NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2819 8.1749 110.9354 61.6168 70.1097 173.2183 3 M 4.1616 8.2579 122.7237 54.2846 33.1862 174.2921 4 Q 4.5824 9.0708 121.5162 54.4056 31.7392 174.7966 5 I 4.6720 8.0142 121.7049 59.4112 39.8452 175.3529 6 K 4.2934 8.3603 126.2912 55.9495 33.4054 175.8500 7 I 4.7411 8.1719 123.8290 58.8687 40.9459 174.0260 8 K 4.5407 8.8159 130.3040 54.8117 34.6389 174.3939 9 Y 4.9186 8.5822 124.5583 56.7226 39.0453 175.3164 10 L 4.0064 8.8743 125.9615 58.2331 42.7544 176.3022 11 D 4.5788 7.6813 115.7625 52.3404 41.6230 175.7252 12 E 4.0261 8.7215 117.0319 58.8974 29.6041 177.9830 13 T 4.1437 8.0373 108.7522 62.8167 69.4958 175.3218 14 Q 4.0954 7.6044 121.9637 55.9008 29.2363 176.0832 15 T 3.9621 8.2627 118.9569 63.1255 68.9520 174.8953 16 R 3.5117 8.2672 126.4221 56.1963 30.6078 176.4389 17 I 4.4762 8.8268 115.3112 60.6536 37.8760 175.5764 18 S 4.3851 8.0672 117.5088 58.7106 63.2029 173.4919 19 K 4.4272 8.0243 122.5858 55.7702 34.8772 174.8905 20 I 3.7801 8.2760 120.2454 61.5730 37.2247 175.5702 21 E 4.7813 8.6145 124.5867 54.8596 31.7367 175.9443 22 Q 4.5161 8.3331 121.6924 55.5927 29.8781 176.3527 23 G 3.9607 8.4911 106.3785 45.2531 0.0000 174.1997 24 D 4.6777 7.5493 118.6543 53.7364 41.5506 176.0774 25 W 4.3880 8.8455 121.2455 56.9768 30.3932 175.4591 26 I 4.4998 8.4480 123.1455 59.5148 39.0405 175.0504 27 D 5.1676 8.9046 127.2493 54.3965 41.6161 175.7086 28 L 5.0274 9.1884 122.5433 53.1079 45.5617 175.6272 29 R 5.2152 8.2958 118.3886 53.9492 34.5238 174.7955 30 A 4.5284 8.6879 124.2172 52.5208 18.9190 178.3733 31 A 4.3207 8.8513 123.8451 53.7369 19.4181 176.7228 32 E 4.6651 7.6783 111.1765 55.1244 32.5452 174.8391 33 D 4.6931 8.6292 120.2074 54.5911 41.8258 176.4203 34 V 4.3840 8.9462 122.3232 61.5177 34.7794 174.0070 35 T 4.9964 8.6052 124.4172 62.1922 70.3269 174.1762 36 I 4.5608 8.4493 126.2990 59.3635 40.8802 175.3743 37 K 4.5988 8.6530 126.3240 55.2905 33.6861 176.4551 38 K 3.8146 9.8160 124.1795 58.6319 32.3417 176.1739 39 D 4.6202 8.8909 123.6444 54.7755 39.0694 173.1377 40 E 4.7716 7.5492 118.1650 54.4403 33.1581 174.6119 41 F 5.4752 8.6271 122.5377 56.5840 42.3275 174.2672 42 K 4.3378 8.1890 123.6480 54.3629 36.8859 175.6747 43 L 4.3318 8.0639 123.6087 54.1856 42.1646 176.8328 44 V 4.0032 9.0090 126.8116 61.6455 32.6308 173.6565 45 P 4.9677 0.0000 0.0000 63.0770 32.1351 176.6134 46 L 4.9800 8.6386 120.6651 52.9580 43.5136 178.0626 47 G 3.9398 8.5211 107.2496 45.7057 0.0000 173.0723 48 V 4.8722 7.5569 112.3767 59.1473 35.9459 174.4669 49 A 4.8795 8.6325 125.4790 50.3050 22.1927 174.9344 50 M 4.9787 8.3573 119.3280 53.4904 36.5377 174.2314 51 E 4.6304 8.8061 123.9851 54.7832 30.5207 175.4203 52 L 4.3648 8.4399 126.9135 53.3975 43.0366 175.5987 53 P 4.3819 0.0000 0.0000 62.2146 31.9466 176.1460 54 E 4.3357 8.5034 119.5183 57.8479 30.2609 177.4389 55 G 3.9390 9.8118 110.0614 45.5680 0.0000 172.0888 56 Y 5.1877 7.8900 116.6024 55.8997 42.0498 174.2496 57 E 5.1894 9.2228 117.9610 54.7624 33.8563 174.1196 58 A 5.2811 8.7794 121.6720 50.5704 22.3566 175.1858 59 H 5.5277 9.1453 117.1757 53.9791 32.5084 173.2130 60 V 5.2383 8.9101 122.1353 61.4767 34.3320 174.7636 61 V 5.4296 9.0053 119.7416 57.5313 36.2522 173.3663 62 P 4.8374 0.0000 0.0000 62.6732 32.3079 176.9144 63 R 4.2261 8.3478 121.0875 55.6980 30.7590 178.3958 64 S 4.1448 8.6116 114.4894 61.0049 63.3031 175.2949 65 S 4.6980 7.9107 113.2956 58.3028 63.4937 175.7021 66 T 4.0896 8.0157 120.0267 67.3489 68.1290 175.7669 67 Y 3.9254 8.0742 120.9201 60.3481 38.6914 177.6130 68 K 3.7931 8.0243 118.9746 59.8324 32.4643 178.0934 69 N 4.1699 7.8847 114.9921 55.1636 38.4677 176.0259 70 F 4.6499 7.8425 115.9570 55.8028 41.4413 175.8446 71 G 3.4034 7.9673 108.4112 45.9285 0.0000 172.9812 72 V 5.2666 7.8624 111.3832 59.2170 34.4220 175.1331 73 I 4.8003 8.7625 116.4847 59.1928 41.0725 174.3383 74 Q 4.5463 8.6224 125.4496 55.1523 29.2727 176.5269 75 T 3.9192 8.7971 118.7619 64.2119 69.0039 174.8748 76 N 4.5982 8.0894 117.1609 52.1469 37.0163 174.1763 77 S 3.9883 7.6062 116.4007 58.7012 62.2101 169.7491 78 M 4.9215 7.6127 120.8515 53.7692 34.8674 175.1044 79 G 3.8314 9.3544 114.5716 45.9291 0.0000 172.2124 80 V 4.7991 8.1181 122.4349 60.8707 33.8869 174.7129 81 I 3.8853 8.4357 129.9576 59.3641 38.6426 175.0616 82 D 4.8259 8.3487 127.4263 53.4679 42.1240 176.4975 83 E 4.2040 8.1772 121.9854 59.6208 29.2948 178.7532 84 S 4.2692 8.6720 113.7364 60.4566 63.7009 174.5358 85 Y 4.5918 7.7636 124.2358 56.5558 36.4339 174.6357 86 K 4.9033 7.1160 115.3111 54.7037 34.6148 177.6661 87 G 3.7034 8.4732 109.6649 45.2031 0.0000 174.8057 88 D 4.1824 8.4807 118.9827 56.3097 41.2729 176.7785 89 N 4.9294 7.8102 114.1276 53.2018 39.6751 175.3601 90 D 4.2189 7.1499 119.9766 52.8834 39.2837 176.6628 91 F 4.6353 7.6024 118.2139 56.9934 40.5674 176.2621 92 W 4.7510 9.6437 125.6667 56.8791 30.2598 175.1413 93 F 5.5402 7.7488 116.1294 55.5252 41.4579 173.4314 94 F 4.9104 9.6266 122.2963 55.7591 41.5886 172.7277 95 P 4.7096 0.0000 0.0000 62.3520 32.2860 174.6304 96 A 5.1393 8.3881 127.6378 50.0886 21.8568 174.2054 97 Y 5.1055 9.0657 124.0130 55.7279 41.4737 174.2638 98 A 4.9620 8.2924 129.1744 51.4636 19.9362 177.4445 99 L 4.7779 9.1466 122.5484 55.1903 42.4754 176.8577 100 R 4.6773 7.6447 113.7603 54.3094 32.1710 174.2948 101 D 4.7287 8.4588 119.1820 55.3822 41.5342 175.6090 102 T 4.7482 8.8527 116.1213 60.9737 71.8252 171.6807 103 E 5.1711 8.6749 124.3291 54.5288 32.7900 174.1967 104 I 4.5116 8.9592 127.8146 59.6158 39.5923 174.9668 105 K 4.8390 9.3230 126.7409 54.5606 34.1076 176.3010 106 K 3.8842 8.7501 124.5497 58.6612 32.2921 177.0964 107 G 4.0068 9.0607 115.2471 45.1101 0.0000 173.3106 108 D 4.5703 8.0967 120.9379 54.1808 42.0642 176.0023 109 R 4.4849 8.6261 122.3687 56.4843 29.9933 176.0540 110 I 4.3154 8.4822 123.6464 61.1401 40.6368 174.0267 111 C 4.9514 7.5942 114.9547 57.8043 32.9450 172.3423 112 Q 5.4990 9.1984 115.6056 55.1084 31.9892 173.7805 113 F 6.3000 9.8812 115.1008 54.4231 41.9533 173.5210 114 R 4.4524 7.8432 115.6772 54.4733 33.2860 173.2981 115 I 5.0169 7.8728 111.9378 59.7868 40.4469 174.5796 116 M 4.8365 8.8384 121.5736 53.8153 35.9529 173.8421 117 K 3.2767 8.4603 126.8762 56.0529 32.8582 176.6116 118 K 4.3143 8.5333 127.0568 56.0693 32.8413 176.9134 119 M 4.1471 8.4001 119.1362 54.5039 31.7391 174.5552 120 P 4.3113 0.0000 0.0000 61.9674 32.1703 176.1686 121 A 4.0158 8.4419 122.4615 53.1065 18.5290 177.6852 122 V 4.5134 8.1339 114.9431 59.2851 35.5281 174.5675 123 E 4.5773 8.5887 122.4494 54.2675 31.5313 175.2030 124 L 4.3510 8.4566 126.4289 53.6420 42.7497 176.1317 125 V 4.2655 8.1043 122.8357 60.6044 33.3130 174.5270 126 E 4.1497 8.7408 128.7021 56.0558 30.2070 176.0284 127 V 4.5895 7.9465 117.8784 59.5318 35.2484 175.6418 128 E 4.1715 8.6560 120.7024 58.7649 29.8717 176.8873 129 H 4.8808 7.7473 113.5672 54.3708 32.9078 173.2520 130 L 4.3192 8.4670 121.0936 54.9866 41.7648 176.5520 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 2 T 8.17 4.28 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 1.19 0.00 0.00 3 M 8.26 4.16 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 4 Q 9.07 4.58 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 5 I 8.01 4.67 1.88 0.00 0.00 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 1.34 0.59 0.94 0.00 0.00 6 K 8.36 4.29 0.00 1.69 1.66 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.35 7.81 7 I 8.17 4.74 1.64 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.48 0.83 0.00 0.00 8 K 8.82 4.54 0.00 1.68 1.42 0.00 1.64 0.00 0.00 1.52 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.39 7.81 9 Y 8.58 4.92 0.00 2.94 2.88 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 10 L 8.87 4.01 0.00 1.41 1.60 0.05 1.12 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 11 D 7.68 4.58 0.00 2.88 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 12 E 8.72 4.03 0.00 2.07 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 0.00 2.26 2.23 0.00 13 T 8.04 4.14 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 1.19 0.00 0.00 14 Q 7.60 4.10 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.88 0.00 0.00 0.00 0.00 0.00 2.73 2.76 0.00 15 T 8.26 3.96 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 1.18 0.00 0.00 16 R 8.27 3.51 0.00 1.59 1.74 0.00 2.21 0.00 0.00 2.84 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.15 0.00 17 I 8.83 4.48 1.96 0.00 0.00 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 1.52 0.76 1.09 0.00 0.00 18 S 8.07 4.39 0.00 3.92 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 19 K 8.02 4.43 0.00 1.82 1.78 0.00 1.59 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.52 1.44 7.81 20 I 8.28 3.78 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.53 0.91 0.00 0.00 21 E 8.61 4.78 0.00 1.89 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 2.40 2.19 0.00 22 Q 8.33 4.52 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.56 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 23 G 8.49 3.96 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 0.00 24 D 7.55 4.68 0.00 2.71 2.68 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 25 W 8.85 4.39 0.00 3.15 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 26 I 8.45 4.50 1.16 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.68 0.98 0.00 0.00 27 D 8.90 5.17 0.00 2.62 2.66 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 28 L 9.19 5.03 0.00 1.67 1.63 1.13 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 29 R 8.30 5.22 0.00 1.78 1.77 0.00 3.24 0.00 0.00 3.38 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 30 A 8.69 4.53 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 A 8.85 4.32 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 32 E 7.68 4.67 0.00 1.92 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 2.17 2.31 0.00 33 D 8.63 4.69 0.00 2.58 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 34 V 8.95 4.38 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 0.89 0.00 0.00 0.97 0.00 0.00 35 T 8.61 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 1.21 0.00 0.00 36 I 8.45 4.56 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.73 0.83 0.00 0.00 37 K 8.65 4.60 0.00 1.69 1.70 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.52 1.42 7.81 38 K 9.82 3.81 0.00 1.64 1.76 0.00 1.95 0.00 0.00 1.73 0.00 0.00 3.18 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.65 7.81 39 D 8.89 4.62 0.00 2.85 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 40 E 7.55 4.77 0.00 1.87 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 2.45 2.33 0.00 41 F 8.63 5.48 0.00 3.09 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.19 4.34 0.00 1.52 1.45 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.25 1.31 7.81 43 L 8.06 4.33 0.00 1.30 1.31 0.31 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 44 V 9.01 4.00 2.18 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 0.98 0.00 0.00 1.05 0.00 0.00 45 P 0.00 4.97 0.00 2.19 2.22 0.00 3.73 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 46 L 8.64 4.98 0.00 1.89 1.80 1.20 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.52 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.56 4.87 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.43 0.00 0.00 49 A 8.63 4.88 0.51 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 50 M 8.36 4.98 0.00 1.82 1.80 0.00 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.12 0.00 51 E 8.81 4.63 0.00 2.01 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 52 L 8.44 4.36 0.00 1.66 1.68 1.02 1.31 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 53 P 0.00 4.38 0.00 1.83 1.79 0.00 3.54 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.11 0.00 54 E 8.50 4.34 0.00 2.12 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 2.32 2.37 0.00 55 G 9.81 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 7.89 5.19 0.00 3.10 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 57 E 9.22 5.19 0.00 2.06 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 2.17 0.00 58 A 8.78 5.28 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 59 H 9.15 5.53 0.00 2.97 3.30 0.00 5.58 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.91 5.24 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 1.27 0.00 0.00 0.96 0.00 0.00 61 V 9.01 5.43 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 1.28 0.00 0.00 0.65 0.00 0.00 62 P 0.00 4.84 0.00 2.05 2.18 0.00 3.78 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.60 0.00 63 R 8.35 4.23 0.00 1.85 1.87 0.00 3.28 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 64 S 8.61 4.14 0.00 3.97 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 65 S 7.91 4.70 0.00 4.14 4.12 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 0.00 0.00 0.00 0.00 66 T 8.02 4.09 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 1.33 0.00 0.00 67 Y 8.07 3.93 0.00 3.14 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 68 K 8.02 3.79 0.00 1.81 1.94 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.49 7.81 69 N 7.88 4.17 0.00 2.39 1.67 0.00 0.00 6.90 6.75 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 70 F 7.84 4.65 0.00 3.16 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 71 G 7.97 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.86 5.27 2.34 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 0.90 0.00 0.00 1.22 0.00 0.00 73 I 8.76 4.80 1.96 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.91 1.02 0.00 0.00 74 Q 8.62 4.55 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.93 0.00 0.00 0.00 0.00 0.00 2.45 1.75 0.00 75 T 8.80 3.92 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 1.43 0.00 0.00 76 N 8.09 4.60 0.00 2.84 2.96 0.00 0.00 6.10 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 7.61 3.99 0.00 4.07 3.98 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 78 M 7.61 4.92 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 79 G 9.35 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 80 V 8.12 4.80 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 0.80 0.00 0.00 0.86 0.00 0.00 81 I 8.44 3.89 1.23 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 -0.36 0.30 0.00 0.00 82 D 8.35 4.83 0.00 2.76 2.51 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 83 E 8.18 4.20 0.00 2.22 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 84 S 8.67 4.27 0.00 4.03 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 85 Y 7.76 4.59 0.00 2.78 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 7.12 4.90 0.00 1.80 1.97 0.00 1.21 0.00 0.00 0.61 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.32 7.81 87 G 8.47 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 0.00 0.00 0.00 88 D 8.48 4.18 0.00 2.57 2.68 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 89 N 7.81 4.93 0.00 2.72 2.88 0.00 0.00 6.92 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 90 D 7.15 4.22 0.00 2.15 1.54 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 0.00 91 F 7.60 4.64 0.00 3.22 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 92 W 9.64 4.75 0.00 3.21 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 93 F 7.75 5.54 0.00 3.17 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 94 F 9.63 4.91 0.00 3.12 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 95 P 0.00 4.71 0.00 2.38 2.47 0.00 3.43 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.23 0.00 96 A 8.39 5.14 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 9.07 5.11 0.00 3.24 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 98 A 8.29 4.96 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 99 L 9.15 4.78 0.00 1.82 1.92 1.09 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 100 R 7.64 4.68 0.00 1.88 1.88 0.00 3.01 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.64 0.00 101 D 8.46 4.73 0.00 2.58 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 T 8.85 4.75 4.42 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 1.36 0.00 0.00 103 E 8.67 5.17 0.00 1.98 1.80 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 2.22 2.34 0.00 104 I 8.96 4.51 1.73 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 0.38 0.49 0.52 0.00 0.00 105 K 9.32 4.84 0.00 2.07 1.73 0.00 1.72 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.45 7.81 106 K 8.75 3.88 0.00 1.69 1.75 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 107 G 9.06 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 0.00 108 D 8.10 4.57 0.00 2.56 2.58 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 0.00 109 R 8.63 4.48 0.00 1.74 1.91 0.00 3.18 0.00 0.00 3.41 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 110 I 8.48 4.32 1.51 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 -0.21 0.67 0.00 0.00 111 C 7.59 4.95 0.00 3.37 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 9.20 5.50 0.00 2.40 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 113 F 9.88 6.30 0.00 3.44 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.84 4.45 0.00 1.11 0.66 0.00 2.22 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.85 0.00 115 I 7.87 5.02 2.07 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.73 1.10 0.00 0.00 116 M 8.84 4.84 0.00 1.91 1.72 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 117 K 8.46 3.28 0.00 1.18 1.42 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.64 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.14 1.03 7.81 118 K 8.53 4.31 0.00 1.61 1.67 0.00 1.94 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.62 1.24 7.81 119 M 8.40 4.15 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 120 P 0.00 4.31 0.00 2.04 2.01 0.00 3.67 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 121 A 8.44 4.02 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 0.00 122 V 8.13 4.51 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 0.00 123 E 8.59 4.58 0.00 1.87 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 2.16 2.27 0.00 124 L 8.46 4.35 0.00 1.64 1.58 0.91 0.87 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 0.00 125 V 8.10 4.27 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 0.80 0.00 0.00 0.93 0.00 0.00 126 E 8.74 4.15 0.00 1.96 1.82 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 2.27 2.31 0.00 127 V 7.95 4.59 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 0.81 0.00 0.00 0.97 0.00 0.00 128 E 8.66 4.17 0.00 1.94 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 0.00 2.27 2.31 0.00 129 H 7.75 4.88 0.00 3.10 3.13 0.00 5.67 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 0.00 130 L 8.47 4.32 0.00 1.62 1.56 0.92 0.83 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