NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9108 8.3501 109.7344 44.3591 0.0000 175.3877 2 A 4.0095 7.8462 120.4518 50.6374 20.1083 171.5114 3 L 3.6290 7.8949 126.7727 56.4638 39.5709 173.0823 4 T 4.3118 8.7778 115.3600 60.5951 71.6010 175.1827 5 E 3.9852 8.5148 121.2015 59.0732 29.5269 178.4301 6 S 4.2974 7.9738 113.5315 60.7008 63.3934 176.3293 7 Q 3.9492 7.8274 121.8298 58.7686 28.5005 178.1269 8 A 3.9287 7.9719 121.5491 54.8977 18.3356 179.4889 9 A 3.9842 7.8576 118.8306 55.3389 18.4137 179.8916 10 L 3.9666 7.6981 117.3709 57.9026 41.7211 179.8256 11 V 3.4464 7.7571 118.1198 65.9471 31.3165 177.9387 12 K 3.9654 8.2746 119.2857 59.4613 32.1158 178.6824 13 S 4.1460 8.4304 113.7359 61.5948 62.4840 176.4189 14 S 4.3684 8.7187 117.1346 60.8583 62.8211 176.2200 15 W 4.3877 8.5611 132.5417 60.5943 30.3458 177.8800 16 E 3.3930 8.5393 118.7921 59.1664 28.6011 179.1958 17 E 3.9062 7.9062 117.8297 59.0486 29.6218 178.8081 18 F 3.9745 8.1559 120.7420 61.3751 39.2694 176.7400 19 N 3.9773 7.5499 114.7537 56.3926 38.5851 176.1330 20 A 4.1196 7.2913 121.7625 53.5856 19.8146 177.0389 21 N 4.6694 7.4840 115.6258 50.7458 39.1507 174.4926 22 I 3.2012 7.6095 123.5296 63.0992 37.7105 175.4747 23 P 4.1130 0.0000 0.0000 65.4617 31.2112 178.4935 24 K 3.8204 7.6397 117.4748 59.9991 32.2287 178.4767 25 H 4.2697 8.0348 117.1136 58.8440 28.6296 177.9693 26 T 3.9666 8.1014 112.1421 64.7901 68.6083 176.3421 27 H 4.4173 8.2228 121.0995 59.1865 29.9239 177.1400 28 R 3.8734 8.1779 120.5864 59.2751 29.8463 178.1901 29 F 4.0992 8.4066 121.8014 60.9164 39.4897 177.2528 30 F 4.1334 7.9723 115.8858 60.2455 38.6529 177.6678 31 I 3.6902 7.8418 119.6893 64.6113 36.8336 178.4819 32 L 3.9767 7.7171 119.4295 57.1787 41.3498 179.7427 33 V 3.3509 7.7116 118.9345 66.0741 31.2855 178.2147 34 L 4.0855 7.7764 117.0303 57.6384 41.4778 179.0558 35 E 4.0866 8.0844 118.0608 59.0505 29.3583 178.9947 36 I 4.1729 7.2201 119.0572 62.5797 38.6893 176.4527 37 A 4.6189 8.0326 123.9390 48.4043 19.7097 174.2204 38 P 4.4424 0.0000 0.0000 65.9020 31.2537 178.3757 39 A 4.0697 8.1015 118.7827 54.6673 18.6338 178.8438 40 A 4.1154 8.6503 119.4073 54.1511 18.3896 179.2937 41 K 3.8790 7.9279 118.6908 60.2009 31.9836 178.4030 42 D 4.4390 8.1215 116.3811 57.0749 40.7381 178.3322 43 L 4.0483 7.6057 118.7040 55.6617 41.7171 176.9607 44 F 4.2148 7.5344 118.9603 55.5185 39.1369 176.5352 45 S 3.9679 8.3988 121.7673 61.1627 62.6697 175.8432 46 F 4.6190 6.8562 112.3931 56.7791 38.1720 175.6096 47 L 4.5537 7.4199 121.0575 55.4026 43.2995 177.4102 48 K 3.9018 7.3524 117.4707 57.6826 32.6315 176.7099 49 G 4.0702 8.6949 109.6021 46.8497 0.0000 173.0114 50 T 4.6922 7.4412 105.3553 59.7033 72.2925 173.9055 51 S 4.2797 8.6793 117.3419 60.4588 62.9484 173.9520 52 E 4.6995 7.6156 118.1827 53.9213 31.6324 176.1011 53 V 3.7260 8.2145 121.3766 62.0390 32.1014 174.3196 54 P 4.4074 0.0000 0.0000 63.4135 31.5597 176.0275 55 Q 4.3162 8.5213 118.3928 56.7004 30.1567 175.5586 56 N 4.9988 7.7560 114.1246 51.8212 39.5992 174.4272 57 N 4.7641 7.8217 116.7421 51.6849 41.3306 172.4825 58 P 4.2879 0.0000 0.0000 65.6367 31.5607 178.6409 59 E 3.8564 8.3711 118.8112 59.0810 29.4600 178.7180 60 L 2.4936 7.4472 119.7458 57.8231 42.0889 178.9510 61 Q 3.9654 7.7399 117.2797 58.7616 28.6879 178.5737 62 A 3.9813 7.9700 121.7857 55.4405 18.4865 178.8715 63 H 4.1404 8.3317 116.5244 59.7638 29.9943 177.3774 64 A 4.0314 8.5366 122.5199 54.9457 18.3367 179.8668 65 G 3.7974 8.3055 104.5773 47.8820 0.0000 176.2553 66 K 4.1539 8.1192 120.4162 59.1311 32.2248 179.3948 67 V 3.6309 7.9153 118.5676 66.3882 31.3584 178.2101 68 F 4.0966 8.3122 116.8774 60.2523 38.5990 177.6562 69 K 4.0197 8.3947 119.1285 59.6598 32.0503 178.9626 70 L 3.9389 8.1711 119.2881 57.5738 41.5151 179.6903 71 V 3.5600 7.8360 118.0897 66.0315 31.3898 177.4091 72 Y 3.6789 8.1764 119.4181 60.7538 38.5907 178.0882 73 E 3.1570 7.8691 119.1724 58.7565 29.3450 179.2125 74 A 3.8302 7.7287 120.8995 55.0457 18.0679 179.5856 75 A 3.7907 7.7755 119.1764 55.0545 18.3262 179.9977 76 I 3.5680 7.0465 118.6060 64.2531 37.1181 178.3016 77 Q 3.8480 7.8713 120.4597 59.2116 28.7676 178.3850 78 L 4.1008 7.9911 120.1049 57.5171 41.3325 179.2365 79 E 4.1131 7.3783 119.4677 58.7322 29.7605 178.7852 80 V 3.6943 7.6655 116.9784 65.7622 31.8295 177.2480 81 T 4.4157 8.4482 106.3000 60.9554 69.9392 175.4007 82 G 3.9361 8.2737 109.9712 45.3789 0.0000 172.9037 83 V 4.4014 7.0994 110.8126 59.6558 35.6514 174.4462 84 V 4.1362 8.0017 120.0424 61.0509 32.2657 175.1967 85 V 3.7488 8.1566 127.7426 62.7187 32.0613 175.2753 86 T 4.2182 8.3901 124.5166 63.0312 69.3255 173.4846 87 D 5.0662 8.1908 126.3045 51.2239 42.4878 175.5332 88 A 3.9491 8.6835 119.0662 56.2199 18.2637 179.8870 89 T 3.8080 7.9353 113.7214 66.9533 68.4124 176.4631 90 L 4.1182 7.8975 120.0387 56.9473 41.3693 179.6705 91 K 3.9755 7.8959 118.9320 59.4168 32.1537 178.7312 92 N 4.3090 9.1416 118.4932 56.7280 38.9601 176.6442 93 L 4.1734 8.4532 122.1996 57.9519 42.1208 179.2408 94 G 3.6932 8.0233 106.2126 47.6729 0.0000 175.9678 95 S 4.1804 7.8774 116.4796 61.2304 63.1886 176.9427 96 V 3.6111 7.7158 115.8983 64.5462 31.4451 178.3359 97 H 4.0909 8.0674 115.3383 58.6096 28.4639 178.1697 98 V 3.6504 7.8174 120.3254 66.0526 31.1843 178.0822 99 S 4.1463 8.2768 114.2248 61.5088 62.8078 176.1246 100 K 4.2975 7.7759 117.7382 56.1564 32.0025 177.6078 101 G 3.8472 7.8828 107.5980 45.5955 0.0000 173.7039 102 V 3.7972 7.5370 118.8532 61.9993 32.2299 175.3191 103 A 4.9823 8.6099 128.5583 49.9134 22.0478 176.4285 104 D 4.4886 8.8557 118.6948 57.7053 40.8975 179.0637 105 A 4.2955 7.9629 119.4290 54.1469 18.4893 178.2825 106 H 4.5917 8.4383 113.3624 57.8091 28.8249 177.6181 107 F 4.2831 8.3947 120.2580 60.1116 38.7305 175.6844 108 P 4.3436 0.0000 0.0000 65.3807 31.1430 178.7522 109 V 3.4952 7.4936 115.8903 66.1800 31.6822 178.4002 110 V 3.4809 7.6861 117.4274 65.4662 31.2934 177.6937 111 K 2.7285 7.8516 119.5485 59.2681 31.9732 178.7445 112 E 3.9032 8.0716 118.3604 59.0425 29.2963 179.1780 113 A 3.8588 7.7273 120.9378 54.8426 18.3496 179.7731 114 I 3.7735 7.4687 118.1927 64.3325 37.1066 178.6829 115 L 3.9139 7.5486 119.8742 57.8274 41.6435 179.7614 116 K 3.9517 7.9528 118.3773 59.4032 31.7706 179.7072 117 T 3.8853 7.8841 116.1646 66.8636 68.4660 176.8333 118 I 3.7731 7.5026 121.1826 64.1325 36.8712 178.4824 119 K 3.9811 8.0944 120.6210 59.5290 31.7367 178.7581 120 E 3.9750 7.7830 117.6939 58.7979 29.4414 179.1642 121 V 3.6292 7.6542 117.9743 66.1717 32.0457 178.2377 122 V 4.0867 8.2785 111.3311 60.0631 31.7409 178.6295 123 G 3.8087 8.5415 107.1351 46.4576 0.0000 177.0098 124 A 4.1819 9.0252 128.3864 53.8435 18.3126 178.9279 125 K 4.4180 7.9341 114.5502 56.0853 32.1828 177.0577 126 W 4.4119 7.7909 130.0125 57.2748 31.5578 175.8305 127 S 4.3221 6.9123 117.2732 55.7245 67.1346 174.9341 128 E 3.5932 8.1169 121.1925 58.6089 29.1068 178.9240 129 E 3.9704 7.7619 119.3757 58.5178 29.7850 178.1568 130 L 3.9525 7.4854 120.2533 57.8873 42.1704 178.1516 131 N 4.4726 7.6785 116.9764 57.0545 38.8357 176.9994 132 S 4.2550 8.0278 114.6479 60.9698 63.1496 176.3520 133 A 3.9189 7.7537 124.4546 54.9785 18.2019 179.6389 134 W 4.0737 8.4301 117.5275 60.0596 29.1065 178.6719 135 T 4.0172 8.1543 115.7810 66.9251 68.0020 176.3825 136 I 3.7069 8.0622 121.1715 64.4696 37.2303 178.2607 137 A 3.9439 7.9973 121.3841 55.3530 18.1710 178.8075 138 Y 3.8637 8.1761 117.8277 61.0518 38.7960 177.8857 139 D 4.4754 8.4640 119.5785 57.8418 41.1988 179.1189 140 E 3.9563 8.2896 118.7147 59.0783 29.4219 179.2267 141 L 3.9332 7.9452 120.3514 57.9984 42.0993 178.8412 142 A 3.8159 8.1230 121.1228 55.0062 18.0591 179.6425 143 I 3.3844 7.3838 118.3284 64.3226 36.8797 178.8671 144 V 3.5334 7.0414 116.9983 65.9574 31.7417 177.7839 145 I 3.8248 7.6048 119.4225 64.5945 37.1683 178.5118 146 K 3.7588 8.5063 119.9309 59.2121 31.2576 179.1760 147 K 4.1049 7.6779 118.6325 59.1156 32.6088 178.6599 148 E 4.1707 7.9440 118.6156 58.4326 29.7999 178.5084 149 M 4.3939 7.7514 118.9953 58.4956 32.1214 178.0335 150 D 4.5092 7.8621 116.3961 56.3200 41.0580 177.4259 151 D 4.6649 7.6314 116.8388 54.9192 41.6013 177.6110 152 A 4.3248 7.8147 120.2530 53.1774 19.3866 176.8776 153 A 4.2361 7.8791 123.7111 52.3916 19.2454 176.7613 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 3.91 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 0.00 0.00 0.00 2 A 7.85 4.01 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 3 L 7.89 3.63 0.00 1.84 1.72 0.84 0.60 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 4 T 8.78 4.31 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 1.25 0.00 0.00 5 E 8.51 3.99 0.00 2.04 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 2.37 2.35 0.00 6 S 7.97 4.30 0.00 4.08 4.10 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 0.00 0.00 0.00 7 Q 7.83 3.95 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 8 A 7.97 3.93 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 9 A 7.86 3.98 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 10 L 7.70 3.97 0.00 1.87 1.78 0.90 1.12 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 7.76 3.45 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 0.52 0.00 0.00 0.27 0.00 0.00 12 K 8.27 3.97 0.00 2.13 2.14 0.00 1.87 0.00 0.00 1.69 0.00 0.00 3.27 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.56 1.61 7.81 13 S 8.43 4.15 0.00 4.21 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 14 S 8.72 4.37 0.00 4.39 4.37 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 15 W 8.56 4.39 0.00 3.63 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 16 E 8.54 3.39 0.00 2.12 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 2.36 2.75 0.00 17 E 7.91 3.91 0.00 2.15 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 2.34 2.32 0.00 18 F 8.16 3.97 0.00 3.06 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 19 N 7.55 3.98 0.00 2.01 2.42 0.00 0.00 7.28 7.77 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 20 A 7.29 4.12 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 21 N 7.48 4.67 0.00 2.43 2.07 0.00 0.00 7.20 8.55 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 22 I 7.61 3.20 1.71 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.56 0.80 0.00 0.00 23 P 0.00 4.11 0.00 2.04 2.02 0.00 3.37 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 24 K 7.64 3.82 0.00 1.66 1.57 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.46 7.81 25 H 8.03 4.27 0.00 2.09 2.95 0.00 5.67 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.10 3.97 4.31 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 0.00 0.00 0.00 1.11 0.00 0.00 27 H 8.22 4.42 0.00 3.32 3.62 0.00 5.79 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.18 3.87 0.00 2.10 2.14 0.00 3.19 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 29 F 8.41 4.10 0.00 3.25 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 30 F 7.97 4.13 0.00 3.34 3.11 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 31 I 7.84 3.69 1.97 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.02 0.88 0.00 0.00 32 L 7.72 3.98 0.00 1.64 1.55 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.71 3.35 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 1.09 0.00 0.00 0.13 0.00 0.00 34 L 7.78 4.09 0.00 1.92 1.73 1.06 0.85 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 35 E 8.08 4.09 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 2.54 0.00 36 I 7.22 4.17 1.92 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 1.40 0.48 0.88 0.00 0.00 37 A 8.03 4.62 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 38 P 0.00 4.44 0.00 2.28 2.34 0.00 3.72 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 39 A 8.10 4.07 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 40 A 8.65 4.12 1.48 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 0.00 0.00 0.00 41 K 7.93 3.88 0.00 2.00 1.88 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.54 7.81 42 D 8.12 4.44 0.00 2.66 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 43 L 7.61 4.05 0.00 1.08 1.20 0.69 0.59 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 44 F 7.53 4.21 0.00 3.02 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 0.00 0.00 0.00 0.00 45 S 8.40 3.97 0.00 3.97 4.05 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 46 F 6.86 4.62 0.00 3.02 3.22 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 0.00 47 L 7.42 4.55 0.00 1.68 1.69 0.77 0.75 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 48 K 7.35 3.90 0.00 1.63 1.73 0.00 1.92 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.55 7.81 49 G 8.69 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 0.00 0.00 0.00 50 T 7.44 4.69 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 1.31 0.00 0.00 51 S 8.68 4.28 0.00 3.86 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 52 E 7.62 4.70 0.00 2.01 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 2.24 2.28 0.00 53 V 8.21 3.73 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 0.92 0.00 0.00 0.98 0.00 0.00 54 P 0.00 4.41 0.00 2.22 2.06 0.00 3.84 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 55 Q 8.52 4.32 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.53 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 56 N 7.76 5.00 0.00 2.60 2.70 0.00 0.00 6.78 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 7.82 4.76 0.00 2.71 2.60 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 4.29 0.00 2.27 2.26 0.00 3.71 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 2.04 2.03 0.00 59 E 8.37 3.86 0.00 1.93 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 2.34 2.31 0.00 60 L 7.45 2.49 0.00 1.11 1.56 0.90 1.00 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 61 Q 7.74 3.97 0.00 2.07 2.09 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 2.32 2.40 0.00 62 A 7.97 3.98 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 63 H 8.33 4.14 0.00 3.51 3.59 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.54 4.03 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 65 G 8.31 3.80 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 0.00 0.00 0.00 66 K 8.12 4.15 0.00 2.08 1.95 0.00 1.75 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.54 7.81 67 V 7.92 3.63 2.15 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 0.92 0.00 0.00 0.91 0.00 0.00 68 F 8.31 4.10 0.00 2.99 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 69 K 8.39 4.02 0.00 2.17 1.93 0.00 1.68 0.00 0.00 2.06 0.00 0.00 3.07 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.44 1.41 7.81 70 L 8.17 3.94 0.00 1.76 1.68 0.96 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 71 V 7.84 3.56 2.37 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 1.32 0.00 0.00 1.10 0.00 0.00 72 Y 8.18 3.68 0.00 2.78 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 73 E 7.87 3.16 0.00 1.76 1.68 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 1.85 1.92 0.00 74 A 7.73 3.83 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 75 A 7.78 3.79 1.13 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 0.00 0.00 76 I 7.05 3.57 1.63 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 0.92 0.50 0.77 0.00 0.00 77 Q 7.87 3.85 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.45 2.31 0.00 78 L 7.99 4.10 0.00 1.63 1.64 0.86 0.70 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 79 E 7.38 4.11 0.00 2.00 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 0.00 2.35 2.45 0.00 80 V 7.67 3.69 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 0.90 0.00 0.00 81 T 8.45 4.42 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 1.16 0.00 0.00 82 G 8.27 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 83 V 7.10 4.40 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 0.67 0.00 0.00 0.89 0.00 0.00 84 V 8.00 4.14 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 0.72 0.00 0.00 0.86 0.00 0.00 85 V 8.16 3.75 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 0.83 0.00 0.00 0.95 0.00 0.00 86 T 8.39 4.22 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 1.23 0.00 0.00 87 D 8.19 5.07 0.00 2.83 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 88 A 8.68 3.95 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 7.94 3.81 4.39 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 1.23 0.00 0.00 90 L 7.90 4.12 0.00 1.68 1.70 0.95 0.60 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 91 K 7.90 3.98 0.00 2.04 1.86 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.70 1.71 7.81 92 N 9.14 4.31 0.00 2.80 2.98 0.00 0.00 6.91 6.54 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 93 L 8.45 4.17 0.00 2.15 1.84 1.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.02 3.69 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 0.00 0.00 0.00 95 S 7.88 4.18 0.00 4.08 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 96 V 7.72 3.61 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 0.91 0.00 0.00 0.80 0.00 0.00 97 H 8.07 4.09 0.00 3.39 3.48 0.00 5.81 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.82 3.65 2.28 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 1.05 0.00 0.00 1.06 0.00 0.00 99 S 8.28 4.15 0.00 4.00 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 0.00 100 K 7.78 4.30 0.00 1.63 1.67 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.64 1.45 7.81 101 G 7.88 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 V 7.54 3.80 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.91 0.00 0.00 103 A 8.61 4.98 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 0.00 104 D 8.86 4.49 0.00 2.75 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 0.00 105 A 7.96 4.30 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 0.00 106 H 8.44 4.59 0.00 3.35 3.22 0.00 5.64 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 0.00 107 F 8.39 4.28 0.00 3.29 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 2.20 2.16 0.00 3.80 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 2.19 2.26 0.00 109 V 7.49 3.50 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 0.97 0.00 0.00 0.96 0.00 0.00 110 V 7.69 3.48 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 1.22 0.00 0.00 1.03 0.00 0.00 111 K 7.85 2.73 0.00 1.05 1.69 0.00 1.94 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.27 1.04 7.81 112 E 8.07 3.90 0.00 1.94 1.90 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 2.47 2.43 0.00 113 A 7.73 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 I 7.47 3.77 1.79 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 0.60 1.12 0.48 0.00 0.00 115 L 7.55 3.91 0.00 1.59 1.75 0.96 1.08 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 0.00 116 K 7.95 3.95 0.00 1.82 1.77 0.00 1.58 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.51 7.81 117 T 7.88 3.89 4.61 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 1.38 0.00 0.00 118 I 7.50 3.77 1.61 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 -0.36 0.82 0.00 0.00 119 K 8.09 3.98 0.00 1.38 1.83 0.00 0.71 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.07 1.17 7.81 120 E 7.78 3.98 0.00 2.14 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 2.27 2.44 0.00 121 V 7.65 3.63 2.19 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 0.80 0.00 0.00 0.79 0.00 0.00 122 V 8.28 4.09 2.21 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 0.92 0.00 0.00 1.30 0.00 0.00 123 G 8.54 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 124 A 9.03 4.18 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 0.00 125 K 7.93 4.42 0.00 1.86 1.91 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.55 7.81 126 W 7.79 4.41 0.00 3.34 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 0.00 127 S 6.91 4.32 0.00 3.80 3.73 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 0.00 128 E 8.12 3.59 0.00 1.85 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 2.33 2.30 0.00 129 E 7.76 3.97 0.00 2.00 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 2.32 2.37 0.00 130 L 7.49 3.95 0.00 1.77 1.55 1.19 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 131 N 7.68 4.47 0.00 2.88 2.93 0.00 0.00 7.01 7.08 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 0.00 132 S 8.03 4.25 0.00 4.14 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 0.00 133 A 7.75 3.92 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 0.00 134 W 8.43 4.07 0.00 3.48 3.35 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 0.00 135 T 8.15 4.02 4.50 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 1.29 0.00 0.00 136 I 8.06 3.71 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 1.47 1.12 0.90 0.00 0.00 137 A 8.00 3.94 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 0.00 138 Y 8.18 3.86 0.00 3.35 3.11 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 0.00 139 D 8.46 4.48 0.00 3.05 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 0.00 140 E 8.29 3.96 0.00 1.94 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 2.48 2.42 0.00 141 L 7.95 3.93 0.00 1.71 1.68 0.86 0.78 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 0.00 142 A 8.12 3.82 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 0.00 143 I 7.38 3.38 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.67 0.84 0.00 0.00 144 V 7.04 3.53 2.15 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 0.79 0.00 0.00 0.90 0.00 0.00 145 I 7.60 3.82 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.76 1.05 0.00 0.00 146 K 8.51 3.76 0.00 1.76 1.68 0.00 1.16 0.00 0.00 1.41 0.00 0.00 2.81 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.21 0.35 7.81 147 K 7.68 4.10 0.00 1.90 2.00 0.00 1.27 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.63 1.44 7.81 148 E 7.94 4.17 0.00 2.10 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 2.59 2.48 0.00 149 M 7.75 4.39 0.00 2.11 2.28 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.88 0.00 150 D 7.86 4.51 0.00 2.68 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 0.00 151 D 7.63 4.66 0.00 2.75 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 0.00 152 A 7.81 4.32 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 0.00 153 A 7.88 4.24 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