NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.2091 8.2544 117.2827 55.2355 30.7359 174.5398 5 L 3.5902 8.5350 121.4206 54.1714 41.8745 175.3842 6 D 4.7169 9.2794 128.4699 52.0145 39.9608 175.1222 7 L 4.4405 8.0014 121.8384 55.0233 41.9641 179.2534 8 S 4.1267 8.2459 115.3102 61.8355 62.9030 175.6054 9 T 3.9556 8.1417 116.3785 66.1552 68.2735 174.5730 10 L 4.1066 7.7254 120.4984 55.5188 42.0829 178.0937 11 T 4.2234 9.3926 114.7847 61.3835 70.9411 175.4661 12 D 4.3430 8.4928 121.0428 57.5292 40.6662 178.6580 13 E 4.0752 8.2283 117.7118 59.6161 29.6163 178.9570 14 E 4.1052 8.0465 117.2297 59.1862 29.6950 178.7540 15 A 4.0264 8.2062 120.8502 55.7108 18.1467 179.1041 16 E 4.0336 8.8561 117.5856 59.8603 29.5474 178.6984 17 H 4.2380 8.5684 118.3381 59.2681 30.0387 176.9508 18 V 3.4440 7.9296 119.5238 66.0219 31.1676 177.1770 19 W 4.7178 8.2224 127.2496 60.9394 30.4429 177.2599 20 A 3.7027 7.6585 119.8337 55.3393 17.7316 179.3881 21 V 3.4394 7.6365 115.8920 66.4254 31.5402 178.4700 22 V 3.6562 8.1715 117.9357 66.0094 31.3197 177.9321 23 Q 3.7514 8.1498 118.0294 59.0839 28.5349 178.8541 24 R 4.0787 7.8650 118.9239 59.5046 29.9833 178.6365 25 D 4.2269 7.9815 117.6312 57.2845 41.1204 178.3483 26 F 4.0318 8.2657 118.3472 60.5368 38.9299 177.1142 27 D 4.4128 8.6449 119.0098 57.4188 40.5679 178.6892 28 L 3.8781 7.9557 120.3785 58.3256 41.8848 179.0428 29 R 3.7826 7.7880 116.5888 59.3800 30.3149 178.4482 30 R 4.0191 8.2503 118.4167 59.7822 29.9874 178.2723 31 R 3.8916 8.0196 117.3679 59.6465 30.3543 178.7678 32 E 3.9480 8.4468 118.7059 59.1436 29.5257 178.5817 33 E 4.0573 8.1084 118.7912 58.9808 29.4771 178.8171 34 E 4.0418 8.0923 118.3321 58.8236 29.7852 178.9673 35 R 3.8649 8.1311 119.0274 59.5324 30.1345 178.6585 36 L 4.0434 7.8082 118.3194 57.8305 41.5082 179.1802 37 Q 4.0703 8.3875 118.2508 58.8368 28.6055 178.8507 38 G 3.9468 8.3811 106.6356 48.2627 0.0000 175.3927 39 L 4.0121 7.8163 121.3829 57.3830 41.5538 179.9208 40 K 4.1212 8.4625 118.5655 59.1205 31.8612 179.7386 41 G 3.6000 8.4307 106.9009 47.6747 0.0000 176.0918 42 K 4.0697 8.2977 121.2380 59.2462 32.0410 179.5972 43 I 3.8168 8.0432 120.2726 64.2090 36.8678 178.5967 44 Q 4.5300 7.8564 120.6232 58.2653 28.6310 178.0730 45 K 3.8728 7.9893 120.6002 59.8375 32.2007 178.4555 46 E 4.0202 8.3450 118.8034 59.5363 29.4285 179.7373 47 S 4.1877 8.2102 114.5361 61.4411 63.1383 176.7519 48 S 4.1794 8.5486 118.3415 60.7800 62.8434 176.2269 49 K 3.8915 8.1447 123.3462 59.5407 31.7604 178.8610 50 R 3.9428 7.8434 117.8630 59.2829 29.8106 178.5315 51 E 4.0384 7.8491 116.9366 58.1432 29.6972 178.2905 52 L 4.3190 7.5618 118.5641 57.4537 42.4187 178.3592 53 L 4.2506 7.8592 117.5322 56.1205 41.2842 179.1684 54 S 4.2023 7.7702 114.7692 60.6377 62.7108 174.6448 55 D 4.8524 7.5181 120.6644 54.3279 40.5941 177.2685 56 T 4.3346 7.5534 119.4405 61.2525 67.5709 171.8334 57 A 3.8147 7.9248 124.5179 52.5727 19.3022 177.0844 58 H 4.2459 9.2847 119.2831 56.1727 27.0642 176.9117 59 L 3.9741 7.6216 122.5356 58.2399 41.6141 177.7561 60 N 4.7008 8.0934 116.9542 55.8668 38.9495 176.1409 61 E 4.0402 7.9132 120.0375 58.7039 29.8441 177.6672 62 T 4.4649 7.8965 107.1097 61.4317 70.5881 173.4402 63 H 4.5927 7.6898 119.1359 53.0394 31.6759 172.8844 64 C 4.4322 8.2142 122.6146 58.9074 31.8085 174.7636 65 A 4.1223 8.7296 129.6470 54.4368 18.1718 178.0818 66 R 4.4802 7.8763 114.7463 58.0849 31.2724 176.8086 67 C 4.2803 7.8717 110.6866 57.7685 30.4413 174.8781 68 L 3.8111 7.9230 118.6225 55.2405 40.2768 174.8254 69 Q 4.1796 7.4830 117.8412 55.1533 29.5201 173.8037 70 P 4.5362 0.0000 0.0000 62.0730 32.6205 176.7095 71 Y 4.4112 7.9892 122.0426 61.4354 37.9152 179.3028 72 R 4.0876 8.1278 113.8759 58.6846 29.2893 177.1629 73 L 4.2432 7.6527 117.0113 55.6339 42.0893 176.8710 74 L 4.4298 7.8812 119.0209 54.1404 42.5289 176.5144 75 L 4.5718 8.3092 118.0275 54.6175 42.6649 176.2522 76 N 5.1945 7.6553 116.9574 51.0334 39.6919 172.9203 77 S 4.4143 8.0696 111.3296 57.3793 65.1929 173.9061 78 R 3.5150 7.6815 126.7870 53.0679 31.6906 174.9358 79 R 4.6851 8.5624 121.8128 54.8320 35.3028 173.8023 80 Q 4.4030 8.3547 120.2761 54.2909 31.4292 174.4324 81 C 4.6283 8.6695 124.7568 59.0381 32.2614 174.5321 82 L 4.1181 8.9632 126.5035 56.7570 41.0673 177.3842 83 E 4.2038 7.6593 119.2316 57.2245 30.2172 175.7562 84 C 4.4684 7.8749 110.9299 56.9988 30.3444 173.7558 85 S 4.7692 7.3711 112.3119 58.4531 62.2273 171.8525 86 L 4.7791 7.1030 118.6512 54.5789 44.6483 175.6680 87 F 5.3334 10.0297 119.0100 56.6952 41.5687 175.6931 88 V 5.0539 8.6508 113.7756 60.1800 36.9135 174.1600 89 C 4.6251 8.6926 117.4146 57.2641 31.0187 174.5665 90 K 3.9691 8.5052 120.1485 59.0204 31.6466 178.9237 91 S 4.1117 8.0576 112.7283 61.3084 62.9242 174.6344 92 C 5.5136 8.2176 115.8560 58.7764 29.3681 173.5513 93 S 5.2492 7.9457 114.5804 57.1276 66.0721 172.6738 94 H 5.3793 9.5991 116.3251 54.3283 33.4958 172.8382 95 A 4.7477 8.9241 124.8362 51.5643 17.3701 177.0464 96 H 4.6489 9.0633 118.3030 54.9143 30.2107 175.4353 97 P 4.0166 0.0000 0.0000 65.2616 31.3507 177.3451 98 E 4.4936 7.6656 118.2264 53.2602 30.6593 173.3866 99 E 5.5227 7.8594 129.3106 55.5346 32.1353 176.9918 100 Q 3.8839 8.5276 122.9384 57.6728 29.0885 176.5926 101 G 3.8526 7.0805 113.0374 45.8224 0.0000 169.0342 102 W 5.4433 7.8407 120.5450 55.8371 34.5435 173.5938 103 L 5.2229 9.9279 120.6313 53.2610 45.7954 176.2466 104 C 4.6939 8.7584 117.0258 57.8750 30.7876 174.2197 105 D 4.5043 9.7113 122.9381 57.4446 40.3771 178.2788 106 P 4.2984 0.0000 0.0000 65.8878 31.5475 178.1986 107 C 4.2013 8.2278 114.9857 63.1336 27.9155 175.8793 108 H 4.2064 8.5269 119.8470 59.3290 29.4924 177.3215 109 L 3.9208 7.7802 120.7254 57.7626 40.9299 179.0944 110 A 3.9546 8.4542 121.1226 55.3918 18.1723 179.5840 111 R 3.9618 7.6855 116.8117 59.1341 30.2301 178.6903 112 V 3.5753 7.7030 118.1565 65.9205 31.4589 178.2482 113 V 3.5806 8.0304 118.1719 65.9184 31.2008 178.0125 114 K 4.0293 7.5546 117.3346 59.3549 31.8687 178.5124 115 I 4.1906 7.9951 120.2141 64.0858 37.0880 178.4522 116 G 3.7884 8.7866 106.8124 47.6682 0.0000 175.5015 117 S 4.2807 8.0875 115.7734 59.5543 63.6958 174.6483 118 L 3.6397 7.9477 119.5670 55.2710 39.3014 176.1709 119 E 3.9940 8.6707 120.6215 59.4363 29.0926 177.0540 120 W 4.3994 8.5396 116.0243 60.2666 27.7472 177.2612 121 Y 3.4612 6.2111 119.5786 60.1485 38.3324 177.0028 122 Y 3.9796 7.5803 117.4482 60.6949 37.9140 178.6967 123 Q 4.1304 7.9990 119.0417 58.6968 28.7055 177.8641 124 H 4.3568 7.7818 116.3415 58.4789 28.7526 178.1431 125 V 3.4415 7.6691 120.3775 66.0680 31.2049 178.2030 126 R 4.0360 7.8382 116.3748 58.5242 29.9949 177.2182 127 A 4.4462 7.8465 118.3427 52.3226 19.3490 177.1852 128 R 4.2362 7.5263 116.0524 56.1198 31.9924 175.2500 129 F 4.8433 8.0007 114.3521 55.5291 43.0180 174.3575 130 K 4.3574 8.7102 119.9525 57.9724 33.3062 176.4645 131 R 4.5816 7.5365 114.0442 53.4034 32.5512 174.6857 132 F 4.7174 7.9282 114.1308 56.6048 40.4232 176.0400 133 G 3.8159 8.5935 103.2690 48.6492 0.0000 175.8213 134 S 4.2079 8.3052 118.3633 61.0345 63.2951 176.4765 135 A 4.1595 7.8159 122.8503 54.8065 17.9666 178.9015 136 K 3.6843 7.9826 117.1962 60.0014 32.2253 179.1852 137 V 3.6727 8.1643 117.9431 65.4994 31.0996 177.7205 138 I 3.8695 7.9458 118.3353 64.1666 38.1910 177.5903 139 R 4.0410 7.8865 118.5580 59.0856 29.8488 178.7305 140 S 4.1583 7.9241 113.2490 60.6511 62.1823 174.9291 141 L 4.3484 7.2726 120.6074 55.7919 42.2446 177.2552 142 C 4.3904 7.9256 115.8807 61.4323 28.2194 175.4568 143 G 4.0863 7.5310 110.7059 44.6968 0.0000 174.0125 144 R 4.1194 8.6027 125.5648 56.4082 31.4929 175.1996 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 4 R 8.25 4.21 0.00 1.94 2.01 0.00 3.02 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 5 L 8.54 3.59 0.00 1.71 1.69 0.94 0.90 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 6 D 9.28 4.72 0.00 2.81 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 7 L 8.00 4.44 0.00 1.76 1.73 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.25 4.13 0.00 3.97 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 9 T 8.14 3.96 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 1.22 0.00 0.00 10 L 7.73 4.11 0.00 1.85 1.67 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 11 T 9.39 4.22 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 1.27 0.00 0.00 12 D 8.49 4.34 0.00 2.72 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 13 E 8.23 4.08 0.00 1.93 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 2.34 2.49 0.00 14 E 8.05 4.11 0.00 2.24 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 2.35 2.35 0.00 15 A 8.21 4.03 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 16 E 8.86 4.03 0.00 2.14 2.23 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 2.41 2.46 0.00 17 H 8.57 4.24 0.00 3.30 3.57 0.00 5.86 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 18 V 7.93 3.44 2.31 0.00 0.00 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 0.98 0.00 0.00 19 W 8.22 4.72 0.00 3.37 3.25 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 20 A 7.66 3.70 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 21 V 7.64 3.44 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.82 0.00 0.00 22 V 8.17 3.66 2.56 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 1.48 0.00 0.00 1.09 0.00 0.00 23 Q 8.15 3.75 0.00 1.68 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.51 0.00 0.00 0.00 0.00 0.00 1.66 1.16 0.00 24 R 7.87 4.08 0.00 1.97 1.94 0.00 3.08 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 25 D 7.98 4.23 0.00 2.67 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.27 4.03 0.00 3.37 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 27 D 8.64 4.41 0.00 2.85 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 28 L 7.96 3.88 0.00 1.86 1.80 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.79 3.78 0.00 1.90 1.84 0.00 2.34 0.00 0.00 2.60 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.34 0.00 30 R 8.25 4.02 0.00 1.99 2.19 0.00 3.14 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 1.65 1.72 0.00 31 R 8.02 3.89 0.00 2.07 1.98 0.00 3.17 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 32 E 8.45 3.95 0.00 2.04 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 2.31 2.38 0.00 33 E 8.11 4.06 0.00 2.17 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 2.41 2.44 0.00 34 E 8.09 4.04 0.00 2.11 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 0.00 2.40 2.65 0.00 35 R 8.13 3.86 0.00 2.03 2.08 0.00 3.10 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 36 L 7.81 4.04 0.00 1.91 1.70 0.93 0.90 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 37 Q 8.39 4.07 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 38 G 8.38 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 39 L 7.82 4.01 0.00 1.89 1.74 0.93 0.83 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 40 K 8.46 4.12 0.00 1.96 1.87 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.67 7.81 41 G 8.43 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 0.00 0.00 0.00 42 K 8.30 4.07 0.00 1.96 1.89 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.70 7.81 43 I 8.04 3.82 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.91 0.93 0.00 0.00 44 Q 7.86 4.53 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 45 K 7.99 3.87 0.00 1.95 1.81 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.50 7.81 46 E 8.35 4.02 0.00 2.19 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 2.35 2.50 0.00 47 S 8.21 4.19 0.00 4.08 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 0.00 48 S 8.55 4.18 0.00 4.05 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 49 K 8.14 3.89 0.00 1.86 2.06 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.49 7.81 50 R 7.84 3.94 0.00 2.11 1.98 0.00 3.20 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 51 E 7.85 4.04 0.00 2.13 2.08 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 0.00 2.33 2.36 0.00 52 L 7.56 4.32 0.00 1.92 1.67 0.92 0.67 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 53 L 7.86 4.25 0.00 1.71 1.70 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 54 S 7.77 4.20 0.00 3.98 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 55 D 7.52 4.85 0.00 2.62 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 56 T 7.55 4.33 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 1.19 0.00 0.00 57 A 7.92 3.81 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 H 9.28 4.25 0.00 3.30 3.53 0.00 5.65 0.00 0.00 0.00 0.00 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.62 3.97 0.00 1.91 1.67 0.79 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.09 4.70 0.00 2.85 2.95 0.00 0.00 7.38 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 61 E 7.91 4.04 0.00 2.10 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 2.25 2.29 0.00 62 T 7.90 4.46 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 1.20 0.00 0.00 63 H 7.69 4.59 0.00 3.14 3.17 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 C 8.21 4.43 0.00 3.08 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 65 A 8.73 4.12 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 66 R 7.88 4.48 0.00 1.80 1.95 0.00 3.41 0.00 0.00 3.46 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.56 0.00 67 C 7.87 4.28 0.00 3.14 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 68 L 7.92 3.81 0.00 1.82 1.80 0.90 1.01 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 69 Q 7.48 4.18 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.02 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 70 P 0.00 4.54 0.00 2.09 1.77 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 71 Y 7.99 4.41 0.00 3.03 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 72 R 8.13 4.09 0.00 1.92 2.10 0.00 3.02 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 73 L 7.65 4.24 0.00 1.84 1.75 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.88 4.43 0.00 1.72 1.77 1.03 1.21 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 75 L 8.31 4.57 0.00 1.60 1.67 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 76 N 7.66 5.19 0.00 2.70 2.78 0.00 0.00 5.79 7.64 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 77 S 8.07 4.41 0.00 3.72 3.63 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.68 3.51 0.00 1.18 1.49 0.00 2.21 0.00 0.00 2.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.16 0.00 79 R 8.56 4.69 0.00 1.48 1.38 0.00 2.53 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.43 0.00 80 Q 8.35 4.40 0.00 1.76 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.12 0.00 0.00 0.00 0.00 0.00 1.16 1.44 0.00 81 C 8.67 4.63 0.00 2.99 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 82 L 8.96 4.12 0.00 1.74 1.73 1.02 1.13 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 83 E 7.66 4.20 0.00 1.87 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 2.23 2.34 0.00 84 C 7.87 4.47 0.00 3.14 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 85 S 7.37 4.77 0.00 4.19 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 86 L 7.10 4.78 0.00 1.68 1.84 0.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 87 F 10.03 5.33 0.00 3.08 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 88 V 8.65 5.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.92 0.00 0.00 89 C 8.69 4.63 0.00 3.13 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 K 8.51 3.97 0.00 1.61 1.75 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.20 7.81 91 S 8.06 4.11 0.00 3.88 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 92 C 8.22 5.51 0.00 2.91 2.93 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 93 S 7.95 5.25 0.00 3.83 3.84 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 94 H 9.60 5.38 0.00 3.04 3.14 0.00 5.61 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 95 A 8.92 4.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 H 9.06 4.65 0.00 3.33 3.45 0.00 5.50 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.02 0.00 2.11 2.12 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.18 0.00 98 E 7.67 4.49 0.00 1.85 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 2.19 2.22 0.00 99 E 7.86 5.52 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 100 Q 8.53 3.88 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.13 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 101 G 7.08 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 102 W 7.84 5.44 0.00 3.22 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 0.00 103 L 9.93 5.22 0.00 1.67 1.57 0.95 0.93 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 0.00 104 C 8.76 4.69 0.00 3.04 3.08 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 0.00 0.00 0.00 0.00 105 D 9.71 4.50 0.00 2.73 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 0.00 106 P 0.00 4.30 0.00 2.19 2.11 0.00 3.66 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 2.14 2.25 0.00 107 C 8.23 4.20 0.00 3.14 3.02 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 0.00 108 H 8.53 4.21 0.00 3.26 3.55 0.00 5.59 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 0.00 109 L 7.78 3.92 0.00 1.84 1.72 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 110 A 8.45 3.95 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 0.00 111 R 7.69 3.96 0.00 1.83 2.04 0.00 3.09 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 112 V 7.70 3.58 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 0.93 0.00 0.00 0.77 0.00 0.00 113 V 8.03 3.58 2.31 0.00 0.00 0.00 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 0.96 0.00 0.00 114 K 7.55 4.03 0.00 1.84 1.85 0.00 1.88 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.51 7.81 115 I 8.00 4.19 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.13 0.97 0.00 0.00 116 G 8.79 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 0.00 117 S 8.09 4.28 0.00 4.12 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 0.00 118 L 7.95 3.64 0.00 1.84 1.30 0.70 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.67 3.99 0.00 2.12 2.10 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 2.45 2.45 0.00 120 W 8.54 4.40 0.00 3.72 3.38 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 0.00 121 Y 6.21 3.46 0.00 1.43 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 0.00 0.00 0.00 122 Y 7.58 3.98 0.00 3.04 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 0.00 123 Q 8.00 4.13 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 124 H 7.78 4.36 0.00 3.41 3.33 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.67 3.44 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 0.96 0.00 0.00 -0.03 0.00 0.00 126 R 7.84 4.04 0.00 2.05 2.12 0.00 3.32 0.00 0.00 3.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 127 A 7.85 4.45 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 0.00 128 R 7.53 4.24 0.00 1.76 2.01 0.00 3.18 0.00 0.00 3.31 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.25 0.00 129 F 8.00 4.84 0.00 3.02 2.93 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 0.00 130 K 8.71 4.36 0.00 1.86 1.94 0.00 1.56 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.45 7.81 131 R 7.54 4.58 0.00 1.53 1.76 0.00 3.16 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.44 0.00 132 F 7.93 4.72 0.00 3.26 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 0.00 133 G 8.59 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 0.00 0.00 0.00 134 S 8.31 4.21 0.00 3.79 3.84 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 0.00 135 A 7.82 4.16 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 K 7.98 3.68 0.00 1.82 1.97 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.50 7.81 137 V 8.16 3.67 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 1.02 0.00 0.00 1.01 0.00 0.00 138 I 7.95 3.87 2.31 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.75 1.01 0.00 0.00 139 R 7.89 4.04 0.00 1.88 1.93 0.00 3.15 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 140 S 7.92 4.16 0.00 3.85 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.27 4.35 0.00 1.90 1.67 0.94 1.08 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 C 7.93 4.39 0.00 3.18 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 0.00 143 G 7.53 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 0.00 0.00 0.00 144 R 8.60 4.12 0.00 1.65 1.73 0.00 3.18 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00