802 120.7741 61.1992 68.8568 174.2253 40 K 4.0305 8.4717 126.4295 58.0967 32.8939 178.1196 41 G 3.8005 8.6334 108.3590 45.9200 0.0000 173.4235 42 A 4.5428 7.3391 121.5225 51.2941 21.1333 175.5192 43 Y 5.3564 8.8906 116.2526 56.3321 42.7529 174.2414 44 C 5.2474 9.5111 119.9772 57.8219 35.2039 172.3376 45 L 4.9990 9.4018 128.9353 53.9448 43.2696 174.8099 46 S 5.2198 8.8776 123.6865 56.9759 65.0417 173.7966 47 V 5.0849 8.7338 124.3579 61.1031 34.9344 174.7067 48 S 5.0080 9.2154 122.3564 58.0170 65.2681 172.3172 49 D 5.1858 9.1951 120.5195 53.2982 45.6235 173.7637 50 F 5.4176 8.7472 121.6240 57.9986 42.2632 172.5492 51 D 4.7295 7.7557 124.2104 51.8524 42.5258 176.0267 52 N 4.3057 8.8369 116.5189 56.3709 38.8881 176.9830 53 A 4.0352 7.9999 120.0521 55.0293 18.5720 178.5141 54 K 4.1367 8.6670 112.9773 55.7930 33.7825 179.4867 55 G 3.1577 7.9936 108.4657 45.3236 0.0000 172.2208 56 L 4.9321 8.4590 124.6587 55.1678 42.9264 177.0020 57 N 5.0697 8.9735 122.4209 51.9168 41.4242 173.0848 58 V 4.9112 8.2427 118.1190 61.0142 34.5691 174.5303 59 K 4.5831 8.8867 125.4804 54.7693 35.7384 174.6892 60 H 5.1115 8.2685 119.5474 54.1229 31.8469 172.4975 61 Y 4.6653 8.7789 121.1715 55.7839 40.6398 174.9299 62 K 4.5868 8.8817 126.3054 56.3404 33.3488 175.7375 63 I 4.6383 8.9253 128.8515 59.8714 39.3432 175.1736 64 R 4.6638 8.6526 126.6608 54.5648 32.7205 175.6118 65 K 4.5547 8.0276 121.5617 54.6754 34.3113 176.1543 66 L 4.3926 8.6359 127.9248 54.3519 42.5599 177.5129 67 D 4.5662 8.3467 118.5160 56.0847 41.3212 178.5975 68 S 4.1774 7.9923 114.7848 60.8113 62.9606 174.4208 69 G 3.8577 7.1894 107.2996 45.3036 0.0000 174.2897 70 G 4.2022 8.1258 107.3686 45.5512 0.0000 172.7094 71 F 5.5880 9.2939 120.8719 56.0720 41.7314 174.5447 72 Y 5.1909 8.4268 118.1637 57.2887 41.0060 175.0615 73 I 4.1511 9.0891 121.2637 63.1856 38.3797 176.1856 74 T 4.7775 7.8322 114.5470 59.7235 69.1143 174.8166 75 S 2.7900 8.6921 123.1291 60.6662 62.9029 175.8885 76 R 3.8568 7.8135 119.1705 58.3025 29.9580 176.2488 77 T 4.1115 7.8939 114.1465 61.5206 69.0364 173.1210 78 Q 4.7880 7.6662 124.1401 53.9594 31.5909 175.2506 79 F 4.9307 8.6032 117.1070 55.9582 42.9849 175.9274 80 N 4.8453 8.5632 119.2244 55.3473 38.9480 176.0123 81 S 4.2823 7.6435 112.0131 55.6328 66.9779 174.7394 82 L 3.3599 6.9199 123.8617 58.0902 41.7099 179.1007 83 Q 4.2238 7.9212 117.4299 59.3378 28.7906 178.7514 84 Q 3.9146 8.0233 118.8662 58.6908 28.6517 178.7945 85 L 2.4400 7.5107 121.2649 57.6321 41.9264 179.0607 86 V 3.1105 7.3645 116.8391 65.8271 31.5344 177.4646 87 A 3.9847 7.8561 120.4180 55.1982 18.2579 178.9596 88 Y 3.6989 7.6220 117.9285 60.9492 38.8116 177.5353 89 Y 4.4037 7.7293 115.9652 59.5630 37.8329 177.3334 90 S 4.6856 7.2799 116.3820 58.9515 63.2228 174.5922 91 K 4.2659 7.4155 119.3021 56.1389 33.8528 175.9780 92 H 4.6532 7.4774 114.7566 53.5783 31.7606 173.2908 93 A 4.1306 8.7744 127.4064 54.4710 19.8980 179.5160 94 D 4.3985 7.8165 112.7236 55.9450 40.3155 175.0427 95 G 3.9361 8.9583 116.2468 46.3159 0.0000 173.4584 96 L 3.8871 7.8652 121.3387 53.6990 42.3185 177.9069 97 C 4.3837 8.7345 115.6380 61.1776 29.7988 173.2945 98 H 4.4410 7.0583 116.0760 54.9957 32.5516 173.6113 99 R 4.1219 7.6248 120.2626 55.6538 30.2516 176.0153 100 L 4.2198 8.4517 120.9452 55.1738 41.3394 175.9014 101 T 4.7243 8.0153 113.2017 61.8688 70.1194 174.2072 102 T 4.9600 7.7115 109.0749 58.3773 73.4151 173.2554 103 V 3.4812 8.3414 122.4545 62.9266 32.1880 175.2479 104 C 4.3353 8.3151 128.5543 58.8259 31.9487 171.7902 105 P 4.5421 0.0000 0.0000 62.8725 31.8714 176.5951 106 T 4.2085 8.2817 115.8129 63.8714 68.5813 174.9600 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 S 8.18 4.37 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 2 I 7.97 3.52 1.25 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.04 0.73 0.00 0.00 3 Q 8.13 4.11 0.00 2.03 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.08 0.00 0.00 0.00 0.00 0.00 2.55 2.27 0.00 4 A 7.08 4.20 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 5 E 7.63 3.66 0.00 1.16 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 1.97 1.47 0.00 6 E 8.35 3.95 0.00 2.04 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 2.28 0.00 7 W 7.15 4.59 0.00 3.43 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 8 Y 7.63 5.16 0.00 2.76 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 9 F 9.15 4.58 0.00 2.74 2.99 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 10 G 5.88 3.36 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 0.00 11 K 8.53 4.28 0.00 1.77 1.78 0.00 1.75 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.44 7.81 12 I 7.54 4.68 1.92 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 1.54 0.89 0.98 0.00 0.00 13 T 8.13 4.35 4.34 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 1.22 0.00 0.00 14 R 8.65 3.82 0.00 1.84 1.91 0.00 2.92 0.00 0.00 2.99 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.23 0.00 15 R 7.89 3.90 0.00 1.91 1.91 0.00 3.23 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 16 E 8.27 4.00 0.00 2.16 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 0.00 2.34 2.42 0.00 17 S 8.38 4.17 0.00 4.09 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 18 E 8.36 4.02 0.00 2.22 2.06 0.00 0.00 0.00 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 2.59 0.00 19 R 7.79 3.91 0.00 1.98 2.13 0.00 3.27 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 20 L 7.87 4.19 0.00 1.88 1.81 1.16 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.95 4.20 0.00 1.69 1.73 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.80 4.47 0.00 1.71 1.66 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 23 N 7.25 4.92 0.00 2.70 2.65 0.00 0.00 6.92 7.73 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 24 A 8.78 4.08 1.30 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 0.00 0.00 25 E 8.70 4.17 0.00 2.07 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 2.32 2.27 0.00 26 N 7.93 4.51 0.00 2.86 2.78 0.00 0.00 6.99 7.59 0.00 0.00 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 P 0.00 4.55 0.00 2.19 2.15 0.00 3.72 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 28 R 8.20 3.96 0.00 1.49 1.58 0.00 3.27 0.00 0.00 3.50 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.68 0.00 29 G 9.18 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 0.00 0.00 0.00 30 T 7.59 4.66 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 1.23 0.00 0.00 31 F 8.78 5.47 0.00 3.21 3.18 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 0.00 0.00 0.00 32 L 8.65 4.40 0.00 0.30 0.66 0.72 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 33 V 9.00 5.14 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.98 0.00 0.00 34 R 9.16 5.01 0.00 2.00 1.98 0.00 3.03 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 35 E 8.99 4.57 0.00 1.89 1.95 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 2.50 2.41 0.00 36 S 8.52 4.27 0.00 3.88 3.90 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 37 E 9.18 3.93 0.00 1.98 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 2.31 2.30 0.00 38 T 7.41 4.48 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 39 T 8.38 4.37 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 1.18 0.00 0.00 40 K 8.47 4.03 0.00 1.82 1.80 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.42 7.81 41 G 8.63 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 42 A 7.34 4.54 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 43 Y 8.89 5.36 0.00 3.11 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 44 C 9.51 5.25 0.00 2.98 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 45 L 9.40 5.00 0.00 1.80 1.80 0.90 0.66 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 46 S 8.88 5.22 0.00 3.80 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 47 V 8.73 5.08 2.26 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 1.15 0.00 0.00 1.11 0.00 0.00 48 S 9.22 5.01 0.00 3.94 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 49 D 9.20 5.19 0.00 2.77 2.69 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 50 F 8.75 5.42 0.00 3.09 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 51 D 7.76 4.73 0.00 2.69 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 52 N 8.84 4.31 0.00 2.71 2.90 0.00 0.00 6.90 7.35 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 53 A 8.00 4.04 1.23 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 0.00 0.00 0.00 54 K 8.67 4.14 0.00 1.67 1.79 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.31 7.81 55 G 7.99 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 0.00 0.00 0.00 56 L 8.46 4.93 0.00 1.95 1.71 1.10 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.97 5.07 0.00 2.84 2.82 0.00 0.00 5.97 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 58 V 8.24 4.91 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 0.68 0.00 0.00 0.93 0.00 0.00 59 K 8.89 4.58 0.00 1.63 1.18 0.00 1.56 0.00 0.00 1.55 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.55 7.81 60 H 8.27 5.11 0.00 2.85 3.10 0.00 5.64 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 8.78 4.67 0.00 2.89 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 62 K 8.88 4.59 0.00 1.80 1.76 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.50 7.81 63 I 8.93 4.64 2.13 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.72 1.20 0.00 0.00 64 R 8.65 4.66 0.00 1.09 1.37 0.00 3.09 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.46 0.00 65 K 8.03 4.55 0.00 1.17 1.48 0.00 1.22 0.00 0.00 0.61 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.94 1.24 7.81 66 L 8.64 4.39 0.00 1.86 1.65 1.14 0.86 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 67 D 8.35 4.57 0.00 2.66 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 68 S 7.99 4.18 0.00 3.87 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 69 G 7.19 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 70 G 8.13 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 0.00 0.00 0.00 0.00 71 F 9.29 5.59 0.00 3.13 3.07 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 72 Y 8.43 5.19 0.00 3.41 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 I 9.09 4.15 1.89 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.62 0.94 0.00 0.00 74 T 7.83 4.78 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 1.31 0.00 0.00 75 S 8.69 2.79 0.00 3.50 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 76 R 7.81 3.86 0.00 1.78 1.97 0.00 3.26 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 77 T 7.89 4.11 4.29 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 0.81 0.00 0.00 78 Q 7.67 4.79 0.00 1.84 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.81 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 79 F 8.60 4.93 0.00 3.20 2.89 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 80 N 8.56 4.85 0.00 3.26 2.98 0.00 0.00 6.75 7.45 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 81 S 7.64 4.28 0.00 3.85 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 82 L 6.92 3.36 0.00 0.88 1.46 0.75 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 7.92 4.22 0.00 2.22 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.67 0.00 0.00 0.00 0.00 0.00 2.60 2.87 0.00 84 Q 8.02 3.91 0.00 2.31 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 85 L 7.51 2.44 0.00 1.65 1.62 1.17 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.36 3.11 1.61 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 0.04 0.00 0.00 -0.12 0.00 0.00 87 A 7.86 3.98 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 88 Y 7.62 3.70 0.00 2.72 2.20 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 0.00 89 Y 7.73 4.40 0.00 2.92 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 90 S 7.28 4.69 0.00 3.80 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 91 K 7.42 4.27 0.00 1.38 1.47 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.34 7.81 92 H 7.48 4.65 0.00 2.64 3.21 0.00 5.70 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.77 4.13 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 94 D 7.82 4.40 0.00 3.07 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 0.00 0.00 0.00 0.00 95 G 8.96 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 96 L 7.87 3.89 0.00 1.60 1.28 0.53 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 97 C 8.73 4.38 0.00 3.35 3.21 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 98 H 7.06 4.44 0.00 3.12 3.16 0.00 5.76 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 R 7.62 4.12 0.00 2.04 1.92 0.00 3.20 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 100 L 8.45 4.22 0.00 1.22 0.46 0.09 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 101 T 8.02 4.72 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 1.35 0.00 0.00 102 T 7.71 4.96 4.29 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 1.27 0.00 0.00 103 V 8.34 3.48 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 0.87 0.00 0.00 0.98 0.00 0.00 104 C 8.32 4.34 0.00 2.97 2.69 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 0.00 105 P 0.00 4.54 0.00 2.11 1.98 0.00 3.78 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 2.14 2.12 0.00 106 T 8.28 4.21 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 1.13 0.00 0.00