NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 S 4.5782 8.2816 115.3648 57.8517 64.8260 172.3847 20 L 4.4625 8.3250 122.4820 53.3435 42.4416 174.3929 21 S 4.7799 9.6554 120.4013 57.1462 67.3083 172.2395 22 I 4.9876 8.1610 121.5121 59.8281 39.4272 175.5018 23 T 3.9116 8.7300 123.6853 64.5538 68.8234 173.2055 24 T 3.2603 8.8489 126.4129 63.2877 65.3222 170.1389 25 P 4.5966 0.0000 0.0000 63.3170 32.6542 175.3302 26 E 5.8510 7.6235 120.2997 55.8277 32.9744 173.9552 27 E 4.8837 8.8029 124.0905 55.1334 34.5805 173.6872 28 M 5.1867 8.6672 121.1974 53.8098 34.6473 175.5391 29 I 4.6119 8.7234 123.1401 59.6924 41.2579 174.2041 30 E 4.5630 8.8944 126.6757 54.8135 30.8735 175.4730 31 K 4.6760 8.2896 121.0535 54.9397 36.6317 175.0365 32 A 4.7246 9.0865 123.2045 49.8438 21.2153 176.6867 33 K 4.1893 8.3189 119.2170 58.1849 32.3675 178.0819 34 G 3.9495 8.8094 112.5969 45.2607 0.0000 173.2797 35 E 4.4586 7.7743 119.3806 56.2318 31.3739 175.3978 36 T 4.9649 8.3051 110.4563 60.0744 71.0266 173.6982 37 A 4.4249 8.5682 128.1047 50.5385 20.5167 175.6086 38 Y 4.6309 8.6045 124.9079 57.5946 39.5208 175.2128 39 L 4.2720 8.0962 129.0672 52.6308 42.5901 174.5408 40 P 4.4380 0.0000 0.0000 62.5223 32.6243 177.9236 41 C 4.8645 9.2759 123.4172 55.4771 45.9456 170.6615 42 K 5.1555 8.4984 125.2304 54.1777 33.8867 174.4142 43 F 5.5253 8.4144 122.3871 55.3917 40.9517 174.3754 44 T 4.6990 8.9986 117.2339 61.9605 71.1138 173.3656 45 L 4.9747 8.5204 124.5765 53.3738 44.1600 176.2676 46 S 4.7709 8.9297 118.1976 56.5392 64.6546 173.8361 47 P 4.3791 0.0000 0.0000 65.6995 31.2085 177.8074 48 E 4.1045 8.0778 115.9311 58.8216 29.9060 177.6068 49 D 4.8985 7.3843 120.4222 54.2626 38.3080 175.7492 50 Q 4.3308 7.9936 118.6269 55.7214 29.9335 176.3300 51 G 3.8964 8.0259 108.1711 43.9205 0.0000 171.5574 52 P 4.4141 0.0000 0.0000 62.0680 32.0290 175.7522 53 L 4.3725 8.3940 123.3372 55.1088 42.9878 175.4352 54 D 5.0150 9.2035 125.8222 52.8720 44.2942 173.9189 55 I 5.1970 9.1255 127.7317 59.5485 40.4360 174.7971 56 E 5.3119 9.0157 122.5555 54.6938 33.4425 173.9034 57 W 5.2317 9.3386 121.9410 55.1306 31.8470 175.0472 58 L 5.2395 9.3337 123.6481 52.8459 45.4935 175.1000 59 I 4.3120 8.3326 121.2445 59.3589 41.0278 174.6672 60 S 4.8093 8.7231 126.5568 55.8090 63.0121 171.2990 61 P 4.6791 0.0000 0.0000 62.2615 31.6944 177.0049 62 A 4.0945 8.6300 125.3453 55.3368 18.3978 178.6324 63 D 4.4176 7.9942 114.4238 57.3082 41.0210 176.9982 64 N 5.0300 7.6454 113.5118 51.3761 41.5413 174.7318 65 Q 4.2700 8.4286 116.1570 56.7108 29.0938 177.1589 66 K 4.1937 7.7718 117.9685 56.4452 32.7498 176.3786 67 V 4.3277 7.6657 120.2704 62.3485 35.1651 174.7311 68 D 4.2320 8.2442 123.6924 55.4726 38.5805 173.8279 69 Q 4.5720 8.2500 118.1968 53.9453 31.0987 177.6002 70 V 4.0701 8.5183 118.0061 62.3507 31.4973 176.0191 71 I 4.5236 8.5399 117.8701 62.0400 39.7680 175.7184 72 I 4.9478 7.4866 119.8456 60.0133 41.2961 173.2121 73 L 5.5956 9.6348 127.5051 53.2548 46.5195 174.9520 74 Y 5.3241 9.5963 123.1058 56.1177 41.2317 174.3627 75 S 4.7408 8.7888 120.4875 57.3321 67.0816 174.3448 76 G 3.6541 9.0886 108.1496 46.7978 0.0000 173.0525 77 D 4.3538 7.7940 114.2951 53.1542 38.5755 174.0783 78 K 4.3105 6.7124 116.6648 55.0554 35.6976 174.1370 79 I 4.9303 7.9951 126.6086 60.0097 38.6935 174.5431 80 Y 4.7561 9.1203 123.1145 56.4369 39.9144 175.7660 81 D 5.0528 8.6688 121.3424 52.9937 41.2798 175.3519 82 D 4.7111 7.6245 119.6659 54.7009 40.8321 175.3904 83 Y 4.5993 7.9799 117.5696 59.3778 40.3017 176.0950 84 Y 4.5915 7.9046 122.9019 55.0947 39.8899 173.8655 85 P 4.2600 0.0000 0.0000 65.8293 31.6192 178.7346 86 D 4.3788 7.6498 115.9592 56.7559 41.0735 177.1143 87 L 4.6234 7.8905 117.8594 54.0386 41.8349 175.6929 88 K 4.1225 7.8045 121.3809 58.1144 31.9655 177.2979 89 G 3.9968 9.0829 114.5487 45.6829 0.0000 173.1715 90 R 4.6751 8.0856 117.1711 54.8538 31.9935 175.4997 91 V 4.8194 7.8076 118.9233 60.3579 34.1650 174.1096 92 H 4.8006 7.8997 120.1418 54.4739 31.6383 172.8891 93 F 4.6881 8.7819 119.8360 57.8318 39.3963 175.9812 94 T 4.2257 8.7266 116.2543 64.0836 69.2601 175.6317 95 S 4.3328 8.0656 116.0691 57.9970 62.9177 173.2932 96 N 4.6975 8.6222 122.7288 53.8171 37.9093 175.4989 97 D 4.6399 7.7710 118.7200 52.9498 42.4143 174.8375 98 L 4.1251 8.3284 125.9612 56.5629 42.6052 179.0830 99 K 4.1586 7.8586 116.4094 59.3829 32.5034 177.7790 100 S 4.1733 7.4518 114.7883 59.1086 63.0613 173.7963 101 G 2.2661 6.8142 111.0671 44.6603 0.0000 173.1007 102 D 4.7113 7.8236 119.6633 52.3772 42.2654 174.5621 103 A 5.0311 9.1869 128.4018 51.8782 20.0450 176.9038 104 S 4.7695 8.8292 115.2368 60.2908 64.3871 173.4379 105 I 5.0208 8.1340 115.3404 59.1458 41.1199 173.3687 106 N 5.2543 8.3169 117.7269 51.1010 41.3191 173.6991 107 V 4.6389 8.1670 120.7369 61.4642 33.0831 175.2755 108 T 4.3935 8.9514 119.4296 60.4023 70.7373 173.7262 109 N 4.1831 8.4544 118.3696 54.4514 37.3221 174.1377 110 L 4.2935 7.9648 119.3210 55.2918 43.0166 177.0586 111 Q 4.9828 8.6142 117.9643 54.4629 32.2497 175.9064 112 L 4.1206 8.4374 117.0625 57.6019 41.7675 179.8696 113 S 4.5340 8.0221 112.0526 60.8545 63.0758 174.5862 114 D 4.7310 7.7098 118.9365 54.8065 41.1059 176.6606 115 I 4.0596 7.9293 122.2247 60.4834 37.8222 176.2849 116 G 4.0188 7.5734 111.4202 46.4343 0.0000 170.0566 117 T 4.9220 7.4869 116.6251 62.2525 70.6040 173.5298 118 Y 5.0871 9.4227 125.0415 56.3262 40.6252 174.5204 119 Q 4.9406 9.4393 125.3658 54.3608 32.3048 172.9796 120 C 3.9545 8.3835 126.8519 54.5391 46.6454 172.1487 121 K 4.7795 8.6736 126.5763 54.5529 34.5014 175.2359 122 V 4.3385 8.5778 126.0516 60.9072 33.6505 174.3719 123 K 4.9606 8.4694 127.2699 54.8235 35.3605 175.9305 124 K 4.9712 8.9073 124.6354 55.0940 33.9168 174.2549 125 A 4.2405 8.5545 127.9349 51.5294 19.2024 176.1802 126 P 4.3720 0.0000 0.0000 63.4416 32.1719 177.0961 127 G 3.7107 7.9449 109.8914 46.0623 0.0000 172.5427 128 V 4.9025 8.0180 122.1770 61.2851 34.8952 173.9415 129 A 4.8564 8.7907 127.5169 50.6493 22.8888 174.7580 130 N 5.3917 8.5704 116.9925 50.9329 40.8633 173.4859 131 K 4.7484 8.8014 121.9199 54.6312 35.7028 174.5918 132 K 4.9234 8.7413 126.2581 54.8357 34.6948 175.2843 133 I 4.9876 9.0708 125.3918 59.8797 40.6438 174.1360 134 H 5.1699 9.3906 125.4853 54.5065 30.2464 175.2652 135 L 4.7652 8.9147 125.3870 54.3502 42.0995 176.0512 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 19 S 8.28 4.58 0.00 3.89 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 20 L 8.33 4.46 0.00 1.94 1.60 0.83 0.49 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 21 S 9.66 4.78 0.00 3.87 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 22 I 8.16 4.99 1.87 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 1.41 0.65 1.03 0.00 0.00 23 T 8.73 3.91 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 1.23 0.00 0.00 24 T 8.85 3.26 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 1.26 0.00 0.00 25 P 0.00 4.60 0.00 2.18 2.26 0.00 3.45 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 26 E 7.62 5.85 0.00 2.04 1.83 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 2.30 2.37 0.00 27 E 8.80 4.88 0.00 1.94 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 2.32 2.36 0.00 28 M 8.67 5.19 0.00 1.88 1.98 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 2.54 2.61 0.00 29 I 8.72 4.61 1.85 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 1.24 1.29 0.89 0.00 0.00 30 E 8.89 4.56 0.00 1.95 1.88 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 2.25 2.32 0.00 31 K 8.29 4.68 0.00 1.65 1.64 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.32 1.33 7.81 32 A 9.09 4.72 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 33 K 8.32 4.19 0.00 1.76 1.78 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.45 7.81 34 G 8.81 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 35 E 7.77 4.46 0.00 2.06 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 0.00 2.32 2.25 0.00 36 T 8.31 4.96 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 1.20 0.00 0.00 37 A 8.57 4.42 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 8.60 4.63 0.00 2.85 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.10 4.27 0.00 0.85 1.35 0.08 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.44 0.00 1.92 1.88 0.00 3.62 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.91 0.00 41 C 9.28 4.86 0.00 3.24 3.28 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 42 K 8.50 5.16 0.00 1.94 1.65 0.00 1.61 0.00 0.00 1.99 0.00 0.00 3.04 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.57 7.81 43 F 8.41 5.53 0.00 3.04 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 44 T 9.00 4.70 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 1.22 0.00 0.00 45 L 8.52 4.97 0.00 1.57 1.63 1.06 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.93 4.77 0.00 4.10 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 47 P 0.00 4.38 0.00 2.18 2.19 0.00 3.78 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 48 E 8.08 4.10 0.00 2.10 2.13 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 2.28 2.33 0.00 49 D 7.38 4.90 0.00 2.83 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 50 Q 7.99 4.33 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.03 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 51 G 8.03 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 52 P 0.00 4.41 0.00 2.20 2.07 0.00 3.77 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 53 L 8.39 4.37 0.00 1.74 1.78 0.79 1.22 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 54 D 9.20 5.01 0.00 2.72 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 0.00 0.00 0.00 0.00 55 I 9.13 5.20 2.05 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.61 1.05 0.00 0.00 56 E 9.02 5.31 0.00 2.01 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 2.12 2.22 0.00 57 W 9.34 5.23 0.00 3.26 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 58 L 9.33 5.24 0.00 1.45 1.44 0.86 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.33 4.31 1.18 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.17 0.05 0.00 0.00 60 S 8.72 4.81 0.00 3.67 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 61 P 0.00 4.68 0.00 2.11 2.06 0.00 3.92 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 2.02 2.08 0.00 62 A 8.63 4.09 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 63 D 7.99 4.42 0.00 2.70 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 64 N 7.65 5.03 0.00 2.69 2.75 0.00 0.00 6.93 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 8.43 4.27 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 66 K 7.77 4.19 0.00 1.80 1.79 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.45 7.81 67 V 7.67 4.33 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 0.81 0.00 0.00 0.92 0.00 0.00 68 D 8.24 4.23 0.00 2.80 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 69 Q 8.25 4.57 0.00 1.87 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.51 6.93 0.00 0.00 0.00 0.00 0.00 2.33 2.63 0.00 70 V 8.52 4.07 1.71 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 0.54 0.00 0.00 0.62 0.00 0.00 71 I 8.54 4.52 1.89 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.66 0.65 0.00 0.00 72 I 7.49 4.95 1.87 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.65 0.00 0.00 73 L 9.63 5.60 0.00 2.03 1.79 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 9.60 5.32 0.00 2.74 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 75 S 8.79 4.74 0.00 3.93 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 76 G 9.09 3.65 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 0.00 0.00 0.00 77 D 7.79 4.35 0.00 2.79 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 6.71 4.31 0.00 1.62 1.52 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.62 1.15 7.81 79 I 8.00 4.93 1.95 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.91 1.24 0.00 0.00 80 Y 9.12 4.76 0.00 3.31 2.89 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 81 D 8.67 5.05 0.00 2.78 2.80 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 82 D 7.62 4.71 0.00 2.55 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.98 4.60 0.00 3.14 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 84 Y 7.90 4.59 0.00 3.27 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 85 P 0.00 4.26 0.00 2.03 2.01 0.00 3.09 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 1.95 2.04 0.00 86 D 7.65 4.38 0.00 2.76 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 87 L 7.89 4.62 0.00 1.90 1.76 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 88 K 7.80 4.12 0.00 1.86 1.79 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.41 7.81 89 G 9.08 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 90 R 8.09 4.68 0.00 1.88 2.10 0.00 3.28 0.00 0.00 3.21 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 91 V 7.81 4.82 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 0.68 0.00 0.00 0.91 0.00 0.00 92 H 7.90 4.80 0.00 3.29 3.33 0.00 5.70 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 F 8.78 4.69 0.00 3.17 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 94 T 8.73 4.23 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 1.40 0.00 0.00 95 S 8.07 4.33 0.00 4.05 3.82 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 96 N 8.62 4.70 0.00 2.88 2.93 0.00 0.00 5.80 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 97 D 7.77 4.64 0.00 2.66 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.33 4.13 0.00 1.38 1.04 -0.37 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.86 4.16 0.00 1.95 2.02 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.66 7.81 100 S 7.45 4.17 0.00 3.92 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 0.00 101 G 6.81 2.27 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 0.00 102 D 7.82 4.71 0.00 2.64 2.49 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 0.00 103 A 9.19 5.03 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 0.00 104 S 8.83 4.77 0.00 3.98 3.60 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 0.00 105 I 8.13 5.02 1.31 0.00 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.04 0.00 0.00 0.00 106 N 8.32 5.25 0.00 2.71 2.96 0.00 0.00 6.89 8.99 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 0.00 107 V 8.17 4.64 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 0.99 0.00 0.00 0.55 0.00 0.00 108 T 8.95 4.39 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 109 N 8.45 4.18 0.00 2.79 2.84 0.00 0.00 7.03 7.78 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 0.00 110 L 7.96 4.29 0.00 1.74 1.58 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 111 Q 8.61 4.98 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 112 L 8.44 4.12 0.00 1.75 1.78 0.93 0.61 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 0.00 113 S 8.02 4.53 0.00 4.10 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 0.00 114 D 7.71 4.73 0.00 2.93 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 I 7.93 4.06 1.99 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 1.28 0.72 1.02 0.00 0.00 116 G 7.57 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 0.00 0.00 0.00 117 T 7.49 4.92 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 1.09 0.00 0.00 118 Y 9.42 5.09 0.00 2.92 3.17 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 0.00 119 Q 9.44 4.94 0.00 2.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 2.07 2.31 0.00 120 C 8.38 3.95 0.00 1.23 2.20 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 0.00 121 K 8.67 4.78 0.00 1.54 1.56 0.00 1.70 0.00 0.00 1.49 0.00 0.00 2.70 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.23 1.19 7.81 122 V 8.58 4.34 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 -0.01 0.00 0.00 0.54 0.00 0.00 123 K 8.47 4.96 0.00 1.81 1.60 0.00 1.70 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.26 7.81 124 K 8.91 4.97 0.00 1.67 1.66 0.00 1.88 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.50 7.81 125 A 8.55 4.24 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 0.00 126 P 0.00 4.37 0.00 2.18 2.17 0.00 3.89 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 127 G 7.94 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 0.00 0.00 0.00 128 V 8.02 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 0.75 0.00 0.00 0.95 0.00 0.00 129 A 8.79 4.86 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 0.00 130 N 8.57 5.39 0.00 2.63 2.64 0.00 0.00 5.80 7.13 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 0.00 131 K 8.80 4.75 0.00 1.72 1.47 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.49 7.81 132 K 8.74 4.92 0.00 1.74 1.59 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.36 7.81 133 I 9.07 4.99 2.04 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.83 0.93 0.00 0.00 134 H 9.39 5.17 0.00 3.16 3.30 0.00 5.79 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.91 4.77 0.00 1.74 1.69 0.81 0.99 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