NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 M 4.5248 8.1627 120.3652 55.4305 33.4869 173.9692 4 H 4.3872 8.8087 126.6597 55.1971 31.2324 168.3922 5 V 4.8025 8.7099 127.1463 61.2128 34.3517 173.1984 6 A 4.9790 8.8832 130.8140 50.6059 21.1851 175.4234 7 Q 5.2712 8.2930 117.3453 54.7557 31.6339 172.6209 8 P 4.2843 0.0000 0.0000 63.0522 32.2167 177.4193 9 A 4.0956 8.6138 123.8019 54.5717 19.5663 177.5995 10 V 4.8522 7.5145 113.1201 61.4485 35.0980 174.9501 11 V 4.5233 8.7862 126.1540 61.2930 35.3331 173.4491 12 L 5.1638 8.4884 126.8184 52.7676 43.1054 176.2579 13 A 4.3942 8.6910 127.0030 51.7053 19.2596 177.4502 14 S 4.3433 8.9607 117.1447 57.8171 63.7372 175.5322 15 S 4.1499 8.4752 114.3030 60.8552 62.7506 175.1065 16 R 4.2997 8.0059 118.6262 55.5832 30.1617 175.9802 17 G 3.9188 8.1123 105.8878 47.0957 0.0000 173.5060 18 I 5.1641 7.6609 118.3084 59.0168 41.3184 175.1884 19 A 4.9755 9.0531 126.7066 50.3345 22.5145 175.0707 20 S 5.1923 8.8098 117.6739 56.6585 66.0706 173.3642 21 F 4.9867 8.5153 118.5779 55.8899 41.9524 172.9004 22 V 4.7994 8.6055 118.1660 61.2879 34.5706 174.7330 23 C 5.4602 9.0524 124.5417 55.5938 42.2089 172.7271 24 E 5.2153 9.2353 124.6231 55.3271 31.7768 175.4641 25 Y 5.3532 8.2689 119.2862 56.0734 40.9866 174.2780 26 A 4.1888 8.9583 121.8439 51.9706 19.0954 177.7054 27 S 4.1252 8.6867 115.8407 58.4454 63.0744 172.9373 28 P 4.3365 0.0000 0.0000 63.1865 31.8258 176.7725 29 G 3.9146 8.2065 104.5531 44.7081 0.0000 172.5358 30 K 4.2299 8.3030 115.9912 58.0281 32.7930 178.4598 31 A 4.2203 7.9419 120.6764 54.7850 18.8837 178.0396 32 T 4.2241 7.8120 112.5124 64.0104 69.3237 173.8403 33 E 4.2578 9.6698 128.4967 55.4618 30.9217 175.0463 34 V 4.7294 8.3363 127.4391 60.9086 34.5928 174.0963 35 R 5.0432 8.6478 127.1002 54.4024 33.0935 174.1786 36 V 4.9419 9.0337 126.3583 60.3184 34.1689 174.7429 37 T 5.1590 9.1336 121.0124 61.7814 72.0041 172.8581 38 V 4.7060 9.1169 127.2892 61.5872 33.4177 174.3521 39 L 5.0990 8.9525 128.2495 52.9290 44.7371 175.2777 40 R 4.3534 9.0708 124.2395 54.5795 31.9899 174.2977 41 Q 5.0869 8.8041 128.4179 54.3035 31.3407 174.1522 42 A 4.6198 9.0807 127.9221 51.1142 23.0991 175.5884 43 D 4.2686 9.4660 122.0349 55.6470 39.6393 173.9917 44 S 3.7968 8.1768 109.2210 59.0935 61.1350 171.6478 45 Q 4.7178 8.0163 120.2186 54.0850 31.1713 174.6757 46 V 4.9359 8.3161 122.4130 61.3055 34.0094 174.6456 47 T 4.7342 8.6943 117.0377 59.7544 72.5872 172.3106 48 E 4.4216 8.6900 124.3945 55.9899 29.9341 175.9692 49 V 4.0863 9.1760 128.3371 65.3161 32.4873 173.2358 50 C 5.1185 7.9907 111.7123 55.1746 44.3982 172.3268 51 A 5.5377 8.8764 119.6489 51.1876 21.9619 175.4804 52 A 4.5002 9.0128 120.6230 50.8629 23.0822 175.3699 53 T 5.0709 8.3789 117.7642 62.0142 71.0990 173.1290 54 Y 4.8049 8.7223 123.2972 56.5223 41.8524 172.7406 55 M 4.9057 8.5766 118.5206 53.4008 35.2099 174.6418 56 M 4.1827 8.7213 123.7727 57.7058 32.7025 176.5024 57 G 4.1127 9.0253 113.7385 45.0966 0.0000 172.3942 58 N 5.1024 7.6115 115.4521 50.8032 42.1069 173.6987 59 E 4.3398 8.5581 121.5232 56.2409 30.4394 176.3294 60 L 4.1730 8.4417 126.1704 54.5638 42.9670 177.1709 61 T 4.3248 8.0651 118.2370 61.9629 69.5060 173.9787 62 F 4.7329 8.3597 124.8587 55.4553 40.8771 176.1006 63 L 4.1871 8.4555 121.6292 55.0093 42.0055 177.0279 64 D 4.5416 8.4029 120.4647 55.9189 41.2605 176.3853 65 D 4.5209 8.8234 120.6424 54.9952 38.3420 174.2294 66 S 4.3502 7.6902 113.5405 58.2034 62.9345 174.0749 67 I 4.1164 8.1695 117.6563 61.8839 38.6668 175.4912 68 C 5.1961 7.5697 120.4318 55.6214 43.0209 173.1451 69 T 4.9067 8.0947 111.2150 60.2424 72.6995 172.9861 70 G 4.2924 7.9460 108.1338 47.0336 0.0000 171.2454 71 T 5.0042 7.8892 108.4948 59.9470 72.7805 172.7227 72 S 5.2062 8.6949 117.6176 56.5378 65.1456 173.0639 73 S 4.5718 8.7861 121.3419 56.7425 66.2420 173.7508 74 G 3.7205 8.9483 113.4637 47.1491 0.0000 173.5070 75 N 4.7758 8.4248 118.4893 51.8445 38.2449 173.1864 76 Q 4.7622 7.9239 115.7333 56.1055 33.0636 173.2592 77 V 4.7858 8.7677 112.8583 59.6914 35.1763 174.7467 78 N 4.9330 9.2712 123.4843 51.9752 39.8690 173.9495 79 L 5.0041 8.3594 124.4353 53.2210 45.0381 176.1346 80 T 4.9236 8.4073 117.4331 61.9830 72.6517 172.8348 81 I 4.8288 9.0207 127.9104 59.4971 39.7933 174.9841 82 Q 4.8836 8.7030 125.3670 54.5738 31.6264 175.9142 83 G 3.9001 8.7645 104.6682 46.0368 0.0000 173.7971 84 L 4.3591 7.8513 120.1076 54.4453 42.3333 176.4987 85 R 4.7746 9.0925 120.3541 53.8433 34.3158 176.2782 86 A 4.7706 9.8693 122.9398 55.1200 18.2507 180.2030 87 M 4.1994 8.0417 110.5334 57.6128 31.2543 176.5443 88 D 4.7283 8.6043 119.1158 54.5279 41.4911 176.6854 89 T 4.1147 7.8451 116.9454 63.7374 69.3158 174.1764 90 G 3.8065 7.8389 110.1669 46.6585 0.0000 170.2806 91 L 4.9469 7.7900 122.8352 53.9289 43.5641 175.7840 92 Y 4.7906 9.1562 126.2832 56.8400 39.1761 174.7533 93 I 4.7193 8.8228 126.7618 60.1386 39.4447 174.4774 94 C 5.1065 9.1666 124.7455 55.7794 39.4773 172.4010 95 K 4.8800 9.0829 125.8744 54.5128 34.4970 174.6974 96 V 4.6930 8.6213 127.5729 61.1644 33.9623 173.8091 97 E 4.8668 9.0163 127.9401 54.5387 32.2734 175.6915 98 L 4.5244 8.6896 124.9324 54.1393 41.2503 177.0760 99 M 4.4301 8.8500 124.9159 58.0851 32.9909 176.4499 100 Y 4.8534 7.7090 117.6427 55.9547 42.4874 172.9615 101 P 3.7117 0.0000 0.0000 60.1755 33.1061 173.5820 102 P 4.3913 0.0000 0.0000 62.1821 31.6548 174.4895 103 P 4.6622 0.0000 0.0000 61.8063 32.5863 175.2808 104 Y 4.4282 8.3669 121.8227 57.9948 39.5298 174.1630 105 Y 4.6840 7.5279 125.3186 57.0099 42.8122 172.3557 106 L 4.3289 6.2622 121.6374 55.2380 43.3585 173.8523 107 G 4.1891 8.3505 104.3308 45.0019 0.0000 172.1407 108 I 5.0472 8.0822 121.3727 59.2587 40.6903 175.7493 109 G 4.0390 8.9443 114.2342 45.2462 0.0000 174.2211 110 N 4.4176 8.7647 116.3391 53.8877 38.9589 177.0128 111 G 3.9964 7.7769 103.4895 45.8602 0.0000 172.9525 112 T 4.7141 8.4727 116.9311 60.4907 70.8675 173.5961 113 Q 4.4257 8.7938 129.4742 55.8734 30.4109 174.5588 114 I 5.1761 8.7017 128.1246 59.0889 39.7330 174.1163 115 Y 4.9105 8.4390 125.0381 56.4346 40.1734 174.7009 116 V 4.6877 8.7763 123.9853 61.0722 34.4496 174.2761 117 I 4.7177 8.2965 128.1604 59.2819 39.2979 175.0520 118 D 4.5204 8.6233 125.7981 53.2422 41.3730 174.7524 119 P 4.4425 0.0000 0.0000 62.4014 31.8495 175.9696 120 E 4.2428 8.4638 119.8432 55.6127 30.0477 177.6208 121 P 4.6457 0.0000 0.0000 61.7173 30.9764 176.0322 122 C 4.2195 9.2775 124.8007 59.9013 31.6918 173.0968 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 M 8.16 4.52 0.00 2.01 2.17 0.00 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.59 0.00 4 H 8.81 4.39 0.00 3.37 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.71 4.80 2.05 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 1.01 0.00 0.00 0.92 0.00 0.00 6 A 8.88 4.98 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.29 5.27 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.84 0.00 0.00 0.00 0.00 0.00 2.26 2.22 0.00 8 P 0.00 4.28 0.00 2.14 2.03 0.00 3.64 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.16 0.00 9 A 8.61 4.10 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.51 4.85 2.12 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 0.95 0.00 0.00 1.00 0.00 0.00 11 V 8.79 4.52 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 0.92 0.00 0.00 0.87 0.00 0.00 12 L 8.49 5.16 0.00 1.58 1.62 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.69 4.39 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 14 S 8.96 4.34 0.00 4.00 4.04 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 15 S 8.48 4.15 0.00 4.00 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 0.00 16 R 8.01 4.30 0.00 1.81 1.98 0.00 3.30 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 17 G 8.11 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 0.00 0.00 0.00 18 I 7.66 5.16 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 1.13 0.86 0.92 0.00 0.00 19 A 9.05 4.98 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 0.00 0.00 0.00 0.00 0.00 20 S 8.81 5.19 0.00 3.72 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 21 F 8.52 4.99 0.00 3.07 3.09 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 0.00 0.00 0.00 22 V 8.61 4.80 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 1.07 0.00 0.00 1.00 0.00 0.00 23 C 9.05 5.46 0.00 3.06 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 24 E 9.24 5.22 0.00 1.91 1.78 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 2.22 2.26 0.00 25 Y 8.27 5.35 0.00 2.90 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 26 A 8.96 4.19 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 27 S 8.69 4.13 0.00 4.00 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 28 P 0.00 4.34 0.00 2.30 2.49 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 29 G 8.21 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 30 K 8.30 4.23 0.00 1.77 1.89 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.44 7.81 31 A 7.94 4.22 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 32 T 7.81 4.22 4.38 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 1.23 0.00 0.00 33 E 9.67 4.26 0.00 2.10 1.90 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 2.21 2.20 0.00 34 V 8.34 4.73 1.13 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 0.56 0.00 0.00 0.87 0.00 0.00 35 R 8.65 5.04 0.00 1.83 1.69 0.00 3.12 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.72 0.00 36 V 9.03 4.94 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 0.98 0.00 0.00 1.10 0.00 0.00 37 T 9.13 5.16 4.28 0.00 0.00 0.00 0.00 0.00 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 38 V 9.12 4.71 2.19 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 1.21 0.00 0.00 1.06 0.00 0.00 39 L 8.95 5.10 0.00 1.57 1.48 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 40 R 9.07 4.35 0.00 1.19 1.52 0.00 2.85 0.00 0.00 2.96 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.81 0.00 41 Q 8.80 5.09 0.00 2.03 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.50 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 42 A 9.08 4.62 1.14 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 43 D 9.47 4.27 0.00 2.75 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.18 3.80 0.00 4.05 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 45 Q 8.02 4.72 0.00 2.01 1.95 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 2.48 2.40 0.00 46 V 8.32 4.94 2.05 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 0.80 0.00 0.00 0.89 0.00 0.00 47 T 8.69 4.73 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 48 E 8.69 4.42 0.00 2.01 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 2.30 2.33 0.00 49 V 9.18 4.09 2.28 0.00 0.00 0.00 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 0.94 0.00 0.00 50 C 7.99 5.12 0.00 3.06 3.06 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 0.00 0.00 0.00 51 A 8.88 5.54 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.01 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.38 5.07 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 1.17 0.00 0.00 54 Y 8.72 4.80 0.00 2.96 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 55 M 8.58 4.91 0.00 2.20 1.97 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 2.73 2.59 0.00 56 M 8.72 4.18 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.61 0.00 57 G 9.03 4.11 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 0.00 58 N 7.61 5.10 0.00 2.73 2.72 0.00 0.00 6.64 7.54 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 59 E 8.56 4.34 0.00 1.96 1.82 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 2.28 2.43 0.00 60 L 8.44 4.17 0.00 1.42 0.98 0.76 -0.13 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 61 T 8.07 4.32 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 1.20 0.00 0.00 62 F 8.36 4.73 0.00 3.06 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 63 L 8.46 4.19 0.00 1.78 1.66 0.96 1.03 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 64 D 8.40 4.54 0.00 2.66 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.82 4.52 0.00 2.85 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 66 S 7.69 4.35 0.00 3.95 3.83 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 67 I 8.17 4.12 2.06 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 1.31 0.81 0.90 0.00 0.00 68 C 7.57 5.20 0.00 1.23 1.82 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 69 T 8.09 4.91 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 70 G 7.95 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 0.00 0.00 0.00 0.00 71 T 7.89 5.00 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 72 S 8.69 5.21 0.00 3.36 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 73 S 8.79 4.57 0.00 3.88 3.87 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 74 G 8.95 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 75 N 8.42 4.78 0.00 2.71 2.89 0.00 0.00 5.47 7.44 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 76 Q 7.92 4.76 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.63 6.79 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 77 V 8.77 4.79 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 0.80 0.00 0.00 1.16 0.00 0.00 78 N 9.27 4.93 0.00 2.52 2.70 0.00 0.00 6.56 6.73 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 79 L 8.36 5.00 0.00 0.68 1.13 0.83 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 80 T 8.41 4.92 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 1.14 0.00 0.00 81 I 9.02 4.83 1.76 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.72 0.82 0.00 0.00 82 Q 8.70 4.88 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.24 0.00 0.00 0.00 0.00 0.00 2.36 2.23 0.00 83 G 8.76 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 0.00 0.00 0.00 84 L 7.85 4.36 0.00 1.81 1.58 0.74 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 85 R 9.09 4.77 0.00 1.90 1.78 0.00 3.17 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 86 A 9.87 4.77 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 87 M 8.04 4.20 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.59 0.00 88 D 8.60 4.73 0.00 2.84 2.88 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 0.00 0.00 0.00 89 T 7.85 4.11 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 1.30 0.00 0.00 90 G 7.84 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 0.00 0.00 0.00 91 L 7.79 4.95 0.00 1.81 1.59 0.86 1.00 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 92 Y 9.16 4.79 0.00 2.92 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 93 I 8.82 4.72 1.86 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 1.21 0.73 0.95 0.00 0.00 94 C 9.17 5.11 0.00 3.15 3.09 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 0.00 0.00 0.00 95 K 9.08 4.88 0.00 1.80 1.76 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.31 1.31 7.81 96 V 8.62 4.69 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 -0.13 0.00 0.00 0.76 0.00 0.00 97 E 9.02 4.87 0.00 1.92 1.86 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 2.21 2.21 0.00 98 L 8.69 4.52 0.00 1.68 1.62 0.85 0.98 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 99 M 8.85 4.43 0.00 2.00 2.25 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 2.65 2.81 0.00 100 Y 7.71 4.85 0.00 3.05 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 0.00 101 P 0.00 3.71 0.00 1.76 1.01 0.00 3.71 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 102 P 0.00 4.39 0.00 2.02 2.05 0.00 3.46 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 103 P 0.00 4.66 0.00 2.19 2.04 0.00 3.73 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 1.89 0.00 104 Y 8.37 4.43 0.00 3.01 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 0.00 105 Y 7.53 4.68 0.00 2.84 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 0.00 106 L 6.26 4.33 0.00 1.52 1.13 0.90 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.35 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 0.00 0.00 0.00 108 I 8.08 5.05 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 1.24 0.64 0.90 0.00 0.00 109 G 8.94 4.04 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 0.00 0.00 0.00 110 N 8.76 4.42 0.00 2.73 2.88 0.00 0.00 7.11 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 0.00 111 G 7.78 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.47 4.71 3.51 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 0.71 0.00 0.00 113 Q 8.79 4.43 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.76 0.00 0.00 0.00 0.00 0.00 1.93 1.31 0.00 114 I 8.70 5.18 1.64 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.21 0.74 0.00 0.00 115 Y 8.44 4.91 0.00 3.00 2.82 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 0.00 116 V 8.78 4.69 2.22 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 0.99 0.00 0.00 0.94 0.00 0.00 117 I 8.30 4.72 1.89 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 1.43 0.82 0.92 0.00 0.00 118 D 8.62 4.52 0.00 2.67 2.61 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 0.00 119 P 0.00 4.44 0.00 2.04 1.99 0.00 3.68 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 120 E 8.46 4.24 0.00 2.00 1.86 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 2.40 2.27 0.00 121 P 0.00 4.65 0.00 2.04 2.09 0.00 3.68 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 122 C 9.28 4.22 0.00 2.88 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