NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.8489 8.4293 116.2002 55.2254 30.2814 173.2723 2 C 4.1031 7.5330 114.8462 56.8286 30.2087 172.8103 3 D 4.5629 8.3972 118.5913 54.8837 40.3613 175.0740 4 L 4.0627 7.4596 121.0427 57.4725 42.0612 175.9491 5 P 4.5879 0.0000 0.0000 62.2607 32.3772 175.1990 6 C 4.3774 8.4371 112.5014 57.5626 30.8370 175.0969 7 G 3.9260 8.2627 107.5879 45.4123 0.0000 172.9661 8 V 4.2055 7.1392 119.2678 61.1920 32.2226 174.3774 9 Y 4.6318 7.9128 123.6791 56.3782 42.0558 174.5434 10 D 3.5062 7.7839 115.3982 51.7762 43.6626 175.1723 11 P 4.0753 0.0000 0.0000 64.7095 31.1655 178.0683 12 A 3.9632 8.8913 120.6854 55.0668 17.9046 179.5338 13 Q 3.7903 8.0067 116.3727 59.0860 28.7381 179.0728 14 A 4.0476 7.7611 121.0802 55.0823 18.4612 179.2993 15 R 3.8336 8.1374 117.4302 59.8247 30.0100 178.6782 16 I 3.7060 8.0872 119.7997 64.5176 37.0708 178.3602 17 E 3.9839 8.0242 118.9326 59.3733 29.3485 179.2747 18 A 4.0812 8.2668 120.8568 55.0722 18.2925 179.5717 19 E 3.9884 8.6025 117.7712 59.5220 29.3871 179.6773 20 S 4.0998 7.8111 115.4898 61.4107 62.8974 176.5556 21 V 3.5715 7.6895 121.0103 66.0709 31.1535 178.0377 22 K 4.0841 8.1106 118.7608 59.6009 32.2383 178.5835 23 A 4.1791 8.2762 121.2065 55.2723 18.1442 179.7612 24 I 3.7745 8.1574 118.7920 64.6175 37.0696 178.6080 25 Q 4.0220 8.1053 118.9485 58.9819 28.2903 178.6547 26 E 4.0141 8.2098 118.8448 59.4484 29.9258 179.3117 27 K 4.2093 8.1027 118.0848 59.7220 31.9300 179.4049 28 M 4.4200 8.2546 118.0067 58.1737 31.8945 178.3383 29 A 4.2351 7.9577 120.0311 53.7587 18.4850 177.8707 30 A 4.5766 7.4471 118.4561 51.4214 19.4257 176.0427 31 N 4.5561 7.9488 117.8290 54.5260 39.7418 173.4996 32 D 4.7541 8.5437 124.7893 54.1325 41.6084 177.1832 33 D 4.4343 8.2004 120.2470 54.3495 42.5387 176.3849 34 L 3.9407 8.6157 128.3792 58.9448 42.2556 178.9551 35 H 4.1147 8.3383 115.4528 58.8600 28.5666 177.4867 36 F 4.1555 8.6367 122.5809 61.2587 39.1979 177.3265 37 Q 3.8920 8.2715 117.8139 58.7964 28.4762 178.7422 38 I 3.6324 7.9258 120.9688 64.4585 37.1314 178.6791 39 R 3.8160 7.9797 118.5692 59.2713 29.8561 179.0560 40 A 3.7268 7.8162 120.8205 55.1875 18.2239 179.9294 41 T 3.7307 7.8821 114.3417 66.6684 68.6195 177.1203 42 V 3.5422 7.7706 120.1080 66.2120 31.5995 178.1991 43 I 3.9014 7.8879 119.6724 64.1406 36.8379 178.3658 44 K 3.9249 8.2284 120.7626 59.3089 32.0318 178.4035 45 E 3.8972 8.1824 119.6400 59.4869 29.5605 178.9499 46 Q 3.9831 7.9165 117.4863 59.0369 28.7023 178.9439 47 R 3.9404 8.1733 118.9340 59.1470 30.0263 178.9947 48 A 3.9777 8.2358 120.7924 55.0217 18.3503 179.3181 49 E 3.8597 8.1751 117.8809 59.3770 29.6974 179.0961 50 L 3.9360 8.0484 118.8953 57.6080 41.7192 179.2686 51 A 4.0542 8.2558 120.9392 55.2302 18.2518 179.8819 52 K 3.9455 8.3088 117.1506 59.6142 32.0776 179.0754 53 H 4.1267 8.2404 118.5447 59.6757 29.8442 176.9377 54 H 4.1937 8.1488 117.9071 59.0358 28.5669 177.8342 55 L 4.0828 7.9523 120.5396 57.9153 41.3567 179.2717 56 D 4.5430 8.5140 119.2584 57.4147 40.7396 179.0726 57 V 3.7135 8.0510 118.8558 65.7873 31.4364 178.1085 58 L 3.8924 8.0341 118.8256 57.5957 41.3072 179.2657 59 W 4.6583 8.4182 127.1144 60.5527 30.7578 177.5959 60 S 4.1521 8.5844 113.0282 60.5435 63.0732 175.3389 61 D 4.6401 8.3867 121.0716 55.9078 41.5281 177.4393 62 Y 3.4242 7.4376 118.5426 59.9397 39.1111 175.5017 63 F 4.0955 7.9466 118.3269 57.2769 39.5674 174.9368 64 K 4.6359 8.0717 123.0358 53.2969 35.6003 175.0968 65 P 4.4612 0.0000 0.0000 65.9235 31.0462 177.0814 66 P 4.2456 0.0000 0.0000 65.7960 31.0589 178.4728 67 H 4.3401 7.9192 115.0287 59.0067 28.4854 177.9253 68 F 4.2733 7.6171 117.4806 60.1066 38.7487 177.0387 69 E 4.1259 7.9290 118.7310 59.4984 29.6274 178.7538 70 S 4.2025 7.9981 113.6794 59.9626 64.1806 174.1611 71 Y 4.6903 8.0612 119.9293 54.5496 37.7146 174.1024 72 P 4.4668 0.0000 0.0000 64.7486 31.8430 177.7901 73 E 4.4712 8.1132 115.8376 56.3294 30.6491 177.4800 74 L 3.8962 8.4467 123.1354 58.7722 42.0046 178.1400 75 H 4.4020 8.4223 115.5825 59.6125 28.7289 177.6605 76 T 3.8072 7.9570 116.6648 66.3894 68.3172 176.2990 77 L 3.8224 8.1065 122.3268 58.2080 42.1895 179.2977 78 V 3.5475 8.0921 118.5295 65.8885 31.4940 177.4165 79 N 4.0335 8.2087 117.0895 56.7713 38.7907 176.7598 80 E 3.7478 8.5406 119.9418 58.8628 29.4434 179.2621 81 A 3.8087 7.4582 121.0362 55.2264 18.5013 180.1674 82 V 3.5775 7.6814 110.9431 64.4094 31.5573 179.0483 83 K 3.9858 8.0955 118.0756 59.1553 31.8345 179.2853 84 A 4.0960 7.9682 121.3219 54.9798 18.2873 179.6813 85 L 4.0288 7.8209 117.5423 57.9430 41.5242 179.7876 86 S 4.1392 8.1479 115.0558 61.4311 62.4809 176.5647 87 A 3.9978 7.8059 122.7001 54.9084 18.3492 179.2579 88 A 4.2082 7.8875 120.7150 54.4212 18.1733 180.0058 89 K 3.9493 7.8630 116.4583 59.3016 32.1846 178.3960 90 A 4.4532 7.2912 118.0043 51.3438 18.9167 176.7209 91 S 4.6113 7.2303 111.9502 57.5223 65.6331 173.9515 92 T 4.3362 8.3142 113.8483 61.4292 69.6525 174.0988 93 D 4.4972 8.2875 124.5399 53.3682 41.6019 175.0779 94 P 4.6687 0.0000 0.0000 64.7255 31.2528 178.3207 95 A 4.0049 9.0394 120.6567 55.3480 18.0079 179.7107 96 T 3.9546 8.0254 108.4205 64.9787 68.8857 176.9910 97 G 3.6129 8.1607 108.2148 47.5087 0.0000 175.3061 98 Q 4.0044 8.3464 122.0035 58.6909 29.0344 178.1227 99 K 3.7985 8.2157 120.6541 59.3324 32.2066 178.6663 100 A 4.1837 7.9529 120.6114 55.2500 18.3103 179.5998 101 L 3.9882 7.9247 117.3486 58.0038 41.6847 179.5314 102 D 4.3211 8.3515 119.0640 57.5779 40.7466 178.4412 103 Y 4.2520 7.8549 117.2134 61.2232 37.8451 178.6607 104 I 3.8019 8.1854 120.5977 64.3208 37.1542 178.3168 105 A 4.1136 8.1884 121.7342 55.2668 18.1939 179.7704 106 Q 4.0097 8.0006 116.1651 59.1128 28.8170 178.9387 107 I 3.7644 7.9309 120.9398 64.4057 37.1825 177.8511 108 D 4.4276 8.6233 119.3698 57.1985 41.0255 178.3607 109 K 4.0991 8.0923 120.0124 59.8238 32.3741 178.9572 110 I 3.5130 7.8292 120.0455 63.9646 36.6198 178.2008 111 F 4.0045 8.4369 121.2436 61.2805 39.4321 177.1574 112 W 4.1969 8.2198 118.2168 59.4836 28.8482 178.5123 113 E 4.1048 8.1859 118.8470 59.5299 28.7410 179.2322 114 T 4.0811 7.6195 108.2054 64.0877 68.8945 176.3105 115 K 4.0448 7.3083 120.8835 57.5992 32.5479 177.5053 116 K 4.2334 7.2832 118.2817 55.5354 32.8448 176.8575 117 A 4.1809 8.5110 124.1428 52.5865 18.3030 177.4183 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 4.85 0.00 3.29 3.38 0.00 5.48 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.53 4.10 0.00 3.13 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 3 D 8.40 4.56 0.00 2.88 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 7.46 4.06 0.00 1.68 1.75 0.92 0.91 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 5 P 0.00 4.59 0.00 2.31 2.12 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 6 C 8.44 4.38 0.00 3.00 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 7 G 8.26 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 8 V 7.14 4.21 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 0.85 0.00 0.00 0.91 0.00 0.00 9 Y 7.91 4.63 0.00 2.78 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 10 D 7.78 3.51 0.00 2.53 2.33 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 11 P 0.00 4.08 0.00 2.21 1.90 0.00 2.73 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 1.39 1.31 0.00 12 A 8.89 3.96 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 8.01 3.79 0.00 1.83 1.60 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 2.20 2.29 0.00 14 A 7.76 4.05 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 8.14 3.83 0.00 1.89 2.09 0.00 3.13 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 16 I 8.09 3.71 1.86 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 1.52 1.01 0.91 0.00 0.00 17 E 8.02 3.98 0.00 2.14 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 2.60 2.54 0.00 18 A 8.27 4.08 1.38 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 0.00 0.00 19 E 8.60 3.99 0.00 2.16 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 2.58 0.00 20 S 7.81 4.10 0.00 4.03 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 3.57 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 1.00 0.00 0.00 0.97 0.00 0.00 22 K 8.11 4.08 0.00 1.89 1.80 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.45 1.47 7.81 23 A 8.28 4.18 1.38 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 0.00 0.00 24 I 8.16 3.77 2.03 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 1.53 0.81 0.91 0.00 0.00 25 Q 8.11 4.02 0.00 2.29 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 26 E 8.21 4.01 0.00 2.14 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 2.36 2.51 0.00 27 K 8.10 4.21 0.00 2.23 2.11 0.00 1.82 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.81 7.81 28 M 8.25 4.42 0.00 2.05 2.33 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 2.93 2.54 0.00 29 A 7.96 4.24 1.38 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 0.00 0.00 30 A 7.45 4.58 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 31 N 7.95 4.56 0.00 2.32 2.39 0.00 0.00 7.15 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 8.54 4.75 0.00 2.70 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 0.00 0.00 0.00 0.00 33 D 8.20 4.43 0.00 2.85 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 34 L 8.62 3.94 0.00 1.79 1.63 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 35 H 8.34 4.11 0.00 3.46 3.39 0.00 5.87 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 36 F 8.64 4.16 0.00 3.20 3.26 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 37 Q 8.27 3.89 0.00 2.32 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 38 I 7.93 3.63 1.98 0.00 0.00 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 1.48 0.76 0.88 0.00 0.00 39 R 7.98 3.82 0.00 1.66 1.87 0.00 3.15 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 1.63 1.88 0.00 40 A 7.82 3.73 0.82 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 0.00 0.00 41 T 7.88 3.73 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 1.18 0.00 0.00 42 V 7.77 3.54 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 1.00 0.00 0.00 0.92 0.00 0.00 43 I 7.89 3.90 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.68 0.89 0.00 0.00 44 K 8.23 3.92 0.00 1.86 1.96 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.43 7.81 45 E 8.18 3.90 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 7.92 3.98 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.61 0.00 47 R 8.17 3.94 0.00 1.83 1.98 0.00 3.28 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.79 0.00 48 A 8.24 3.98 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 49 E 8.18 3.86 0.00 2.21 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 2.37 0.00 50 L 8.05 3.94 0.00 1.93 1.68 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.26 4.05 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 52 K 8.31 3.95 0.00 1.97 1.86 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.62 7.81 53 H 8.24 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 8.15 4.19 0.00 3.36 3.28 0.00 5.67 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 55 L 7.95 4.08 0.00 1.88 1.76 0.94 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.51 4.54 0.00 2.89 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 57 V 8.05 3.71 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 1.11 0.00 0.00 0.94 0.00 0.00 58 L 8.03 3.89 0.00 2.10 1.75 0.77 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.42 4.66 0.00 3.51 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 8.58 4.15 0.00 4.11 4.24 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 61 D 8.39 4.64 0.00 2.93 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 62 Y 7.44 3.42 0.00 1.45 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 7.95 4.10 0.00 2.95 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 0.00 0.00 0.00 64 K 8.07 4.64 0.00 1.42 1.55 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.29 1.13 7.81 65 P 0.00 4.46 0.00 2.15 2.16 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 2.25 0.00 66 P 0.00 4.25 0.00 1.95 2.02 0.00 3.34 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 1.99 2.11 0.00 67 H 7.92 4.34 0.00 2.87 3.15 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 7.62 4.27 0.00 3.05 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 7.93 4.13 0.00 2.04 2.14 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 2.31 2.36 0.00 70 S 8.00 4.20 0.00 3.61 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 0.00 71 Y 8.06 4.69 0.00 2.98 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 72 P 0.00 4.47 0.00 2.22 2.23 0.00 3.82 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 73 E 8.11 4.47 0.00 2.19 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 2.36 2.29 0.00 74 L 8.45 3.90 0.00 1.81 1.88 0.52 -0.43 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 3.27 3.38 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 3.81 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 1.22 0.00 0.00 77 L 8.11 3.82 0.00 1.86 1.90 1.09 0.80 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 78 V 8.09 3.55 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 0.91 0.00 0.00 1.12 0.00 0.00 79 N 8.21 4.03 0.00 2.70 2.76 0.00 0.00 7.25 8.40 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 80 E 8.54 3.75 0.00 1.48 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 2.17 2.26 0.00 81 A 7.46 3.81 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 82 V 7.68 3.58 1.99 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 0.89 0.00 0.00 0.86 0.00 0.00 83 K 8.10 3.99 0.00 1.70 1.80 0.00 1.56 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.44 7.81 84 A 7.97 4.10 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.82 4.03 0.00 1.90 1.72 0.93 0.78 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 8.15 4.14 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 7.81 4.00 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 88 A 7.89 4.21 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 7.86 3.95 0.00 1.99 1.99 0.00 1.69 0.00 0.00 2.00 0.00 0.00 3.21 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.63 7.81 90 A 7.29 4.45 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 91 S 7.23 4.61 0.00 3.76 3.78 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 92 T 8.31 4.34 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 1.21 0.00 0.00 93 D 8.29 4.50 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 4.67 0.00 2.20 2.11 0.00 3.95 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 2.13 1.93 0.00 95 A 9.04 4.00 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 96 T 8.03 3.95 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 8.16 3.61 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 0.00 0.00 0.00 98 Q 8.35 4.00 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 99 K 8.22 3.80 0.00 1.87 1.98 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.35 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.33 7.81 100 A 7.95 4.18 1.38 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 0.00 0.00 101 L 7.92 3.99 0.00 1.94 1.74 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.35 4.32 0.00 2.60 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 7.85 4.25 0.00 3.22 2.93 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 0.00 104 I 8.19 3.80 2.08 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 1.50 0.85 0.94 0.00 0.00 105 A 8.19 4.11 1.42 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 0.00 0.00 106 Q 8.00 4.01 0.00 2.37 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.64 0.00 107 I 7.93 3.76 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 0.74 1.08 0.00 0.00 108 D 8.62 4.43 0.00 2.91 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 0.00 109 K 8.09 4.10 0.00 2.07 2.03 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.57 7.81 110 I 7.83 3.51 1.83 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 1.10 0.88 -0.15 0.00 0.00 111 F 8.44 4.00 0.00 2.87 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 0.00 112 W 8.22 4.20 0.00 3.58 3.25 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 0.00 113 E 8.19 4.10 0.00 2.24 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 0.00 2.44 2.52 0.00 114 T 7.62 4.08 4.05 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 1.34 0.00 0.00 115 K 7.31 4.04 0.00 1.98 1.98 0.00 1.48 0.00 0.00 0.74 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.62 0.76 7.81 116 K 7.28 4.23 0.00 1.96 1.78 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.25 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.70 7.81 117 A 8.51 4.18 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