NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7663 8.3501 109.7345 44.3755 0.0000 174.2259 2 A 3.7998 8.0468 121.8083 50.0687 17.4886 174.9798 3 L 3.6952 7.9051 115.6790 55.9512 39.5346 172.9374 4 T 4.2285 7.7125 113.1674 60.7075 71.5155 175.0559 5 E 3.9613 8.6462 121.3929 59.2471 29.3501 178.9640 6 S 4.1130 7.9536 114.0620 61.5835 63.3227 176.2775 7 Q 3.9634 8.1470 121.7393 58.5503 28.4011 178.7699 8 A 4.0093 8.1837 121.4989 54.7482 18.3092 179.5095 9 A 4.0086 7.8579 119.3172 55.2054 18.3709 179.9207 10 L 4.0208 7.6741 117.7720 57.9513 41.6535 179.8030 11 V 3.6900 7.8887 118.3128 65.7375 31.3810 178.0712 12 K 4.3322 8.4092 119.5898 59.5718 32.2343 178.7286 13 S 4.1939 8.0429 113.8211 61.6067 62.4102 176.4084 14 S 4.3947 8.4850 116.8243 61.0939 62.8032 176.1767 15 W 4.5088 9.1087 132.7045 60.3279 30.1280 177.9337 16 E 3.5777 8.2657 118.1439 59.1275 28.6940 178.6280 17 E 4.0490 8.0513 118.2703 59.4224 29.5558 179.1176 18 F 3.9450 8.1151 120.5440 61.2792 39.1312 176.5192 19 N 4.0262 7.4978 114.6178 55.4551 38.7376 176.3019 20 A 3.9917 7.1556 121.1828 54.0586 19.6875 177.1972 21 N 4.6754 7.7981 116.1758 50.8172 39.6926 174.7889 22 I 3.2559 7.5300 124.8730 64.4789 37.5896 176.3262 23 P 4.1738 0.0000 0.0000 65.0859 31.0944 178.7463 24 K 3.9083 7.6106 118.0460 59.8949 32.3710 178.6072 25 H 4.2968 8.0024 117.0028 58.8690 28.3495 177.9430 26 T 4.2003 8.0600 111.9187 64.8787 68.7460 176.4362 27 H 4.3975 8.1577 121.4263 59.0292 29.8037 177.2571 28 R 3.9061 8.2272 120.7761 59.1103 29.8984 178.0850 29 F 4.2119 8.3903 120.5579 61.6752 39.4806 177.2516 30 F 3.7491 7.8561 117.1677 60.3343 38.5112 177.8468 31 I 3.6918 7.7680 119.6676 64.3250 36.7484 178.4820 32 L 3.9143 8.0643 120.1049 57.4012 41.3225 179.8131 33 V 3.3899 7.5049 118.3476 66.0545 31.3233 178.2510 34 L 4.3673 7.8015 116.9395 57.4700 41.4578 179.0083 35 E 4.1163 8.2159 118.5800 59.0015 29.4226 178.8946 36 I 4.1785 7.3739 118.9134 62.6792 38.6026 176.5675 37 A 4.5845 8.3333 124.5519 48.4340 19.7813 174.0863 38 P 4.2401 0.0000 0.0000 65.9955 31.1002 177.7935 39 A 4.0608 8.1637 118.3551 54.8532 18.3107 178.9877 40 A 4.0845 8.0643 119.0895 54.3774 18.4425 179.4282 41 K 3.9560 8.1512 118.8324 59.7945 32.0680 178.3952 42 D 4.4691 7.6189 116.5943 56.7351 40.7001 178.3356 43 L 4.0782 7.6355 119.1433 55.4562 41.7477 176.7857 44 F 4.3975 7.4982 118.5166 55.1767 38.5228 176.2967 45 S 4.0099 8.6099 121.8759 61.3234 62.4843 176.1335 46 F 4.1743 7.3837 112.4392 57.1371 38.3512 175.7833 47 L 4.3702 7.9492 122.0242 55.8713 42.6520 177.0790 48 K 4.0761 7.1295 118.8530 57.6609 32.1940 177.1033 49 G 4.0083 9.0014 112.8694 45.4798 0.0000 173.7230 50 T 4.2430 7.1280 108.8759 61.4118 69.8054 174.1963 51 S 4.4737 8.5544 115.8538 59.0180 63.6303 173.7259 52 E 4.6722 7.6816 116.8852 53.7761 32.2099 175.4905 53 V 3.7398 8.1896 120.4962 61.7373 31.6317 174.0424 54 P 4.3332 0.0000 0.0000 63.6640 31.3672 176.0783 55 Q 4.2935 8.5789 118.9554 56.9752 29.9511 175.7065 56 N 5.1395 7.8090 114.0288 52.2181 39.5971 174.5640 57 N 4.8012 7.8359 116.7865 51.4344 41.3166 172.2023 58 P 4.2963 0.0000 0.0000 65.5812 31.5792 178.4933 59 E 3.8451 8.0658 118.2344 59.2370 29.4043 178.5592 60 L 2.9643 7.3348 119.8451 58.1341 42.0266 179.1394 61 Q 4.0129 8.0673 117.6116 58.7631 28.4867 178.5621 62 A 4.0325 7.9348 121.5667 55.5654 18.2258 178.9462 63 H 4.1196 8.1054 113.2104 59.4706 29.2073 177.4538 64 A 4.3350 8.7979 122.4717 55.1589 18.4052 179.7360 65 G 3.9277 8.3993 104.3208 48.2531 0.0000 176.0471 66 K 4.1979 8.0852 120.9512 59.0452 31.8849 179.6192 67 V 3.6299 7.8361 118.5175 66.2344 31.4778 178.2435 68 F 4.0624 8.4250 116.9026 60.1605 38.6961 177.4814 69 K 4.0986 8.4411 119.4206 59.5217 31.9839 178.9137 70 L 3.9973 7.8975 119.3689 57.7193 41.5148 179.6603 71 V 3.6140 7.6555 118.4233 65.7461 31.3053 177.5381 72 Y 3.6167 8.0978 119.5255 60.6206 38.6893 177.9352 73 E 3.0849 7.8091 119.2066 58.8931 29.3892 179.1013 74 A 3.8019 7.5492 120.2999 55.0619 18.3783 179.5277 75 A 3.7087 7.2942 118.6847 55.2885 18.3603 179.9849 76 I 3.5584 7.0394 118.2717 64.1901 37.0641 178.4327 77 Q 3.8186 7.6297 120.1695 58.9868 28.8292 178.0904 78 L 3.9596 7.8481 120.2010 57.8264 41.4132 179.2410 79 E 3.9900 7.8273 118.0924 59.2018 29.6739 178.7465 80 V 3.7224 7.7073 117.3976 65.5090 31.7859 176.7022 81 T 4.2391 8.0973 106.5438 61.1107 70.0482 175.5787 82 G 3.9314 8.6691 110.1451 44.8850 0.0000 172.8306 83 V 4.3408 7.1408 110.6602 59.4770 35.4786 174.9113 84 V 3.9078 7.9499 120.3629 61.1143 31.2736 175.5150 85 V 3.5781 8.0898 128.3395 62.6804 31.1675 176.0215 86 T 4.0620 8.3960 125.6736 63.4002 68.0484 173.4041 87 D 4.9915 8.0850 128.6862 51.4630 42.4224 176.3713 88 A 4.0053 8.6245 119.1008 56.1219 18.1978 179.9592 89 T 3.8157 7.8452 113.5585 66.9883 68.4107 176.7438 90 L 4.0784 7.6026 119.1961 57.5538 41.9238 179.4738 91 K 4.1487 7.9897 118.3113 59.3540 32.0609 178.8828 92 N 4.3650 8.4395 117.4855 56.5467 38.8816 176.8284 93 L 4.1835 8.1608 120.7271 57.8435 41.5773 179.6556 94 G 3.7408 7.9611 105.1161 47.7704 0.0000 175.7271 95 S 4.1663 7.9511 115.1047 61.3010 62.6976 176.5520 96 V 3.6986 7.9406 121.8241 65.0367 31.1274 178.0376 97 H 4.1660 8.2001 116.8356 58.6612 28.4506 177.9151 98 V 3.6545 7.7008 120.1917 65.9638 31.1289 178.0577 99 S 4.1442 7.7904 114.0185 61.4925 62.7815 176.0384 100 K 4.3508 7.6631 117.4013 55.8057 31.8913 177.3860 101 G 3.8347 7.9291 107.2467 46.0889 0.0000 174.0868 102 V 3.6608 7.7982 119.1383 62.0377 32.2330 175.2612 103 A 4.9783 8.6691 128.3821 49.9934 22.2041 176.7862 104 D 4.7581 8.7039 118.3612 57.4555 40.9658 178.7064 105 A 4.3636 7.9623 119.7641 53.9408 19.1855 178.5554 106 H 4.4522 8.4217 114.1158 58.3935 28.6411 177.3564 107 F 4.1100 8.2967 119.5967 60.5611 38.8641 176.1693 108 P 4.3360 0.0000 0.0000 65.0628 31.1925 178.7453 109 V 3.5457 7.6533 117.5744 66.1156 31.4641 178.2925 110 V 3.6549 7.6887 117.4013 65.4521 31.3452 177.9465 111 K 2.7347 8.0385 119.8047 59.2083 31.9474 178.7607 112 E 3.8805 8.1377 118.6254 59.1609 29.3106 179.1875 113 A 3.9499 7.8246 120.6527 55.2901 18.3390 179.8102 114 I 3.8478 8.0139 118.5860 64.3584 37.1241 178.6767 115 L 3.9476 8.1862 120.3381 57.4805 41.5244 179.6428 116 K 3.9582 8.3257 118.8584 59.4370 31.9940 179.5338 117 T 3.8908 7.8675 116.0594 66.9403 68.4432 176.8596 118 I 3.7217 7.9396 121.8522 63.9706 37.0469 178.4875 119 K 3.9833 8.1703 120.8120 59.3806 31.7197 178.8419 120 E 3.9395 7.7573 118.0626 59.0998 29.4873 178.9904 121 V 3.6398 7.8891 117.7526 65.9174 31.4780 177.8867 122 V 4.3388 7.9311 112.2884 58.9369 32.3134 178.0511 123 G 3.8637 8.5854 107.0326 46.3663 0.0000 177.2491 124 A 4.2263 8.8852 127.9052 53.9592 18.1574 178.7184 125 K 4.3631 7.6323 113.3620 56.2144 32.4352 177.1042 126 W 4.2662 8.0872 130.7407 57.2422 31.3518 175.6621 127 S 4.5191 7.4008 118.8025 55.6343 67.1599 175.0047 128 E 3.4951 8.1583 121.3456 59.2276 29.1937 178.9591 129 E 3.9329 7.9437 120.2594 58.5785 29.5965 178.6483 130 L 3.9589 7.7245 120.2057 58.0922 42.2543 178.4009 131 N 4.5075 7.8153 117.3281 56.6763 38.3445 177.0423 132 S 4.1682 8.1801 115.5829 61.2713 63.1403 176.3563 133 A 3.9779 7.9400 124.4469 54.8545 18.1125 179.7713 134 W 4.1069 8.5275 117.3220 59.8508 29.0829 179.1598 135 T 4.0532 8.1208 115.9062 66.6197 67.9129 176.7002 136 I 3.6967 7.8363 121.4759 64.5455 37.1924 178.2366 137 A 3.8909 8.0693 121.3855 55.2872 18.0850 179.1367 138 Y 3.9340 8.4429 118.0927 60.8933 38.9255 177.6383 139 D 4.4590 8.3228 119.7638 57.6722 40.4958 178.7092 140 E 3.9192 8.2966 118.9330 59.4580 29.4652 179.3481 141 L 3.8843 8.0203 120.0851 57.8890 42.0302 178.8383 142 A 3.7603 8.1248 121.2813 54.6639 18.0992 179.5648 143 I 3.4652 7.5914 118.5831 64.4635 37.1264 178.7646 144 V 3.4989 7.1892 117.8150 66.1601 31.3307 178.2394 145 I 3.7101 7.6941 119.5243 64.2438 37.0098 178.6472 146 K 3.7287 7.9320 119.6188 58.8723 31.5908 179.3342 147 K 3.8397 7.5404 120.0847 59.7057 31.9941 178.8822 148 E 4.0250 7.9913 117.0654 59.3000 29.5450 178.9885 149 M 4.4352 8.3741 119.6286 58.4417 31.7217 178.4233 150 D 4.4011 8.0640 118.6394 57.1917 40.7163 178.2988 151 D 4.2369 7.7654 118.2973 56.1423 40.9760 177.4579 152 A 4.4078 7.8527 119.1845 52.2112 19.3653 176.8575 153 A 4.2404 7.3353 125.1502 52.0893 19.1257 177.0701 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 G 8.35 3.77 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 0.00 0.00 0.00 2 A 8.05 3.80 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.91 3.70 0.00 1.72 1.87 0.87 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.71 4.23 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 1.29 0.00 0.00 5 E 8.65 3.96 0.00 2.04 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 2.37 2.36 0.00 6 S 7.95 4.11 0.00 4.08 4.09 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 7 Q 8.15 3.96 0.00 2.32 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 8 A 8.18 4.01 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 9 A 7.86 4.01 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 10 L 7.67 4.02 0.00 1.90 1.78 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.89 3.69 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 0.57 0.00 0.00 0.59 0.00 0.00 12 K 8.41 4.33 0.00 2.10 1.94 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.78 1.79 7.81 13 S 8.04 4.19 0.00 4.02 4.07 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 14 S 8.49 4.39 0.00 4.43 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 15 W 9.11 4.51 0.00 3.68 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 16 E 8.27 3.58 0.00 2.22 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 0.00 2.41 2.68 0.00 17 E 8.05 4.05 0.00 2.31 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 2.53 0.00 18 F 8.12 3.95 0.00 2.92 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 19 N 7.50 4.03 0.00 1.74 2.30 0.00 0.00 7.23 8.11 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 20 A 7.16 3.99 1.23 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 0.00 0.00 0.00 21 N 7.80 4.68 0.00 2.45 2.02 0.00 0.00 6.98 7.06 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 22 I 7.53 3.26 1.71 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.56 0.84 0.00 0.00 23 P 0.00 4.17 0.00 2.07 2.19 0.00 3.42 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 24 K 7.61 3.91 0.00 1.64 1.59 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.46 7.81 25 H 8.00 4.30 0.00 2.15 2.95 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 26 T 8.06 4.20 4.43 0.00 0.00 0.00 0.00 0.00 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 27 H 8.16 4.40 0.00 3.34 3.46 0.00 5.78 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 28 R 8.23 3.91 0.00 2.15 2.20 0.00 3.22 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.73 0.00 29 F 8.39 4.21 0.00 3.51 3.43 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.86 3.75 0.00 3.09 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 31 I 7.77 3.69 2.01 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.84 0.88 0.00 0.00 32 L 8.06 3.91 0.00 1.72 1.63 0.98 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 33 V 7.50 3.39 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 1.07 0.00 0.00 0.09 0.00 0.00 34 L 7.80 4.37 0.00 1.64 1.72 1.03 0.84 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 35 E 8.22 4.12 0.00 2.04 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 2.32 2.55 0.00 36 I 7.37 4.18 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.55 0.89 0.00 0.00 37 A 8.33 4.58 1.23 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 0.00 0.00 0.00 38 P 0.00 4.24 0.00 2.17 2.14 0.00 3.62 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 39 A 8.16 4.06 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 40 A 8.06 4.08 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 41 K 8.15 3.96 0.00 1.97 1.84 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.49 7.81 42 D 7.62 4.47 0.00 2.67 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 43 L 7.64 4.08 0.00 1.00 1.05 0.60 0.68 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 44 F 7.50 4.40 0.00 2.49 1.45 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 0.00 0.00 0.00 0.00 45 S 8.61 4.01 0.00 4.02 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 46 F 7.38 4.17 0.00 3.02 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 47 L 7.95 4.37 0.00 1.84 1.67 0.57 0.73 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 48 K 7.13 4.08 0.00 1.98 1.73 0.00 1.66 0.00 0.00 1.81 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.53 7.81 49 G 9.00 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.13 4.24 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 1.26 0.00 0.00 51 S 8.55 4.47 0.00 3.84 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 52 E 7.68 4.67 0.00 1.97 1.85 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 2.21 2.26 0.00 53 V 8.19 3.74 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 0.83 0.00 0.00 0.92 0.00 0.00 54 P 0.00 4.33 0.00 2.21 2.07 0.00 3.82 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 55 Q 8.58 4.29 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.53 0.00 0.00 0.00 0.00 0.00 2.12 2.30 0.00 56 N 7.81 5.14 0.00 2.61 2.71 0.00 0.00 6.73 8.00 0.00 0.00 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 N 7.84 4.80 0.00 2.70 2.57 0.00 0.00 6.81 7.71 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 58 P 0.00 4.30 0.00 2.28 2.27 0.00 3.71 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 59 E 8.07 3.85 0.00 2.15 1.64 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 2.42 2.36 0.00 60 L 7.33 2.96 0.00 1.19 1.64 0.69 0.95 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 61 Q 8.07 4.01 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 62 A 7.93 4.03 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 63 H 8.11 4.12 0.00 3.26 3.60 0.00 5.67 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.80 4.33 1.51 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 65 G 8.40 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 66 K 8.09 4.20 0.00 2.05 1.97 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.69 7.81 67 V 7.84 3.63 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 0.85 0.00 0.00 1.06 0.00 0.00 68 F 8.42 4.06 0.00 2.84 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 69 K 8.44 4.10 0.00 2.35 1.97 0.00 1.80 0.00 0.00 1.89 0.00 0.00 3.05 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.44 1.79 7.81 70 L 7.90 4.00 0.00 1.88 1.69 0.97 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 71 V 7.66 3.61 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 1.27 0.00 0.00 0.97 0.00 0.00 72 Y 8.10 3.62 0.00 2.56 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 0.00 0.00 0.00 0.00 73 E 7.81 3.08 0.00 1.93 1.73 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 1.99 2.23 0.00 74 A 7.55 3.80 1.23 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 0.00 0.00 0.00 75 A 7.29 3.71 0.98 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 0.00 0.00 76 I 7.04 3.56 1.56 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.23 0.74 0.00 0.00 77 Q 7.63 3.82 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.46 2.29 0.00 78 L 7.85 3.96 0.00 1.81 1.62 0.86 0.66 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 79 E 7.83 3.99 0.00 1.89 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 2.40 2.57 0.00 80 V 7.71 3.72 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 0.86 0.00 0.00 0.92 0.00 0.00 81 T 8.10 4.24 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 1.15 0.00 0.00 82 G 8.67 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 83 V 7.14 4.34 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 0.66 0.00 0.00 0.88 0.00 0.00 84 V 7.95 3.91 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 0.69 0.00 0.00 0.83 0.00 0.00 85 V 8.09 3.58 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 0.81 0.00 0.00 0.90 0.00 0.00 86 T 8.40 4.06 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 1.24 0.00 0.00 87 D 8.09 4.99 0.00 2.79 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 88 A 8.62 4.01 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 89 T 7.85 3.82 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 1.23 0.00 0.00 90 L 7.60 4.08 0.00 1.55 1.71 0.93 1.29 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 91 K 7.99 4.15 0.00 2.00 1.85 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.62 1.73 7.81 92 N 8.44 4.36 0.00 2.85 2.84 0.00 0.00 7.22 6.34 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 93 L 8.16 4.18 0.00 2.05 1.84 0.98 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 94 G 7.96 3.74 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 95 S 7.95 4.17 0.00 3.92 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 96 V 7.94 3.70 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 0.81 0.00 0.00 0.92 0.00 0.00 97 H 8.20 4.17 0.00 3.41 3.49 0.00 5.81 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 98 V 7.70 3.65 2.26 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 1.12 0.00 0.00 1.05 0.00 0.00 99 S 7.79 4.14 0.00 4.04 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 0.00 100 K 7.66 4.35 0.00 1.73 1.67 0.00 1.71 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.58 1.54 7.81 101 G 7.93 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 0.00 0.00 0.00 102 V 7.80 3.66 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 0.74 0.00 0.00 0.83 0.00 0.00 103 A 8.67 4.98 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 0.00 104 D 8.70 4.76 0.00 2.82 2.78 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 0.00 105 A 7.96 4.36 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 0.00 106 H 8.42 4.45 0.00 3.43 3.20 0.00 5.84 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 0.00 107 F 8.30 4.11 0.00 3.41 3.42 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 0.00 108 P 0.00 4.34 0.00 2.19 2.15 0.00 3.91 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.23 0.00 109 V 7.65 3.55 2.25 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 0.98 0.00 0.00 0.98 0.00 0.00 110 V 7.69 3.65 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 1.31 0.00 0.00 0.97 0.00 0.00 111 K 8.04 2.73 0.00 1.21 1.73 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.24 1.00 7.81 112 E 8.14 3.88 0.00 2.04 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 2.48 2.45 0.00 113 A 7.82 3.95 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 0.00 114 I 8.01 3.85 1.70 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.74 0.63 0.00 0.00 115 L 8.19 3.95 0.00 1.65 1.75 0.97 1.01 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 0.00 116 K 8.33 3.96 0.00 1.84 1.81 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.58 7.81 117 T 7.87 3.89 4.66 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 1.30 0.00 0.00 118 I 7.94 3.72 1.50 0.00 0.00 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 1.04 -0.36 0.66 0.00 0.00 119 K 8.17 3.98 0.00 1.76 1.76 0.00 1.26 0.00 0.00 1.00 0.00 0.00 2.13 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.00 0.35 7.81 120 E 7.76 3.94 0.00 2.15 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 2.29 2.54 0.00 121 V 7.89 3.64 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 0.84 0.00 0.00 0.71 0.00 0.00 122 V 7.93 4.34 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 1.17 0.00 0.00 1.26 0.00 0.00 123 G 8.59 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 0.00 0.00 0.00 124 A 8.89 4.23 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 0.00 125 K 7.63 4.36 0.00 2.01 1.92 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.43 7.81 126 W 8.09 4.27 0.00 3.50 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 0.00 127 S 7.40 4.52 0.00 3.87 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 0.00 128 E 8.16 3.50 0.00 1.92 1.95 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 2.37 2.28 0.00 129 E 7.94 3.93 0.00 2.00 1.87 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 2.35 2.26 0.00 130 L 7.72 3.96 0.00 1.71 1.51 1.19 0.54 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 0.00 131 N 7.82 4.51 0.00 2.69 2.84 0.00 0.00 6.99 6.70 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 0.00 132 S 8.18 4.17 0.00 4.11 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 0.00 133 A 7.94 3.98 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 0.00 134 W 8.53 4.11 0.00 3.51 3.45 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 0.00 0.00 0.00 0.00 135 T 8.12 4.05 4.54 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 1.34 0.00 0.00 136 I 7.84 3.70 1.96 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 1.47 0.84 0.89 0.00 0.00 137 A 8.07 3.89 1.19 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 0.00 138 Y 8.44 3.93 0.00 3.16 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 0.00 139 D 8.32 4.46 0.00 3.02 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 0.00 140 E 8.30 3.92 0.00 1.90 1.93 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 2.54 2.42 0.00 141 L 8.02 3.88 0.00 1.70 1.57 0.83 0.78 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 0.00 142 A 8.12 3.76 0.96 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 0.00 0.00 143 I 7.59 3.47 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.13 0.84 0.00 0.00 144 V 7.19 3.50 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 0.97 0.00 0.00 0.92 0.00 0.00 145 I 7.69 3.71 1.81 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 1.53 0.63 1.01 0.00 0.00 146 K 7.93 3.73 0.00 1.57 1.59 0.00 0.61 0.00 0.00 0.97 0.00 0.00 2.65 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.20 0.21 7.81 147 K 7.54 3.84 0.00 1.82 1.88 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.43 7.81 148 E 7.99 4.02 0.00 2.09 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 2.57 2.61 0.00 149 M 8.37 4.44 0.00 2.10 2.29 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.83 0.00 150 D 8.06 4.40 0.00 2.92 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 0.00 151 D 7.77 4.24 0.00 2.64 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 0.00 152 A 7.85 4.41 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 0.00 153 A 7.34 4.24 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