NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4602 8.1693 120.6426 54.9223 43.1176 175.7508 8 H 4.8861 8.7757 118.0638 53.0617 31.0627 171.8790 9 K 4.6153 9.1879 122.0004 55.9121 34.1574 177.2670 10 E 4.9829 8.9822 123.3713 53.7269 33.4862 173.8167 11 P 4.9991 0.0000 0.0000 63.2021 32.5645 174.7849 12 A 4.9284 8.4242 121.7512 51.4390 23.0887 175.5150 13 T 4.6692 8.5057 114.5877 61.4003 72.4501 173.9131 14 L 4.2851 8.6742 127.7889 55.8066 42.4109 175.4538 15 I 4.3788 8.3708 125.9966 62.1568 39.0996 176.0274 16 K 4.4776 7.5684 120.0435 55.3887 35.5566 173.8692 17 A 4.5463 8.7289 130.8221 52.0187 19.4552 176.8088 18 I 4.2037 8.3405 124.1450 62.9759 38.4920 175.2435 19 D 4.6178 6.8639 116.7258 53.5855 41.1638 175.2633 20 G 3.8241 8.9851 106.9947 48.8752 0.0000 173.7483 21 D 5.0256 8.2644 117.0432 52.8191 41.4403 175.4029 22 T 5.2191 7.9317 114.1749 62.6107 72.5355 173.4359 23 V 4.8367 8.8121 118.4776 59.5510 36.7867 174.0321 24 K 4.9705 9.2522 125.9523 55.2009 33.8532 175.2762 25 L 5.3418 9.3886 126.6828 53.0729 46.7315 175.3032 26 M 4.9378 9.1513 122.0215 55.0848 33.4701 174.3381 27 Y 4.9594 8.9126 127.8362 56.0209 41.9113 175.6463 28 K 3.4326 9.3053 127.7836 57.4626 29.6258 175.8135 29 G 4.0041 8.1781 104.2149 45.4540 0.0000 172.7637 30 Q 4.8383 7.7754 118.2999 53.1497 32.5840 173.3561 31 P 4.9713 0.0000 0.0000 63.0649 32.4476 175.6102 32 M 4.8390 9.4517 122.8457 54.4333 36.4060 173.6018 33 T 4.8600 8.5055 122.0940 62.9782 70.4727 173.4861 34 F 5.1101 9.7749 125.3438 55.6050 42.2356 174.2359 35 R 5.0550 8.9134 123.6514 54.4413 32.0787 175.1857 36 L 4.3595 8.7845 127.5616 54.4642 42.4730 177.1424 37 L 3.9546 8.4490 124.4076 55.8403 42.6594 178.2617 38 L 4.0307 9.0413 120.9977 54.9416 39.3699 174.0679 39 V 5.0047 7.2880 109.5436 59.5474 35.7042 174.7345 40 D 4.9784 9.0053 123.5140 52.8204 43.3672 175.5156 41 T 4.7501 8.2393 114.2875 59.1084 70.8758 173.1900 42 P 4.4248 0.0000 0.0000 62.6267 32.2301 175.4318 43 E 4.3703 10.4926 123.2909 55.8448 30.3463 177.3957 44 T 4.2259 8.0454 115.2469 62.1049 70.2228 174.6268 45 K 4.6208 7.4993 121.6182 56.6699 34.5842 170.3481 46 H 4.1064 8.9328 126.5797 55.3995 29.8714 174.5614 47 P 4.2221 0.0000 0.0000 65.6302 31.3030 177.7072 48 K 4.2267 7.7028 118.1714 56.4878 31.3342 175.7151 49 K 4.2971 9.6429 124.5520 54.8018 28.2585 175.8481 50 G 3.9855 5.3800 113.2010 45.1472 0.0000 177.8217 51 V 4.2390 8.2994 131.2949 61.1905 31.2999 174.0345 52 E 4.3506 9.0570 128.4612 55.0946 31.2271 176.3149 53 K 4.0055 8.2816 122.9033 58.2206 32.5320 176.8001 54 Y 4.4727 8.1021 122.7837 59.4730 36.2422 171.3865 55 G 3.6204 8.1158 107.4612 47.3456 0.0000 174.0412 56 P 4.2798 0.0000 0.0000 65.0982 31.3808 178.6141 57 E 3.9870 8.1632 116.5832 59.4596 29.5566 179.0302 58 A 4.0159 8.7362 121.1983 55.3133 17.9275 179.9335 59 S 4.1779 8.5376 113.8496 61.7407 62.8541 176.7995 60 A 4.1185 8.4573 123.8665 54.7809 18.0828 179.5220 61 F 3.9904 8.5128 119.5226 61.8165 39.5484 177.5056 62 T 3.9163 8.1834 115.4174 66.3948 68.1591 176.3945 63 K 3.8487 8.0642 121.5041 59.6612 32.2307 178.9954 64 K 3.9370 8.3084 118.9414 59.7043 31.7112 179.3161 65 M 3.9353 7.5401 117.9959 58.2702 31.9566 178.5003 66 L 4.1424 7.8189 119.0624 57.6252 41.6995 179.0959 67 E 4.1001 8.4475 117.5150 58.1246 29.4785 177.8818 68 N 4.7664 7.5342 114.0803 51.9540 39.3583 174.6166 69 A 4.5914 6.9468 124.0070 51.4755 19.7765 178.6445 70 K 4.1623 8.9152 121.0231 58.7936 32.6430 178.1310 71 K 4.7090 8.5279 117.5072 54.5151 36.0479 175.3838 72 I 5.0437 8.3886 124.4462 59.6410 40.2133 174.3932 73 E 5.1665 9.1973 124.5186 54.6898 34.0434 174.9807 74 V 4.7205 8.9548 115.4923 59.4755 35.3363 174.5412 75 E 5.0244 8.9778 124.6725 54.4446 32.1512 175.1705 76 F 4.6815 8.9745 125.7191 57.6378 40.1859 175.6001 77 D 5.0385 8.4281 120.3929 53.4490 43.2210 175.8220 78 K 4.3095 9.3336 117.5765 57.8839 32.9479 177.7212 79 G 4.1940 8.4361 110.5039 44.2643 0.0000 173.4763 80 Q 4.1076 8.5864 119.0956 56.7656 29.2163 176.3664 81 R 4.7870 8.4418 117.3386 56.4764 31.6471 175.5712 82 T 5.1987 7.6604 108.4536 60.1002 72.4403 173.4649 83 D 4.9634 8.4571 123.1848 51.8696 42.3085 176.7547 84 K 3.9629 8.5915 116.2292 59.1919 32.7489 176.8993 85 Y 4.3177 8.0356 116.0768 57.7409 38.1870 176.2367 86 G 3.9164 8.2113 108.3865 45.3313 0.0000 173.8959 87 R 4.2851 8.3394 119.7298 55.1772 31.5462 176.4817 88 G 3.5658 8.3102 111.0245 46.4519 0.0000 172.3301 89 L 5.3299 8.7730 124.4775 53.1945 43.0808 175.6589 90 A 4.4783 8.3017 124.7447 50.8546 23.4260 174.1032 91 Y 4.8132 8.6896 117.5751 57.1112 39.8061 175.0826 92 I 4.8551 8.6524 124.0787 59.6308 40.7242 174.0563 93 Y 5.1295 9.1373 123.5539 56.0501 41.2811 174.3916 94 A 4.9504 9.0130 125.7445 50.5012 21.6010 176.3166 95 D 4.3695 9.7564 124.7261 55.5738 39.1353 175.2997 96 G 3.9788 8.4340 104.8677 45.3892 0.0000 173.6015 97 K 4.5344 8.1495 120.6593 54.6396 33.8238 175.3224 98 M 3.9219 8.4960 123.3309 55.1260 33.0383 177.0230 99 I 3.7443 8.5145 129.0616 64.3818 36.7709 178.1926 100 N 4.3276 7.9871 117.1091 56.2858 38.3929 176.8626 101 E 3.8708 8.0220 119.9465 59.0809 29.7208 178.2661 102 A 4.0534 8.2225 121.0518 55.3709 18.3668 179.6162 103 L 3.4552 8.0757 117.2834 57.7709 41.6574 180.0201 104 V 3.7303 7.4382 117.4429 66.0049 31.3054 178.0876 105 R 3.9250 8.4373 117.5805 59.0167 29.9407 177.4930 106 Q 4.3195 7.5859 115.4846 55.0530 29.0908 176.1296 107 G 3.8645 8.0530 108.7394 46.5094 0.0000 174.6542 108 L 4.5604 7.8345 116.7459 53.8458 42.3247 176.1344 109 A 4.6066 7.4626 118.7593 50.8129 22.0590 175.9125 110 K 4.7570 8.5901 121.5667 54.5551 34.7485 175.9363 111 V 4.1709 9.4224 126.7221 63.0090 32.0170 175.8986 112 A 4.1905 9.0451 130.6875 51.0533 19.7594 176.5671 113 Y 4.2622 7.4609 117.0036 58.2287 38.3884 176.1317 114 V 4.1641 8.1197 124.0146 61.5241 33.0855 174.8932 115 Y 4.6116 8.2628 123.8329 55.6075 39.0487 175.1582 116 K 4.3752 8.6074 124.2529 56.3503 32.7080 175.0527 117 P 4.8071 0.0000 0.0000 63.2200 31.7868 177.0656 118 N 4.8428 8.2848 119.0843 52.3713 36.9215 175.3295 119 N 5.1227 7.8385 113.4601 53.4435 39.0686 177.5673 120 T 3.8441 8.6292 118.2146 67.4950 68.7105 175.0405 121 H 4.8757 7.9187 116.8527 55.7338 29.2358 176.6122 122 E 3.9884 8.2787 123.1498 59.6862 29.2217 178.8560 123 Q 3.9678 8.0377 117.2580 59.2655 28.9077 177.8664 124 H 4.1874 8.3087 118.6697 59.6050 29.7687 177.0448 125 L 3.9535 8.0124 120.5196 57.8187 41.4142 179.7561 126 R 3.9430 8.2057 118.2535 58.8996 30.0654 179.2243 127 K 3.9433 8.3635 118.7793 59.7452 32.1069 179.6347 128 S 4.1744 8.0601 115.3144 61.3585 62.6316 176.3911 129 E 3.9718 8.4924 122.2705 59.0795 29.2766 178.6991 130 A 3.7512 7.9817 121.0210 54.8773 18.2881 179.4184 131 Q 3.7901 7.9479 117.5271 59.3519 29.2415 178.3689 132 A 3.9966 8.0814 121.7747 54.9556 18.3716 179.8149 133 K 3.2825 7.7117 117.0933 59.3766 31.8091 179.6332 134 K 3.9028 7.8386 117.6422 59.2612 32.0680 178.3635 135 E 4.2422 8.2155 115.9388 55.3354 30.2592 176.2730 136 K 4.0899 7.7654 117.8385 57.2395 30.5822 175.3735 137 L 4.3290 7.9740 117.9090 55.2821 44.5041 177.8519 138 N 3.7414 9.3779 120.8421 54.0886 37.4727 176.6640 139 I 3.1897 5.4200 121.7635 63.6818 38.2962 177.5657 140 W 4.7752 7.5293 119.9210 56.7630 28.8991 176.4102 141 S 4.4408 8.0047 119.8463 58.4889 62.6909 173.9249 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 7 L 8.17 4.46 0.00 1.87 1.82 1.10 0.86 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 8 H 8.78 4.89 0.00 3.35 3.28 0.00 5.52 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 9 K 9.19 4.62 0.00 1.58 1.68 0.00 1.43 0.00 0.00 1.39 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.09 1.27 7.81 10 E 8.98 4.98 0.00 2.16 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 2.33 2.17 0.00 11 P 0.00 5.00 0.00 2.10 2.07 0.00 3.83 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 2.01 1.99 0.00 12 A 8.42 4.93 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 13 T 8.51 4.67 4.27 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 1.22 0.00 0.00 14 L 8.67 4.29 0.00 1.63 1.57 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.37 4.38 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.81 0.94 0.00 0.00 16 K 7.57 4.48 0.00 1.80 1.61 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.43 7.81 17 A 8.73 4.55 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 18 I 8.34 4.20 2.02 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 1.36 0.65 0.90 0.00 0.00 19 D 6.86 4.62 0.00 2.81 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 20 G 8.99 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 21 D 8.26 5.03 0.00 2.71 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 22 T 7.93 5.22 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 23 V 8.81 4.84 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 0.77 0.00 0.00 0.93 0.00 0.00 24 K 9.25 4.97 0.00 1.87 1.84 0.00 1.49 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.51 7.81 25 L 9.39 5.34 0.00 1.67 1.63 0.36 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.15 4.94 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 27 Y 8.91 4.96 0.00 3.32 3.06 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 0.00 0.00 0.00 0.00 28 K 9.31 3.43 0.00 1.50 1.59 0.00 1.58 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.95 0.21 7.81 29 G 8.18 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 30 Q 7.78 4.84 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 31 P 0.00 4.97 0.00 1.98 2.02 0.00 3.69 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 2.05 2.11 0.00 32 M 9.45 4.84 0.00 2.16 1.96 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.06 0.00 33 T 8.51 4.86 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 1.22 0.00 0.00 34 F 9.77 5.11 0.00 2.87 2.84 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 35 R 8.91 5.05 0.00 1.88 1.77 0.00 3.34 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 36 L 8.78 4.36 0.00 1.52 1.57 0.96 0.84 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 37 L 8.45 3.95 0.00 1.06 1.21 0.39 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 38 L 9.04 4.03 0.00 2.04 1.94 1.13 1.02 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 39 V 7.29 5.00 2.06 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 0.80 0.00 0.00 0.92 0.00 0.00 40 D 9.01 4.98 0.00 2.43 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 41 T 8.24 4.75 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 1.20 0.00 0.00 42 P 0.00 4.42 0.00 2.29 2.04 0.00 3.58 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 2.05 2.04 0.00 43 E 10.49 4.37 0.00 2.14 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 2.56 2.28 0.00 44 T 8.05 4.23 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 1.19 0.00 0.00 45 K 7.50 4.62 0.00 1.82 1.79 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.36 7.81 46 H 8.93 4.11 0.00 3.53 3.43 0.00 5.68 0.00 0.00 0.00 0.00 6.61 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 4.22 0.00 2.12 2.12 0.00 3.89 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 48 K 7.70 4.23 0.00 1.31 1.67 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.50 7.81 49 K 9.64 4.30 0.00 1.98 1.77 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.19 7.81 50 G 5.38 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.30 4.24 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 0.80 0.00 0.00 0.98 0.00 0.00 52 E 9.06 4.35 0.00 1.93 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 2.30 2.45 0.00 53 K 8.28 4.01 0.00 1.61 1.63 0.00 1.59 0.00 0.00 1.46 0.00 0.00 2.14 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.88 0.58 7.81 54 Y 8.10 4.47 0.00 3.21 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.12 3.62 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 0.00 0.00 0.00 56 P 0.00 4.28 0.00 2.16 2.11 0.00 3.57 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 57 E 8.16 3.99 0.00 2.35 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 0.00 2.52 2.50 0.00 58 A 8.74 4.02 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.54 4.18 0.00 4.12 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 60 A 8.46 4.12 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 61 F 8.51 3.99 0.00 3.24 3.21 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 0.00 62 T 8.18 3.92 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 63 K 8.06 3.85 0.00 1.96 1.98 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.49 7.81 64 K 8.31 3.94 0.00 1.69 1.74 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.66 1.59 7.81 65 M 7.54 3.94 0.00 1.88 2.03 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.37 0.00 66 L 7.82 4.14 0.00 1.90 1.68 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.45 4.10 0.00 1.89 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 2.33 2.61 0.00 68 N 7.53 4.77 0.00 2.72 2.78 0.00 0.00 6.93 8.22 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 69 A 6.95 4.59 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 70 K 8.92 4.16 0.00 1.90 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.48 7.81 71 K 8.53 4.71 0.00 1.66 1.65 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.39 5.04 2.02 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 1.32 0.82 0.85 0.00 0.00 73 E 9.20 5.17 0.00 1.88 1.76 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 2.21 2.25 0.00 74 V 8.95 4.72 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 0.68 0.00 0.00 75 E 8.98 5.02 0.00 2.20 2.29 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 2.48 2.53 0.00 76 F 8.97 4.68 0.00 3.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.43 5.04 0.00 2.73 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 78 K 9.33 4.31 0.00 1.77 1.89 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.21 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.46 7.81 79 G 8.44 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 0.00 0.00 0.00 0.00 80 Q 8.59 4.11 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 81 R 8.44 4.79 0.00 1.53 1.53 0.00 2.49 0.00 0.00 2.28 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 82 T 7.66 5.20 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 1.14 0.00 0.00 83 D 8.46 4.96 0.00 2.82 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 84 K 8.59 3.96 0.00 1.59 1.76 0.00 1.26 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.89 0.27 7.81 85 Y 8.04 4.32 0.00 3.13 2.98 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 86 G 8.21 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 R 8.34 4.29 0.00 2.06 1.81 0.00 3.12 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 88 G 8.31 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.77 5.33 0.00 1.56 1.60 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.30 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.69 4.81 0.00 3.01 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 92 I 8.65 4.86 1.75 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.68 0.84 0.00 0.00 93 Y 9.14 5.13 0.00 2.79 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 94 A 9.01 4.95 1.18 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 0.00 0.00 95 D 9.76 4.37 0.00 2.78 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.43 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 0.00 0.00 0.00 97 K 8.15 4.53 0.00 1.93 1.75 0.00 1.74 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.43 7.81 98 M 8.50 3.92 0.00 1.87 1.58 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 2.43 0.00 99 I 8.51 3.74 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.62 0.98 0.00 0.00 100 N 7.99 4.33 0.00 2.84 2.90 0.00 0.00 6.81 7.66 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 0.00 101 E 8.02 3.87 0.00 1.87 1.86 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 2.21 2.03 0.00 102 A 8.22 4.05 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 3.46 0.00 1.80 1.59 0.97 0.55 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 0.00 104 V 7.44 3.73 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 1.08 0.00 0.00 0.98 0.00 0.00 105 R 8.44 3.93 0.00 1.96 1.95 0.00 3.35 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 106 Q 7.59 4.32 0.00 1.88 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.25 0.00 0.00 0.00 0.00 0.00 2.31 2.08 0.00 107 G 8.05 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 0.00 108 L 7.83 4.56 0.00 1.22 1.46 0.43 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.46 4.61 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 0.00 110 K 8.59 4.76 0.00 1.76 1.63 0.00 1.90 0.00 0.00 1.43 0.00 0.00 2.64 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.83 7.81 111 V 9.42 4.17 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 0.86 0.00 0.00 1.01 0.00 0.00 112 A 9.05 4.19 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 0.00 113 Y 7.46 4.26 0.00 2.83 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 0.00 114 V 8.12 4.16 2.06 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 0.87 0.00 0.00 1.03 0.00 0.00 115 Y 8.26 4.61 0.00 3.10 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 0.00 116 K 8.61 4.38 0.00 1.80 1.81 0.00 1.77 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.48 7.81 117 P 0.00 4.81 0.00 2.22 2.16 0.00 3.81 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 1.99 2.01 0.00 118 N 8.28 4.84 0.00 2.97 2.89 0.00 0.00 6.63 7.55 0.00 0.00 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 N 7.84 5.12 0.00 2.88 3.01 0.00 0.00 6.11 7.22 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 0.00 120 T 8.63 3.84 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 121 H 7.92 4.88 0.00 2.89 3.12 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.28 3.99 0.00 2.20 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 0.00 2.35 2.41 0.00 123 Q 8.04 3.97 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.63 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 124 H 8.31 4.19 0.00 3.23 3.45 0.00 5.87 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 0.00 125 L 8.01 3.95 0.00 1.93 1.71 1.01 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.21 3.94 0.00 2.07 1.97 0.00 3.14 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 127 K 8.36 3.94 0.00 2.04 1.87 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.63 7.81 128 S 8.06 4.17 0.00 3.95 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 0.00 129 E 8.49 3.97 0.00 2.15 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 2.22 2.60 0.00 130 A 7.98 3.75 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 0.00 131 Q 7.95 3.79 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 132 A 8.08 4.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 7.71 3.28 0.00 1.52 1.27 0.00 1.09 0.00 0.00 1.37 0.00 0.00 2.77 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.30 0.74 7.81 134 K 7.84 3.90 0.00 1.90 1.83 0.00 1.61 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.42 7.81 135 E 8.22 4.24 0.00 1.92 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 2.31 2.46 0.00 136 K 7.77 4.09 0.00 1.91 1.90 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.49 7.81 137 L 7.97 4.33 0.00 1.81 1.67 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 138 N 9.38 3.74 0.00 2.66 1.66 0.00 0.00 6.90 7.31 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 0.00 139 I 5.42 3.19 1.28 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 -0.36 0.42 0.00 0.00 140 W 7.53 4.78 0.00 3.37 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 0.00 141 S 8.00 4.44 0.00 4.02 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