NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3858 8.2893 120.3493 55.5487 32.0739 174.1196 2 N 4.4869 8.0564 121.4379 50.5053 37.8541 171.0783 3 E 3.9650 9.3318 125.3615 57.0259 29.4036 178.4402 4 L 4.4211 8.1523 124.8131 53.3262 40.6412 175.9289 5 E 4.5135 7.9955 123.2346 53.5589 31.9977 175.8509 6 G 3.7806 8.1499 112.8308 45.2751 0.0000 172.1892 7 Y 4.7758 8.7886 117.2441 56.0979 40.2022 176.8418 8 V 4.0736 8.5907 123.7179 63.4525 32.5335 177.5388 9 T 4.2244 8.1564 117.2995 66.0883 68.8417 175.0037 10 K 4.3945 7.9480 120.0228 56.6324 32.5624 177.3074 11 A 4.3030 8.1949 123.7185 53.5607 19.0463 182.1152 12 Q 3.4282 7.7418 111.6525 57.9802 31.6010 180.1087 13 S 4.0939 7.9987 110.7694 59.9371 63.1721 174.2752 14 F 4.2922 8.5758 119.8599 56.4419 39.9803 174.5257 15 R 4.5723 8.3866 121.7249 54.7201 32.3537 174.3569 16 F 5.6757 8.7371 123.0774 55.7708 43.9108 173.5283 17 A 4.6789 8.5593 120.5723 50.4658 22.4815 175.1759 18 I 4.8184 8.8643 122.7432 59.4466 40.4050 174.9800 19 V 4.5793 8.6472 125.6659 61.1885 34.2932 174.6088 20 V 5.2736 8.7471 120.6337 58.3441 35.3153 174.6428 21 A 5.1209 8.5029 125.7702 51.2266 19.5166 177.8493 22 R 4.2580 9.4399 122.7435 58.8217 30.6084 176.8190 23 F 4.0687 8.2511 119.8750 59.7761 39.8171 174.1866 24 N 4.3290 8.4507 123.2482 54.3956 36.2570 176.0716 25 E 4.4989 8.0254 121.5428 59.3346 29.4022 177.6198 26 F 3.9643 8.3520 118.6859 60.9867 39.4269 176.4241 27 V 4.1245 8.4976 117.1653 65.0564 32.0512 177.5556 28 T 3.8635 8.0159 109.0875 65.1580 68.2779 175.3032 29 R 4.0485 8.4889 122.0919 59.3749 30.0009 178.0997 30 R 3.8163 7.9767 116.7275 59.3365 30.1547 178.1798 31 L 3.8304 8.2347 120.1721 58.6265 41.9498 178.7527 32 M 3.8667 8.5950 117.8086 58.8459 32.1550 177.6716 33 E 4.0796 8.7238 119.1340 59.5937 29.5369 179.8800 34 G 3.4872 8.4739 105.4825 47.6971 0.0000 175.3459 35 A 3.6649 7.8015 124.0362 54.8202 18.4238 178.8562 36 L 4.0668 8.2697 118.7840 58.6513 42.0322 178.2900 37 D 4.3951 8.5304 117.6185 58.1489 41.1146 178.7793 38 T 3.9088 8.0645 116.0004 66.9481 68.2124 176.0886 39 F 4.3180 7.6504 118.0450 60.7418 39.2328 177.4301 40 K 4.1807 8.1479 117.2014 59.6916 31.7609 179.1065 41 K 3.8378 8.5074 118.5549 59.1814 32.5942 176.8684 42 Y 4.3262 8.6642 117.6498 58.3521 38.5983 176.1484 43 S 3.7690 8.2879 111.4864 58.8370 63.4938 172.8515 44 V 3.9864 7.8123 120.2232 62.1013 31.7464 175.7724 45 N 4.7015 8.2792 120.3455 53.7423 40.7283 174.1184 46 E 4.5162 9.0566 126.1090 56.4712 30.7220 174.5279 47 D 4.2930 8.8893 114.1203 59.7759 40.1706 173.8934 48 I 3.5978 6.5164 109.1396 58.3821 39.5098 174.3971 49 D 4.6593 8.7532 124.2519 54.0352 42.2469 175.4090 50 V 4.6339 8.3515 116.2871 59.5383 34.0118 175.0309 51 V 4.2778 8.8731 126.6485 60.9626 33.3281 174.3740 52 W 5.2016 8.8598 128.1466 55.8778 30.2933 176.1855 53 V 4.7120 9.1241 118.0788 58.8613 34.8215 174.8701 54 P 4.3607 0.0000 0.0000 65.5011 32.0327 176.3988 55 G 4.5486 8.2161 108.4311 42.4287 0.0000 173.1047 56 A 3.9337 8.6511 122.7613 55.3624 18.7575 179.4348 57 Y 3.9168 8.3425 116.0742 61.1805 38.7456 178.1458 58 E 4.1653 8.7110 119.2910 59.4934 29.5159 179.3811 59 L 3.9704 7.7355 118.8841 58.6953 41.7280 179.0702 60 G 3.6895 7.8057 101.1564 49.3275 0.0000 175.6209 61 V 3.6624 7.6933 112.0853 63.8687 32.1453 178.6019 62 T 3.8306 7.7701 114.6148 66.6737 68.2873 176.2805 63 A 3.8838 8.6893 122.5415 55.6473 18.3843 179.3790 64 Q 3.8257 8.4449 118.1586 60.0371 29.1933 178.7461 65 A 4.0149 8.8243 122.1033 54.6110 18.0648 179.1281 66 L 4.1202 8.1694 117.8645 57.7983 42.3732 180.2384 67 G 3.8131 8.8853 105.6253 47.9781 0.0000 176.0542 68 K 4.1898 8.1817 120.3144 58.2417 32.3598 179.0203 69 S 4.3425 8.4314 114.4668 58.7773 62.6578 175.2268 70 G 3.9364 7.9338 109.4447 46.2617 0.0000 174.7266 71 K 3.7991 7.8178 119.4174 58.1091 32.2119 176.8863 72 Y 4.7662 7.4130 114.2328 56.5831 40.3846 174.8915 73 H 4.8416 9.0137 118.2699 57.4144 30.0850 175.7519 74 A 4.9545 7.8653 118.1190 50.7227 22.7236 175.0840 75 I 4.9196 8.8213 115.6346 58.9309 40.6943 174.6542 76 V 4.6314 8.8425 125.8947 60.0978 33.8736 174.1405 77 C 5.0844 9.0975 122.9722 57.9069 30.6183 172.7995 78 L 5.5226 8.0247 123.5768 52.1614 44.8542 175.7874 79 G 4.3490 8.0764 107.2425 46.3417 0.0000 171.9586 80 A 5.1808 8.5471 121.4435 50.5716 22.1506 176.2736 81 V 4.2773 9.1824 123.2162 59.9056 33.6141 175.2096 82 V 4.2671 8.4631 119.5296 60.6306 32.5830 177.6706 83 K 3.5730 8.5398 127.3472 56.7272 29.2051 176.9987 84 G 3.7916 8.5714 113.2990 47.2609 0.0000 171.6298 85 D 4.6266 7.8341 117.0739 54.5882 43.3901 177.6942 86 T 4.2683 8.5035 115.1401 61.3406 70.7576 176.0713 87 S 4.9523 8.5406 116.9512 60.1318 62.6187 175.2364 88 H 3.8837 7.9232 122.3793 60.0797 29.4334 175.3510 89 Y 4.1669 8.2277 120.5509 61.3744 38.5238 177.7123 90 D 4.2087 8.4935 118.2384 58.0703 41.0437 178.6142 91 A 3.8438 8.2923 120.0435 55.9869 18.2826 179.4515 92 V 3.6126 8.3902 115.4439 65.9972 31.6349 178.3722 93 V 3.4496 8.0941 117.9083 66.4554 31.2002 177.7956 94 N 4.2445 8.8429 116.3520 56.3030 38.3446 177.2086 95 S 3.9671 8.1890 116.0988 62.1774 63.0113 176.3757 96 A 3.9614 8.7001 123.6115 55.3232 17.9623 179.1160 97 S 4.2652 8.7810 110.3076 61.7780 62.5108 176.5880 98 S 4.1089 8.9366 116.2997 61.6278 62.0942 176.1984 99 G 3.6398 8.5924 108.6501 48.1763 0.0000 175.3830 100 V 3.6721 7.9525 121.1195 65.7556 31.4436 177.4453 101 L 3.9297 8.2542 119.9708 57.7970 41.7920 178.7303 102 S 4.0809 8.7299 114.8721 62.0536 62.9794 176.5025 103 A 4.1644 8.5939 123.2429 55.3633 17.9679 179.4913 104 G 4.3417 8.2831 102.9923 47.8493 0.0000 175.4339 105 L 4.0269 7.8377 120.2097 57.5591 41.8028 179.0567 106 N 4.5047 8.7158 115.8738 56.4575 38.6354 177.4080 107 S 4.3795 8.8022 114.5905 59.0083 63.3534 175.4012 108 G 3.9701 8.0997 109.4321 45.6484 0.0000 172.8306 109 V 4.5403 7.8019 120.2275 59.8635 34.2566 173.2195 110 P 4.5524 0.0000 0.0000 63.3260 32.3173 174.7639 111 C 5.2482 8.5816 122.1743 57.8763 30.7066 173.8096 112 V 3.7310 8.8889 125.8639 62.5314 32.2804 175.4527 113 F 4.4725 8.9739 131.7132 56.4640 37.7497 175.5197 114 G 4.1713 8.7521 118.4826 44.1501 0.0000 170.7829 115 V 4.8032 6.3863 116.9887 59.5715 34.3935 177.2900 116 L 4.4241 8.8842 125.7483 54.1920 42.9283 177.1695 117 T 5.3309 7.9332 112.1947 60.3856 68.2428 173.1461 118 C 4.2933 8.1809 119.3116 60.4438 30.2206 174.5538 119 D 4.5608 8.9976 120.1228 56.0522 39.5894 176.7493 120 N 4.7231 9.5445 116.3294 51.9199 39.4362 175.8133 121 M 3.9743 8.8329 119.7316 59.1941 32.1973 177.7949 122 D 4.3669 8.2212 117.2864 57.7959 41.0161 178.1338 123 Q 3.9969 8.8009 116.7616 59.0171 28.9798 178.6961 124 A 4.1648 7.7313 120.6778 55.5130 18.3822 179.4291 125 I 3.7257 8.0354 118.2834 65.1797 37.2405 178.2933 126 N 4.4343 8.1436 116.6820 56.1887 38.3899 177.5056 127 R 4.0634 8.5471 119.2376 57.5178 30.9254 176.8134 128 A 4.4434 7.5835 123.5652 51.4198 18.2184 177.5029 129 G 3.9124 9.0006 106.0328 45.7750 0.0000 173.8209 130 G 4.2480 7.7713 110.9935 43.9997 0.0000 175.4008 131 K 4.1863 8.2778 120.2699 58.1527 32.5333 177.2209 132 A 4.4851 8.0011 121.4531 51.8129 20.0795 178.4685 133 G 3.7307 8.8471 105.1026 45.3188 0.0000 172.9594 134 N 5.7950 8.0394 119.2143 50.0407 41.4093 175.5100 135 K 4.1453 8.1845 131.3033 58.8993 32.3012 177.9815 136 G 3.7488 8.2367 104.9791 48.0724 0.0000 174.8583 137 A 3.7779 8.3136 123.4028 54.5846 18.0441 179.2550 138 E 3.7343 8.0165 116.7813 59.8431 29.1998 179.8324 139 S 3.9937 8.5498 114.9149 61.5364 62.8444 176.4828 140 A 3.3948 7.5595 123.0695 54.8917 17.9707 179.0368 141 L 3.3479 7.4409 118.4696 58.6988 42.0237 179.4814 142 T 3.6959 8.0574 115.3491 66.3810 68.2983 176.1060 143 A 3.8923 8.0930 122.9982 55.9127 18.2435 179.0863 144 I 3.6250 7.5543 117.5678 64.7348 37.1458 177.7231 145 E 3.8313 8.3601 119.2741 59.9734 29.4650 179.4843 146 M 3.8295 8.4416 118.2765 58.3535 31.7926 178.1604 147 A 3.8545 7.9177 119.7438 55.3208 18.7508 178.9285 148 S 4.2266 7.9318 111.0026 61.6390 62.3838 176.1624 149 L 3.9970 8.3634 122.9835 58.6860 41.7705 179.0582 150 F 4.4851 8.7978 117.4075 59.2333 39.8636 174.7971 151 E 5.0773 8.0339 118.3883 52.8283 28.6395 173.8894 152 H 4.9016 7.7979 129.2516 56.8008 32.2534 174.5834 153 H 4.4839 8.9472 113.6309 57.1622 29.0486 174.8413 154 L 3.9410 7.3039 120.8274 53.0500 41.9538 173.9801 155 K 4.1197 7.5179 121.0361 56.8092 32.7158 175.9870 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 M 8.29 4.39 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 N 8.06 4.49 0.00 2.91 2.78 0.00 0.00 6.33 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 3 E 9.33 3.96 0.00 1.97 1.97 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 2.31 2.33 0.00 4 L 8.15 4.42 0.00 1.68 1.83 0.96 0.95 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 E 8.00 4.51 0.00 1.79 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 6 G 8.15 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 0.00 0.00 0.00 7 Y 8.79 4.78 0.00 2.97 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 8 V 8.59 4.07 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 0.96 0.00 0.00 0.88 0.00 0.00 9 T 8.16 4.22 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 1.25 0.00 0.00 10 K 7.95 4.39 0.00 1.95 1.88 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.35 0.00 0.00 3.61 0.00 0.00 0.00 0.00 1.61 1.86 7.81 11 A 8.19 4.30 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.74 3.43 0.00 2.32 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 13 S 8.00 4.09 0.00 3.60 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 14 F 8.58 4.29 0.00 2.65 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 0.00 0.00 0.00 15 R 8.39 4.57 0.00 1.82 1.62 0.00 3.10 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.75 0.00 16 F 8.74 5.68 0.00 2.49 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 17 A 8.56 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.86 4.82 1.74 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 1.18 0.89 0.74 0.00 0.00 19 V 8.65 4.58 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 0.95 0.00 0.00 0.87 0.00 0.00 20 V 8.75 5.27 1.75 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 0.67 0.00 0.00 -0.57 0.00 0.00 21 A 8.50 5.12 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 22 R 9.44 4.26 0.00 1.95 2.14 0.00 3.04 0.00 0.00 2.92 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.30 0.00 23 F 8.25 4.07 0.00 3.32 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 24 N 8.45 4.33 0.00 3.25 3.06 0.00 0.00 6.72 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 25 E 8.03 4.50 0.00 2.29 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 2.28 0.00 26 F 8.35 3.96 0.00 3.11 3.15 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 27 V 8.50 4.12 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 1.06 0.00 0.00 1.16 0.00 0.00 28 T 8.02 3.86 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 1.37 0.00 0.00 29 R 8.49 4.05 0.00 2.17 1.99 0.00 3.37 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 30 R 7.98 3.82 0.00 2.06 1.93 0.00 3.26 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.51 0.00 31 L 8.23 3.83 0.00 1.88 1.72 0.89 0.84 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 32 M 8.59 3.87 0.00 2.11 1.81 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.60 0.00 33 E 8.72 4.08 0.00 2.16 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 2.36 2.58 0.00 34 G 8.47 3.49 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 0.00 0.00 0.00 35 A 7.80 3.66 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 36 L 8.27 4.07 0.00 2.00 1.72 1.01 1.10 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 37 D 8.53 4.40 0.00 2.80 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 38 T 8.06 3.91 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 0.78 0.00 0.00 39 F 7.65 4.32 0.00 3.35 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 40 K 8.15 4.18 0.00 2.00 1.94 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.58 1.67 7.81 41 K 8.51 3.84 0.00 2.05 2.30 0.00 1.95 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.49 7.81 42 Y 8.66 4.33 0.00 3.32 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 43 S 8.29 3.77 0.00 4.13 4.02 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 0.00 0.00 0.00 44 V 7.81 3.99 2.41 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 0.89 0.00 0.00 1.30 0.00 0.00 45 N 8.28 4.70 0.00 2.76 2.75 0.00 0.00 6.94 7.53 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 46 E 9.06 4.52 0.00 2.04 1.84 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 2.13 2.23 0.00 47 D 8.89 4.29 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 48 I 6.52 3.60 1.72 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.65 0.53 0.00 0.00 49 D 8.75 4.66 0.00 2.63 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 50 V 8.35 4.63 1.77 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 0.60 0.00 0.00 0.90 0.00 0.00 51 V 8.87 4.28 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 1.07 0.00 0.00 0.86 0.00 0.00 52 W 8.86 5.20 0.00 3.23 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 53 V 9.12 4.71 2.17 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 0.83 0.00 0.00 1.03 0.00 0.00 54 P 0.00 4.36 0.00 2.20 2.37 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.05 0.00 55 G 8.22 4.55 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 0.00 56 A 8.65 3.93 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 57 Y 8.34 3.92 0.00 3.01 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 58 E 8.71 4.17 0.00 2.40 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 2.42 2.50 0.00 59 L 7.74 3.97 0.00 1.73 1.68 0.78 1.03 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 60 G 7.81 3.69 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 0.00 0.00 0.00 61 V 7.69 3.66 2.11 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 0.82 0.00 0.00 1.03 0.00 0.00 62 T 7.77 3.83 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 1.21 0.00 0.00 63 A 8.69 3.88 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 64 Q 8.44 3.83 0.00 2.21 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 65 A 8.82 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 66 L 8.17 4.12 0.00 1.75 1.68 0.69 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.89 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 68 K 8.18 4.19 0.00 1.95 1.92 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.48 7.81 69 S 8.43 4.34 0.00 4.07 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 70 G 7.93 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 71 K 7.82 3.80 0.00 0.79 1.19 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.28 1.38 7.81 72 Y 7.41 4.77 0.00 2.95 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.01 4.84 0.00 2.82 3.45 0.00 5.89 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 7.87 4.95 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 75 I 8.82 4.92 1.78 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 1.27 1.33 0.76 0.00 0.00 76 V 8.84 4.63 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 0.94 0.00 0.00 0.83 0.00 0.00 77 C 9.10 5.08 0.00 2.69 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 78 L 8.02 5.52 0.00 1.39 1.40 0.79 0.65 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 79 G 8.08 4.35 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 0.00 80 A 8.55 5.18 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 81 V 9.18 4.28 1.96 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 0.82 0.00 0.00 0.87 0.00 0.00 82 V 8.46 4.27 2.32 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 0.76 0.00 0.00 1.06 0.00 0.00 83 K 8.54 3.57 0.00 0.79 1.45 0.00 0.85 0.00 0.00 1.52 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.09 0.68 7.81 84 G 8.57 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 0.00 0.00 0.00 85 D 7.83 4.63 0.00 2.63 2.40 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 86 T 8.50 4.27 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 1.24 0.00 0.00 87 S 8.54 4.95 0.00 4.27 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 0.00 88 H 7.92 3.88 0.00 3.29 3.43 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Y 8.23 4.17 0.00 3.11 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 90 D 8.49 4.21 0.00 2.91 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 91 A 8.29 3.84 1.29 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 92 V 8.39 3.61 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 0.94 0.00 0.00 1.01 0.00 0.00 93 V 8.09 3.45 1.89 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 0.91 0.00 0.00 0.13 0.00 0.00 94 N 8.84 4.24 0.00 2.84 2.79 0.00 0.00 7.05 6.93 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 95 S 8.19 3.97 0.00 3.70 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 96 A 8.70 3.96 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 97 S 8.78 4.27 0.00 3.72 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 98 S 8.94 4.11 0.00 3.80 3.97 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 99 G 8.59 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.95 3.67 2.45 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 1.10 0.00 0.00 0.97 0.00 0.00 101 L 8.25 3.93 0.00 1.83 1.72 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.73 4.08 0.00 3.99 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 0.00 103 A 8.59 4.16 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 0.00 104 G 8.28 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 0.00 0.00 0.00 0.00 105 L 7.84 4.03 0.00 1.80 1.76 0.95 1.00 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 0.00 106 N 8.72 4.50 0.00 2.70 2.90 0.00 0.00 7.19 7.18 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 0.00 107 S 8.80 4.38 0.00 4.03 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 0.00 108 G 8.10 3.97 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 0.00 0.00 0.00 109 V 7.80 4.54 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 1.08 0.00 0.00 1.05 0.00 0.00 110 P 0.00 4.55 0.00 1.95 1.74 0.00 3.71 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 1.31 1.38 0.00 111 C 8.58 5.25 0.00 2.94 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 0.00 112 V 8.89 3.73 2.03 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 0.85 0.00 0.00 0.88 0.00 0.00 113 F 8.97 4.47 0.00 3.05 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 0.00 114 G 8.75 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 0.00 0.00 0.00 0.00 115 V 6.39 4.80 1.77 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 -0.87 0.00 0.00 0.72 0.00 0.00 116 L 8.88 4.42 0.00 1.63 1.66 0.94 0.30 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 0.00 117 T 7.93 5.33 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 1.28 0.00 0.00 118 C 8.18 4.29 0.00 2.97 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 0.00 119 D 9.00 4.56 0.00 2.68 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 N 9.54 4.72 0.00 2.89 2.91 0.00 0.00 6.77 7.96 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 0.00 121 M 8.83 3.97 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 122 D 8.22 4.37 0.00 2.82 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 0.00 123 Q 8.80 4.00 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.70 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 124 A 7.73 4.16 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 0.00 125 I 8.04 3.73 2.05 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.71 1.02 0.00 0.00 126 N 8.14 4.43 0.00 3.01 2.88 0.00 0.00 7.05 7.53 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 0.00 127 R 8.55 4.06 0.00 1.93 1.98 0.00 3.28 0.00 0.00 3.18 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.81 0.00 128 A 7.58 4.44 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 0.00 129 G 9.00 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 0.00 130 G 7.77 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 0.00 0.00 0.00 0.00 131 K 8.28 4.19 0.00 1.83 1.95 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.39 7.81 132 A 8.00 4.49 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 0.00 133 G 8.85 3.73 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 0.00 0.00 0.00 134 N 8.04 5.79 0.00 2.77 2.60 0.00 0.00 6.78 6.51 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 0.00 135 K 8.18 4.15 0.00 1.83 1.75 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.20 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.36 7.81 136 G 8.24 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 0.00 0.00 0.00 137 A 8.31 3.78 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 0.00 138 E 8.02 3.73 0.00 2.12 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 2.26 2.43 0.00 139 S 8.55 3.99 0.00 3.83 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 0.00 140 A 7.56 3.39 0.33 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 0.00 141 L 7.44 3.35 0.00 1.43 1.64 0.71 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 142 T 8.06 3.70 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 1.12 0.00 0.00 143 A 8.09 3.89 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 0.00 144 I 7.55 3.63 1.93 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.55 0.92 0.00 0.00 145 E 8.36 3.83 0.00 1.94 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 2.24 2.31 0.00 146 M 8.44 3.83 0.00 1.65 2.12 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.69 0.00 147 A 7.92 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 148 S 7.93 4.23 0.00 3.84 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 0.00 149 L 8.36 4.00 0.00 1.85 2.02 0.95 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 150 F 8.80 4.49 0.00 3.42 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 0.00 151 E 8.03 5.08 0.00 2.25 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 0.00 2.41 2.37 0.00 152 H 7.80 4.90 0.00 3.38 3.68 0.00 5.71 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 0.00 153 H 8.95 4.48 0.00 3.33 3.71 0.00 5.96 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 7.30 3.94 0.00 1.74 1.61 0.84 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 155 K 7.52 4.12 0.00 1.82 1.69 0.00 1.53 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.27 1.40 7.81