NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.3109 8.0333 110.9386 61.6617 69.1790 174.1524 4 S 4.2173 8.1672 118.7091 60.0778 62.7558 171.1836 5 E 4.4213 8.3427 122.6966 58.5105 30.5472 177.7610 6 L 3.8751 7.7209 119.6409 57.9199 42.1532 178.8372 7 L 3.9896 7.8724 118.5505 57.8616 41.7368 179.2579 8 K 4.1686 8.1777 118.6800 59.6138 31.9774 178.4032 9 H 4.2372 8.0204 116.1855 58.8989 28.7822 177.6010 10 I 3.7566 8.1206 121.8991 64.6859 36.8036 177.6024 11 Y 4.2359 8.5655 122.1521 60.2262 38.7695 177.4479 12 D 4.3985 8.6706 119.7767 57.6672 41.0264 179.3957 13 I 3.7509 7.9694 118.7798 63.9703 38.0580 177.5765 14 N 4.2242 7.9598 117.2724 56.2189 38.3314 177.0213 15 L 3.7429 7.8079 121.8667 58.1424 42.2246 178.5744 16 S 4.0453 7.6853 112.5386 61.8063 62.1338 175.4140 17 Y 3.9031 8.4973 122.0294 60.7473 38.5551 177.7651 18 L 4.0802 8.3492 119.7650 58.2621 41.9232 179.8295 19 L 3.9875 8.2063 118.7842 57.5337 41.4965 179.4617 20 L 3.8433 7.7198 119.9547 57.9219 41.9906 178.5508 21 A 3.7921 7.8693 121.1271 55.2550 18.1015 179.1792 22 Q 3.8400 7.9595 117.7182 59.4501 29.2631 178.3627 23 R 3.8915 7.7993 118.6481 59.5929 30.2274 178.8760 24 L 3.9533 8.3535 118.3324 58.0518 41.4862 179.7943 25 I 3.7048 7.7800 118.5568 64.2513 37.0706 178.3792 26 V 3.7109 7.8421 118.4329 66.1665 31.5093 177.7599 27 Q 4.3064 7.9684 117.3786 57.0677 29.2503 175.1083 28 D 4.8192 7.4188 119.1603 52.4969 44.6247 176.5087 29 K 3.8124 8.2794 127.9512 59.5258 32.3495 177.6665 30 A 3.9999 8.1539 120.3257 55.7867 18.1113 179.7408 31 S 4.1610 8.2506 112.4643 61.6411 62.8622 176.7820 32 A 4.0044 8.6993 123.8142 55.2706 17.9452 179.7545 33 M 3.9847 8.5419 117.8324 58.4267 31.8760 178.5595 34 F 4.0861 7.8560 118.9547 61.5374 39.6796 177.1169 35 R 3.8831 8.2061 116.4661 59.0601 30.0001 178.5909 36 L 4.1966 8.0743 116.9879 54.4681 42.4183 176.7446 37 G 3.7197 8.3354 107.2358 46.6364 0.0000 172.6559 38 I 4.6320 7.4481 110.0415 58.1632 41.3678 174.4776 39 N 4.8462 8.1620 118.4327 51.0096 40.5763 175.2666 40 E 3.8925 8.5923 120.4007 59.6992 29.5807 178.3286 41 E 3.9554 8.2853 117.8246 59.8598 29.5216 179.0825 42 M 4.0093 8.9618 118.0886 58.5286 32.2568 177.9111 43 A 4.0107 8.4464 121.3991 55.5223 18.2518 179.7204 44 T 3.7846 8.1392 113.4089 67.1616 68.9038 176.4036 45 T 4.0165 7.7394 117.2682 66.9349 68.2043 176.3688 46 L 3.9673 7.9758 120.0438 57.9409 41.5966 179.4620 47 A 3.7731 8.1083 118.8648 54.3397 18.2282 178.6539 48 A 4.2837 8.0261 118.0917 54.2333 20.3318 177.2026 49 L 3.6722 6.3482 114.9443 51.5423 42.3683 177.0979 50 T 4.5750 8.6919 113.2651 59.7781 71.8388 175.5313 51 L 3.8569 8.3977 125.6314 58.2994 42.0295 177.6484 52 P 4.2670 0.0000 0.0000 65.7840 31.2191 178.6759 53 Q 3.9920 7.8126 116.6054 59.0702 28.6753 178.1116 54 M 3.9734 8.2833 120.2181 58.8845 32.1291 179.1014 55 V 3.8149 8.1320 118.0514 65.9921 31.4168 178.0087 56 K 4.1828 7.6491 117.2410 58.6551 32.3165 178.7862 57 L 4.2217 8.0578 119.3737 57.0094 41.6723 179.0490 58 A 3.9053 8.3900 122.3955 55.3521 18.3708 178.8692 59 E 4.5574 8.4032 111.7534 57.4326 29.5495 177.7805 60 T 3.8010 7.4659 115.1733 64.1979 67.3374 174.1211 61 N 4.5190 8.5100 115.4942 53.9943 37.2466 173.7404 62 Q 4.3412 7.4752 111.2932 54.7525 30.7866 170.9603 63 L 3.6458 8.0538 125.9328 54.4322 39.4879 174.2068 64 V 4.0598 8.1808 118.3684 61.2200 31.9539 176.2931 65 C 4.5022 7.6214 115.9263 58.7501 32.0831 173.3686 66 H 5.0777 8.3118 120.7142 53.4744 30.8255 174.0733 67 F 4.4193 8.7112 124.5265 58.3570 39.4237 176.4261 68 R 3.6250 8.0619 127.3184 57.9250 30.1751 176.5726 69 F 4.6382 6.0324 117.1559 55.9002 40.1281 175.2771 70 D 4.9063 8.7850 122.5812 53.0217 41.5047 175.7723 71 S 4.6754 7.9375 115.6608 56.6695 63.3017 174.1990 72 H 4.3854 8.7498 124.2981 58.4826 28.2247 177.4251 73 Q 3.9846 7.4214 119.8002 58.7474 28.3333 178.6187 74 T 3.8362 7.7456 117.5195 66.5304 68.3529 176.9282 75 I 3.4257 7.5088 113.0029 63.8401 37.8098 178.1430 76 T 3.9823 7.6226 117.8373 66.7024 68.2053 176.5419 77 Q 4.0074 8.1601 120.1982 58.7327 29.0472 177.5908 78 L 4.3777 7.8484 118.2393 55.2498 42.1844 177.0729 79 T 4.4485 7.5625 107.7648 61.7340 70.7090 174.8543 80 Q 4.2098 7.8178 118.9502 55.2911 29.4252 175.3389 81 D 4.6251 8.2992 118.9223 55.3192 41.3249 176.3579 82 S 4.5879 8.4847 111.3122 57.9834 68.1632 175.1310 83 R 3.9998 8.5627 118.1019 56.9660 27.0823 177.3238 84 V 4.4806 7.7330 109.1782 60.2575 33.7810 176.4438 85 D 4.4012 8.6844 122.8197 57.9107 40.6569 178.1628 86 D 4.4523 8.2522 118.6084 57.8753 40.7729 179.3289 87 L 4.0993 8.2416 119.2087 57.6801 41.4025 179.2266 88 Q 4.0483 8.0002 118.2998 59.0925 29.1866 178.2527 89 Q 4.1467 8.2064 119.1842 59.1661 28.9071 178.6415 90 I 3.8160 7.3870 119.7062 64.5223 36.9459 178.0200 91 H 4.4401 8.5746 119.8555 59.4466 29.6353 177.4526 92 T 4.0367 8.0942 117.9268 66.4126 68.2724 176.9349 93 G 3.6324 8.0810 107.1660 47.9920 0.0000 175.5610 94 I 3.8087 8.3099 123.1331 64.2934 37.0926 178.5693 95 M 4.1045 8.3946 119.6064 58.3913 31.7918 178.8456 96 L 3.7367 8.0762 119.4101 57.7054 41.7785 179.7968 97 S 4.0059 8.1439 114.2589 61.6889 62.9953 176.5052 98 T 3.9172 8.2977 119.7584 66.6836 68.1380 176.3575 99 R 3.8315 8.1218 119.9550 58.7332 29.8599 178.5479 100 L 3.8067 7.9804 120.4883 58.7864 42.3691 178.7726 101 L 4.0348 8.6077 120.4406 57.8823 41.9631 178.1831 102 N 4.1046 8.4328 116.0979 56.8644 38.5464 176.7976 103 D 4.5387 8.0755 117.8006 56.0476 41.0573 178.3284 104 V 3.8107 8.2426 119.5891 65.4909 31.7353 177.0433 105 N 4.5836 8.0392 113.9631 54.7438 38.8287 175.5592 106 Q 4.3116 7.5924 123.7003 56.0109 29.1293 175.3069 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 3 T 8.03 4.31 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 4 S 8.17 4.22 0.00 3.94 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 5 E 8.34 4.42 0.00 1.97 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 2.27 2.44 0.00 6 L 7.72 3.88 0.00 1.67 1.65 0.91 0.61 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 7 L 7.87 3.99 0.00 1.90 1.72 1.03 1.00 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 8 K 8.18 4.17 0.00 1.88 2.03 0.00 1.54 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.52 1.83 7.81 9 H 8.02 4.24 0.00 3.52 3.38 0.00 5.87 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 10 I 8.12 3.76 2.06 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 1.44 1.05 0.98 0.00 0.00 11 Y 8.57 4.24 0.00 3.02 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 12 D 8.67 4.40 0.00 2.98 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 13 I 7.97 3.75 1.90 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 1.55 0.92 0.98 0.00 0.00 14 N 7.96 4.22 0.00 2.90 2.76 0.00 0.00 6.70 6.77 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 15 L 7.81 3.74 0.00 1.04 1.31 0.82 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.69 4.05 0.00 4.32 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 Y 8.50 3.90 0.00 3.01 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 L 8.35 4.08 0.00 1.91 1.76 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.21 3.99 0.00 1.76 1.69 0.89 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.72 3.84 0.00 1.70 1.62 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.87 3.79 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 7.96 3.84 0.00 2.32 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.65 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 23 R 7.80 3.89 0.00 2.15 1.95 0.00 3.15 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 24 L 8.35 3.95 0.00 1.56 1.68 0.84 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.78 3.70 1.92 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 1.39 0.57 0.90 0.00 0.00 26 V 7.84 3.71 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 0.78 0.00 0.00 0.93 0.00 0.00 27 Q 7.97 4.31 0.00 2.11 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.85 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 28 D 7.42 4.82 0.00 2.74 2.53 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 29 K 8.28 3.81 0.00 1.86 1.80 0.00 1.80 0.00 0.00 1.82 0.00 0.00 3.17 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.52 7.81 30 A 8.15 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 31 S 8.25 4.16 0.00 3.98 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 32 A 8.70 4.00 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 33 M 8.54 3.98 0.00 2.18 2.42 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.64 0.00 34 F 7.86 4.09 0.00 3.06 3.29 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 0.00 35 R 8.21 3.88 0.00 1.80 1.95 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 1.86 1.99 0.00 36 L 8.07 4.20 0.00 1.69 1.71 0.82 0.59 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 37 G 8.34 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 0.00 0.00 0.00 38 I 7.45 4.63 1.88 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 1.47 0.78 0.99 0.00 0.00 39 N 8.16 4.85 0.00 3.01 2.99 0.00 0.00 5.53 7.66 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 40 E 8.59 3.89 0.00 2.06 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 2.39 2.42 0.00 41 E 8.29 3.96 0.00 2.27 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 2.41 2.45 0.00 42 M 8.96 4.01 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.62 0.00 43 A 8.45 4.01 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 44 T 8.14 3.78 4.48 0.00 0.00 0.00 0.00 0.00 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 45 T 7.74 4.02 4.37 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 1.22 0.00 0.00 46 L 7.98 3.97 0.00 1.72 1.73 1.02 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.11 3.77 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 48 A 8.03 4.28 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 49 L 6.35 3.67 0.00 1.84 1.61 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 50 T 8.69 4.57 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 1.30 0.00 0.00 51 L 8.40 3.86 0.00 1.78 1.75 0.94 1.00 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 52 P 0.00 4.27 0.00 2.21 2.11 0.00 3.59 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 2.13 2.20 0.00 53 Q 7.81 3.99 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 54 M 8.28 3.97 0.00 2.01 2.33 0.00 0.00 0.00 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.59 0.00 55 V 8.13 3.81 2.31 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 1.26 0.00 0.00 1.04 0.00 0.00 56 K 7.65 4.18 0.00 1.86 1.88 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.76 7.81 57 L 8.06 4.22 0.00 1.86 1.69 0.93 0.81 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 58 A 8.39 3.91 1.05 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 0.00 0.00 59 E 8.40 4.56 0.00 2.08 2.07 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 2.47 2.76 0.00 60 T 7.47 3.80 4.49 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 1.31 0.00 0.00 61 N 8.51 4.52 0.00 3.00 2.97 0.00 0.00 6.73 7.08 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 62 Q 7.48 4.34 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.56 5.73 0.00 0.00 0.00 0.00 0.00 2.44 2.29 0.00 63 L 8.05 3.65 0.00 1.80 1.74 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 64 V 8.18 4.06 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 0.64 0.00 0.00 0.81 0.00 0.00 65 C 7.62 4.50 0.00 2.75 2.65 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 0.00 0.00 0.00 0.00 66 H 8.31 5.08 0.00 3.12 3.19 0.00 5.70 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 67 F 8.71 4.42 0.00 3.09 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 68 R 8.06 3.63 0.00 1.15 1.48 0.00 3.10 0.00 0.00 2.96 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.45 0.00 69 F 6.03 4.64 0.00 2.60 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 70 D 8.78 4.91 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 71 S 7.94 4.68 0.00 3.88 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 72 H 8.75 4.39 0.00 3.46 3.60 0.00 5.70 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Q 7.42 3.98 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.86 0.00 0.00 0.00 0.00 0.00 2.21 1.93 0.00 74 T 7.75 3.84 4.36 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 1.15 0.00 0.00 75 I 7.51 3.43 1.79 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.61 0.69 0.00 0.00 76 T 7.62 3.98 4.40 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 1.21 0.00 0.00 77 Q 8.16 4.01 0.00 1.98 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 78 L 7.85 4.38 0.00 1.51 1.60 0.64 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 79 T 7.56 4.45 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 80 Q 7.82 4.21 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.03 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 81 D 8.30 4.63 0.00 2.69 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 82 S 8.48 4.59 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 83 R 8.56 4.00 0.00 1.99 2.09 0.00 3.22 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 84 V 7.73 4.48 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 0.69 0.00 0.00 0.95 0.00 0.00 85 D 8.68 4.40 0.00 2.68 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 86 D 8.25 4.45 0.00 2.68 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.24 4.10 0.00 1.80 1.70 0.91 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 8.00 4.05 0.00 2.06 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.06 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 89 Q 8.21 4.15 0.00 2.35 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.55 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 90 I 7.39 3.82 2.04 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 1.44 0.71 0.94 0.00 0.00 91 H 8.57 4.44 0.00 3.40 3.45 0.00 5.78 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 92 T 8.09 4.04 4.46 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 1.39 0.00 0.00 93 G 8.08 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 94 I 8.31 3.81 2.12 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.95 0.98 0.00 0.00 95 M 8.39 4.10 0.00 2.19 2.40 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.96 0.00 96 L 8.08 3.74 0.00 1.55 1.44 0.85 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 97 S 8.14 4.01 0.00 4.27 4.15 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 0.00 0.00 0.00 98 T 8.30 3.92 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 1.22 0.00 0.00 99 R 8.12 3.83 0.00 1.93 1.83 0.00 3.23 0.00 0.00 3.05 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 100 L 7.98 3.81 0.00 1.66 1.78 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.61 4.03 0.00 1.93 1.60 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 102 N 8.43 4.10 0.00 2.78 2.88 0.00 0.00 7.20 8.24 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 0.00 103 D 8.08 4.54 0.00 2.62 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 0.00 104 V 8.24 3.81 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 0.84 0.00 0.00 0.96 0.00 0.00 105 N 8.04 4.58 0.00 2.71 2.85 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 0.00 106 Q 7.59 4.31 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00