NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.3714 8.3149 120.0894 56.1964 33.5749 175.0201 4 C 4.4673 8.9280 124.2525 58.5037 28.3125 171.5144 5 S 4.8159 9.3784 120.0999 56.3879 64.3423 173.8667 6 L 4.0551 8.3586 124.8819 56.3049 41.8002 177.6983 7 T 3.9419 7.1784 116.3629 64.2706 68.9236 172.7274 8 G 3.5648 8.0463 111.6686 43.7158 0.0000 171.6451 9 K 5.0137 8.1684 119.8678 54.5549 34.5252 175.8589 10 W 5.5520 9.4496 128.1879 55.9309 33.7315 174.9238 11 T 5.3828 9.2838 116.2088 59.8131 72.5090 173.3271 12 N 6.0271 8.7009 119.8229 50.0681 40.2248 175.1476 13 N 4.3398 8.6819 115.1805 55.3517 37.3776 175.7300 14 L 4.1965 8.0757 117.4624 54.9737 42.0527 177.5724 15 G 3.9716 8.2403 107.8326 44.7963 0.0000 174.1444 16 S 4.5200 7.9311 115.6277 58.6697 64.5182 173.0631 17 I 5.2160 8.4936 122.7814 59.7325 40.3391 174.6316 18 M 5.0783 9.0376 122.6964 53.7323 35.1172 174.2529 19 T 5.0099 8.8504 116.7713 61.9799 72.0663 172.8790 20 I 4.7203 8.7434 127.5267 59.8262 40.0840 176.1265 21 R 4.5167 8.5024 126.1010 55.0121 32.7303 175.9353 22 A 4.0104 8.5912 122.6422 53.1319 18.9494 177.3517 23 V 4.3322 7.6280 122.1957 61.5982 32.6350 176.1356 24 N 4.8135 8.7406 125.7574 51.7282 39.2336 175.5576 25 S 4.2351 8.4831 111.5322 60.9616 63.1865 175.1246 26 R 4.0555 8.0902 118.7140 56.9759 30.4155 177.2466 27 G 4.4851 8.3888 106.6924 46.1897 0.0000 173.0635 28 E 4.7637 8.4854 120.0992 56.1926 30.8404 175.8649 29 F 5.2064 8.4773 116.8756 55.8507 41.9488 172.9570 30 T 5.0130 8.3159 114.1101 60.4097 71.4342 172.6822 31 G 3.9460 7.5383 109.1041 45.9358 0.0000 171.9967 32 T 5.2326 8.0037 108.4512 60.1056 72.9019 172.4653 33 Y 4.8406 9.2070 123.5032 55.9776 42.4194 173.6136 34 L 4.9963 9.0430 129.7589 53.4279 43.5370 175.2047 35 T 4.5815 8.9594 120.6416 61.7371 68.1065 174.5524 36 A 4.2203 8.7927 131.1797 54.0449 18.8749 178.0264 37 V 4.4420 7.2085 106.8487 59.9369 35.2854 174.3215 38 A 4.3302 7.8867 122.7893 51.3667 21.7879 176.3776 39 D 4.4949 8.7217 119.3698 57.1247 41.0543 177.2744 40 N 4.9347 7.6841 116.6450 50.0835 39.2885 172.7958 41 P 4.1235 0.0000 0.0000 64.9729 31.8977 179.6542 42 G 3.6583 8.0117 106.8840 47.5998 0.0000 173.5976 43 N 4.6358 7.8659 115.8061 53.0370 39.2924 175.5566 44 I 2.0000 6.8590 120.6294 60.9851 37.4970 175.4837 45 T 4.6896 7.3000 113.6529 58.9978 71.8822 173.1739 46 L 4.2375 8.6287 124.3601 56.3030 42.5703 176.3935 47 S 5.0754 9.1570 121.0481 56.0414 67.3564 171.7941 48 P 5.1222 0.0000 0.0000 62.5637 33.0786 174.8519 49 L 5.3285 8.7168 120.7397 54.1973 44.4200 175.0146 50 L 4.8632 8.7477 121.5828 53.9533 45.9781 175.2419 51 G 4.1264 8.0632 111.9719 45.5382 0.0000 171.2339 52 I 5.2458 8.5132 119.5077 59.5249 41.4805 175.1364 53 Q 5.4352 9.3969 124.4818 54.4907 31.8576 174.9972 54 H 4.6288 8.9944 117.4496 56.0148 29.4924 175.6876 55 K 4.4217 8.5529 120.8377 58.2523 33.4516 178.4179 56 R 4.0733 8.0240 116.1695 58.5880 30.4297 177.3028 57 A 4.1855 7.8425 120.2428 51.9033 19.0882 177.6627 58 S 4.3210 8.7858 116.6998 60.6174 63.7913 173.4707 59 Q 5.2838 7.8430 119.0447 52.2238 27.9273 173.5328 60 P 4.5088 0.0000 0.0000 62.8373 33.5591 177.3098 61 T 4.7373 8.3837 118.2982 63.7620 70.4481 173.0924 62 F 5.3306 8.1376 117.0561 56.6228 41.8646 172.9559 63 G 4.7438 9.4315 105.6791 45.1999 0.0000 171.6325 64 F 5.5266 9.0619 115.1007 55.8532 42.0822 172.9502 65 T 4.9980 9.0460 116.8076 61.8650 71.5211 173.4384 66 V 4.3702 8.7482 126.4964 61.3498 33.4568 174.1296 67 H 4.3104 8.3177 129.3520 54.4438 29.7492 174.6268 68 W 4.2469 7.4247 126.6233 56.8258 29.0531 176.5212 69 N 4.7743 9.3554 121.8795 53.7803 38.3361 175.4922 70 F 4.9964 7.4366 111.4019 56.0739 38.9827 173.9253 71 S 4.5271 7.1851 114.4147 57.7032 65.5997 173.3739 72 E 4.2744 8.4633 117.7107 56.7806 29.1622 176.9367 73 S 4.8260 7.6221 116.0702 58.3693 65.0389 173.1916 74 T 5.0079 8.8809 116.7929 62.3832 72.9108 173.3587 75 T 5.1634 8.4932 121.1303 61.8865 72.0498 173.4810 76 V 4.8991 8.5894 118.0737 59.6020 34.9934 174.6905 77 F 5.2966 8.8274 122.5676 55.9873 42.2563 174.2722 78 T 4.7310 8.8891 116.4376 60.6614 71.4048 173.9090 79 G 4.5070 6.6852 111.1969 46.0513 0.0000 171.5535 80 Q 4.7848 7.6031 119.0456 54.5358 33.0559 174.8387 81 C 4.9491 8.8350 123.2530 58.7613 29.8966 172.5920 82 F 5.1520 9.2103 123.3300 55.8776 41.4127 174.8651 83 I 5.0597 8.8829 123.7251 59.4229 39.0030 175.7165 84 D 4.6381 9.2164 128.0125 53.9248 41.3051 177.7579 85 R 4.0548 8.4950 116.4288 58.5692 29.4048 177.0588 86 N 4.6422 8.2489 114.6058 52.9035 38.9383 175.6530 87 G 3.9472 8.2250 106.9662 44.9653 0.0000 173.7140 88 K 4.2871 7.7586 121.5155 56.1123 33.5784 175.1645 89 E 5.4505 8.8361 125.7871 54.8688 32.2917 174.9522 90 V 4.9593 8.9242 122.8499 61.2814 35.4701 173.9394 91 L 5.0864 9.1202 127.7172 53.5289 43.5298 175.4749 92 K 5.1526 9.0240 124.6098 55.2677 33.9910 175.8934 93 T 5.4218 9.1463 114.6970 60.4135 72.7077 172.7887 94 M 5.5195 9.2149 121.6509 53.5624 36.9603 174.2552 95 W 5.4761 8.5228 117.1026 54.7969 32.4620 173.7392 96 L 5.3082 8.8414 120.5941 52.9758 44.6676 175.1957 97 L 4.9366 9.4302 126.7088 53.4920 44.1581 174.8613 98 R 4.8562 9.1149 128.7026 55.2529 31.3246 175.7410 99 S 4.9133 8.7792 123.1484 56.8402 64.5993 173.8024 100 S 4.4067 8.4389 117.2899 57.9729 62.7464 173.8056 101 V 4.4063 8.1363 119.4224 59.1848 34.6073 175.5833 102 N 4.4474 8.4253 118.8077 56.3517 38.7262 174.8391 103 D 4.6631 7.7384 115.1919 51.0692 42.2250 175.7774 104 I 3.7908 8.3546 118.6054 63.9166 37.5468 177.5255 105 S 4.2566 8.2655 114.3150 60.6737 63.0744 174.9532 106 Y 4.5694 7.9702 119.1573 57.9196 37.9832 176.5537 107 D 4.3795 8.1287 121.6355 57.0931 41.0157 178.1002 108 W 4.3384 8.4075 115.6105 58.7806 28.0120 176.5699 109 K 3.7087 6.6252 115.2562 56.1619 32.0775 176.6953 110 A 4.2318 7.7344 122.3841 53.0203 19.2077 176.9912 111 T 5.0656 7.5716 112.2995 61.7467 71.2208 173.8188 112 R 4.8128 9.0680 126.2443 54.7426 32.7159 175.9330 113 V 4.4077 7.7128 119.9455 60.3656 34.7991 175.1955 114 G 3.2429 6.0181 106.9154 45.8182 0.0000 171.3239 115 Y 5.5305 8.1765 116.9231 55.6169 41.6177 174.7436 116 N 5.2112 9.4734 115.6522 52.4512 44.0141 173.2983 117 N 5.6796 9.4712 120.8166 51.7897 41.1129 173.8842 118 F 5.6707 9.6857 122.6576 56.0105 42.4840 174.5503 119 T 5.5030 9.1390 111.4950 59.7629 72.6800 173.5225 120 R 3.8075 8.4452 121.0146 55.6581 30.8232 176.9832 121 L 4.0070 8.4720 124.8419 57.6503 42.3409 177.0127 122 S 4.2455 7.6564 115.6711 58.2287 62.5311 173.1612 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 K 8.31 4.37 0.00 1.65 1.85 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.57 7.81 4 C 8.93 4.47 0.00 3.13 2.92 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 5 S 9.38 4.82 0.00 3.84 3.70 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 6 L 8.36 4.06 0.00 0.80 0.87 -0.57 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.18 3.94 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 1.17 0.00 0.00 8 G 8.05 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.17 5.01 0.00 1.74 1.51 0.00 1.61 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.40 7.81 10 W 9.45 5.55 0.00 3.23 3.20 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 11 T 9.28 5.38 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 1.21 0.00 0.00 12 N 8.70 6.03 0.00 2.22 1.42 0.00 0.00 6.64 6.29 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 13 N 8.68 4.34 0.00 2.90 3.07 0.00 0.00 5.95 7.79 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 14 L 8.08 4.20 0.00 1.79 1.74 0.94 0.80 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 15 G 8.24 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 16 S 7.93 4.52 0.00 3.94 3.88 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 17 I 8.49 5.22 1.83 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 1.28 0.66 0.89 0.00 0.00 18 M 9.04 5.08 0.00 1.50 2.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 19 T 8.85 5.01 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 1.18 0.00 0.00 20 I 8.74 4.72 1.95 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.63 0.53 0.00 0.00 21 R 8.50 4.52 0.00 1.69 1.90 0.00 3.17 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 22 A 8.59 4.01 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 23 V 7.63 4.33 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 0.92 0.00 0.00 0.86 0.00 0.00 24 N 8.74 4.81 0.00 3.00 2.99 0.00 0.00 6.33 7.21 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 25 S 8.48 4.24 0.00 4.01 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 26 R 8.09 4.06 0.00 1.99 2.01 0.00 3.36 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 27 G 8.39 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 0.00 0.00 0.00 0.00 28 E 8.49 4.76 0.00 2.03 1.79 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 2.26 2.23 0.00 29 F 8.48 5.21 0.00 3.02 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 30 T 8.32 5.01 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 1.22 0.00 0.00 31 G 7.54 3.95 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 0.00 0.00 0.00 32 T 8.00 5.23 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 1.23 0.00 0.00 33 Y 9.21 4.84 0.00 2.93 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 34 L 9.04 5.00 0.00 1.78 1.54 0.98 0.59 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 35 T 8.96 4.58 4.69 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 1.23 0.00 0.00 36 A 8.79 4.22 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 37 V 7.21 4.44 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 0.70 0.00 0.00 0.87 0.00 0.00 38 A 7.89 4.33 1.16 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 39 D 8.72 4.49 0.00 2.63 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 40 N 7.68 4.93 0.00 2.72 2.69 0.00 0.00 6.88 8.03 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 41 P 0.00 4.12 0.00 2.14 2.24 0.00 3.66 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 2.02 1.92 0.00 42 G 8.01 3.66 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 0.00 0.00 0.00 43 N 7.87 4.64 0.00 2.89 2.95 0.00 0.00 6.99 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 44 I 6.86 2.00 1.56 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.03 0.76 0.00 0.00 45 T 7.30 4.69 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 1.27 0.00 0.00 46 L 8.63 4.24 0.00 1.73 1.71 0.99 0.88 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 47 S 9.16 5.08 0.00 3.94 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 48 P 0.00 5.12 0.00 2.07 2.15 0.00 3.94 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 2.03 1.93 0.00 49 L 8.72 5.33 0.00 1.90 1.72 0.83 0.11 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 50 L 8.75 4.86 0.00 1.68 1.41 0.87 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.06 4.13 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 0.00 52 I 8.51 5.25 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 1.18 0.79 0.91 0.00 0.00 53 Q 9.40 5.44 0.00 2.24 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.96 0.00 0.00 0.00 0.00 0.00 2.55 2.41 0.00 54 H 8.99 4.63 0.00 3.19 3.33 0.00 5.82 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 55 K 8.55 4.42 0.00 1.76 1.87 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.52 7.81 56 R 8.02 4.07 0.00 1.83 2.01 0.00 3.23 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 57 A 7.84 4.19 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 58 S 8.79 4.32 0.00 4.05 4.16 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 59 Q 7.84 5.28 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.03 0.00 0.00 0.00 0.00 0.00 2.30 2.21 0.00 60 P 0.00 4.51 0.00 2.23 2.34 0.00 3.71 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.29 0.00 61 T 8.38 4.74 4.16 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 1.16 0.00 0.00 62 F 8.14 5.33 0.00 3.51 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 63 G 9.43 4.74 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 0.00 0.00 0.00 64 F 9.06 5.53 0.00 3.19 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 65 T 9.05 5.00 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 1.16 0.00 0.00 66 V 8.75 4.37 1.17 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 -0.65 0.00 0.00 0.76 0.00 0.00 67 H 8.32 4.31 0.00 3.12 3.10 0.00 6.01 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 W 7.42 4.25 0.00 2.64 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 0.00 0.00 0.00 0.00 69 N 9.36 4.77 0.00 2.92 3.01 0.00 0.00 6.82 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 70 F 7.44 5.00 0.00 3.17 3.14 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 71 S 7.19 4.53 0.00 3.81 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 72 E 8.46 4.27 0.00 1.93 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 2.25 2.24 0.00 73 S 7.62 4.83 0.00 3.74 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 74 T 8.88 5.01 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 1.16 0.00 0.00 75 T 8.49 5.16 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 0.71 0.00 0.00 76 V 8.59 4.90 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 0.72 0.00 0.00 0.90 0.00 0.00 77 F 8.83 5.30 0.00 1.53 2.64 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 78 T 8.89 4.73 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 1.15 0.00 0.00 79 G 6.69 4.51 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 0.00 0.00 0.00 0.00 80 Q 7.60 4.78 0.00 1.82 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.89 0.00 0.00 0.00 0.00 0.00 1.36 2.20 0.00 81 C 8.83 4.95 0.00 2.93 2.86 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 82 F 9.21 5.15 0.00 3.07 2.96 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 83 I 8.88 5.06 1.96 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 1.31 0.68 0.97 0.00 0.00 84 D 9.22 4.64 0.00 3.04 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 85 R 8.49 4.05 0.00 1.93 2.08 0.00 3.03 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 86 N 8.25 4.64 0.00 2.75 2.89 0.00 0.00 7.08 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 87 G 8.23 3.95 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 0.00 0.00 0.00 88 K 7.76 4.29 0.00 1.89 1.93 0.00 1.74 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.51 7.81 89 E 8.84 5.45 0.00 2.12 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 0.00 2.44 2.36 0.00 90 V 8.92 4.96 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 1.35 0.00 0.00 1.10 0.00 0.00 91 L 9.12 5.09 0.00 1.72 1.69 -0.78 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 92 K 9.02 5.15 0.00 2.01 1.94 0.00 1.97 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.77 1.80 7.81 93 T 9.15 5.42 4.74 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 1.64 0.00 0.00 94 M 9.21 5.52 0.00 1.83 1.91 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 2.55 2.50 0.00 95 W 8.52 5.48 0.00 2.68 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 0.00 0.00 0.00 96 L 8.84 5.31 0.00 1.60 1.60 0.90 0.38 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 97 L 9.43 4.94 0.00 1.65 1.80 0.86 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 98 R 9.11 4.86 0.00 1.94 1.92 0.00 3.35 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 99 S 8.78 4.91 0.00 3.69 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 0.00 100 S 8.44 4.41 0.00 3.85 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 0.00 101 V 8.14 4.41 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 0.69 0.00 0.00 1.00 0.00 0.00 102 N 8.43 4.45 0.00 2.59 2.88 0.00 0.00 6.73 8.06 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 0.00 103 D 7.74 4.66 0.00 2.93 2.83 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 0.00 104 I 8.35 3.79 1.90 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 1.73 1.36 0.93 0.00 0.00 105 S 8.27 4.26 0.00 3.94 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 0.00 106 Y 7.97 4.57 0.00 3.11 2.86 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 0.00 107 D 8.13 4.38 0.00 2.94 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 0.00 108 W 8.41 4.34 0.00 3.61 3.24 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 0.00 109 K 6.63 3.71 0.00 0.92 0.74 0.00 1.09 0.00 0.00 1.57 0.00 0.00 2.62 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.01 0.94 7.81 110 A 7.73 4.23 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 0.00 111 T 7.57 5.07 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 1.22 0.00 0.00 112 R 9.07 4.81 0.00 1.95 2.06 0.00 3.15 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 113 V 7.71 4.41 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 0.57 0.00 0.00 0.73 0.00 0.00 114 G 6.02 3.24 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 0.00 115 Y 8.18 5.53 0.00 3.07 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 N 9.47 5.21 0.00 3.23 2.54 0.00 0.00 7.28 6.32 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 0.00 117 N 9.47 5.68 0.00 2.80 2.89 0.00 0.00 6.59 7.46 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 0.00 118 F 9.69 5.67 0.00 2.76 3.11 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 0.00 119 T 9.14 5.50 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 1.38 0.00 0.00 120 R 8.45 3.81 0.00 1.53 1.58 0.00 2.88 0.00 0.00 2.65 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.74 0.00 121 L 8.47 4.01 0.00 1.51 1.58 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 122 S 7.66 4.25 0.00 3.75 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00