NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.4964 8.3033 117.8283 56.2170 30.1108 173.9164 1D H 4.0659 8.3374 111.4584 56.2273 26.3660 173.4424 1E H 5.0671 7.4793 116.6236 53.8239 33.4904 172.4114 1F H 4.6164 8.9412 117.1017 55.9954 28.9483 174.3150 1G F 4.8294 8.3850 119.4951 57.8202 39.8975 174.2135 2 N 4.6468 8.4921 117.3203 52.4205 39.0134 174.5022 3 L 4.8062 8.1179 123.4064 52.0180 43.9781 174.7130 4 P 4.4826 0.0000 0.0000 61.6180 32.2162 174.2610 5 P 4.3536 0.0000 0.0000 62.4135 32.2490 174.3611 6 G 3.6505 8.8307 104.3871 44.7287 0.0000 171.4451 7 N 4.3312 7.8845 114.5048 52.2762 39.7982 173.8697 8 Y 4.8589 7.9466 114.0503 57.9790 38.4464 176.9620 9 K 4.0848 8.3199 122.4079 58.7776 32.2505 177.1820 10 K 4.7397 7.6048 115.1224 53.2414 35.5232 173.7322 11 P 4.7364 0.0000 0.0000 63.2729 32.4174 175.0597 12 K 4.9043 9.5160 119.3268 55.2698 37.5047 174.8883 13 L 5.1597 9.2810 121.0299 53.2437 44.5818 176.2094 14 L 5.0518 8.6274 122.8701 53.5316 43.1526 174.6584 15 Y 4.7367 9.1736 127.2543 56.5604 40.2959 173.7747 16 C 4.0716 8.5866 128.6613 58.2393 32.2921 174.5349 17 S 3.8856 8.1456 121.4747 61.1574 62.8590 175.1843 18 N 4.1427 8.1370 118.7850 56.1416 38.5907 175.3215 19 G 3.9054 7.5117 102.6108 44.5011 0.0000 172.7572 20 G 3.2117 7.5965 107.1057 44.2127 0.0000 173.3942 21 H 4.7704 7.3529 115.4840 54.0525 31.3621 174.1674 22 F 5.1244 9.0156 120.8782 56.0385 40.5897 175.2650 23 L 4.5669 8.9990 126.6610 55.5944 42.7019 176.1896 24 R 4.8158 9.5328 125.8229 54.6533 33.7143 173.9081 25 I 4.7843 8.1783 126.5202 59.4152 38.5567 175.6979 26 L 4.1061 8.7348 127.8516 53.3841 42.3052 176.8873 27 P 4.1728 0.0000 0.0000 65.8026 31.2670 177.2125 28 D 4.5407 7.9989 114.6010 53.4279 39.7738 177.0915 29 G 4.0458 8.4509 109.5663 45.3653 0.0000 173.5887 30 T 4.4058 8.0770 114.9578 61.3717 68.1477 173.3246 31 V 4.8543 8.0043 126.4744 61.2537 34.5641 174.6005 32 D 4.5806 8.5938 124.8936 53.0390 42.6529 174.0698 33 G 4.5646 8.7008 104.6929 45.5161 0.0000 172.2263 34 T 4.9999 8.8388 114.7474 60.6264 71.0088 174.6625 35 R 4.4788 8.8583 124.3959 56.6477 30.9915 176.1466 36 D 4.5764 8.1173 119.2989 53.7381 40.8357 176.9689 37 R 3.7591 8.5841 126.6402 58.1882 30.3580 177.9925 38 S 4.2573 8.5727 112.1169 59.2967 63.6168 174.2559 39 D 4.3065 7.4231 121.1358 55.3770 41.1199 175.9002 40 Q 4.5348 8.4395 122.8822 55.5952 29.2471 175.5883 41 H 4.8868 9.1331 115.2581 55.5080 29.2215 175.1434 42 I 4.4924 7.5550 111.4417 60.6942 38.4400 175.2553 43 Q 4.2599 7.8456 122.0227 55.7203 29.7286 174.6618 44 L 4.9566 9.1459 124.8945 52.8156 45.3290 175.3400 45 Q 4.7003 9.3297 125.5354 54.6862 30.4726 174.3230 46 L 5.2879 8.5914 126.6200 53.6633 43.8529 176.0985 47 S 4.5211 8.5684 114.9648 56.8366 66.8534 172.4662 48 A 4.4887 8.3043 123.2688 51.6753 19.9923 174.9982 49 E 3.9394 9.3229 124.1990 56.5730 29.5525 177.8213 50 S 4.7150 6.5613 112.0944 56.3221 65.7460 173.9366 51 V 3.8025 8.1768 121.4578 64.7402 31.6676 176.4010 52 G 3.8861 9.1555 114.4277 45.2219 0.0000 171.9987 53 E 5.2370 8.3317 120.1394 54.6194 32.1086 175.6470 54 V 4.8936 9.0143 116.7663 59.8257 36.5308 173.9943 55 Y 5.1466 8.7911 119.9374 56.5313 41.0881 175.3382 56 I 4.3895 8.6250 122.6858 59.6525 40.1460 173.9084 57 K 4.5856 8.8910 129.5240 54.0712 34.7803 175.1691 58 S 4.4656 8.7754 123.0987 58.4105 62.5483 174.8540 59 T 3.8188 8.5396 118.8584 64.4969 68.7788 176.0640 60 E 4.0283 8.3840 122.8578 58.8618 29.8396 177.2077 61 T 4.2715 7.9959 106.0389 60.9512 69.9897 175.6524 62 G 3.8217 8.2507 110.0998 45.2022 0.0000 173.7195 63 Q 4.4293 7.5869 118.6779 56.0459 30.2814 174.5607 64 Y 4.7847 8.8579 119.7266 55.9101 40.8010 175.2442 65 L 4.3778 9.0226 126.1556 55.4487 43.5103 175.5927 66 A 5.1867 8.6435 125.8344 50.7487 23.2816 174.4425 67 M 5.3971 8.6990 119.0177 53.9336 35.0599 175.4980 68 D 5.4186 9.4351 125.8656 51.7316 41.2820 177.0432 69 T 4.1273 8.5112 108.3261 64.1067 68.6963 174.5345 70 D 4.6136 8.3891 120.5226 54.0158 41.3957 176.9284 71 G 3.2011 8.5757 108.6299 45.2464 0.0000 172.8853 72 L 4.7674 7.9514 119.6422 52.8484 43.1697 176.1936 73 L 5.1225 8.3054 122.5951 55.2223 42.8655 175.4070 74 Y 4.9172 8.7345 118.6187 56.2870 42.0180 173.3368 75 G 4.2655 9.1645 108.4693 45.0472 0.0000 173.3763 76 S 5.0316 9.1081 121.3581 57.1790 63.7735 175.3062 77 Q 4.3143 9.0144 124.8598 58.0633 28.9966 176.3956 78 T 4.6791 7.7033 106.8150 58.7640 71.6853 171.7809 79 P 4.0190 0.0000 0.0000 61.8060 31.5738 174.6881 80 N 4.9444 8.1724 120.6773 50.9991 40.3835 174.1982 81 A 3.9076 8.6447 119.1442 55.7650 18.0830 179.3507 82 E 4.1924 8.8775 114.4692 58.2286 29.6603 177.7484 83 C 5.0476 7.9069 115.2560 58.7633 29.1369 173.2806 84 L 4.3865 7.0007 120.1664 53.4979 42.9835 175.7721 85 F 5.2106 8.9079 121.4107 55.5574 43.3880 174.3909 86 L 4.8316 9.1369 123.0130 53.8655 42.5688 175.5696 87 E 4.4089 8.7309 126.8767 55.2451 30.1758 175.7396 88 R 4.7952 8.6021 125.5602 54.0299 34.7975 174.7646 89 L 4.7270 8.7641 124.0518 55.3037 43.1289 175.8051 90 E 4.7132 9.0722 124.2654 55.2260 33.6381 174.8707 91 E 4.0011 9.7380 123.2270 57.6263 27.3046 174.2334 92 N 4.3206 8.4951 110.8679 54.1234 36.5156 174.0380 93 H 4.8210 8.5957 116.6874 57.5666 37.3706 173.4395 94 Y 4.6987 7.8013 116.0852 57.3928 40.1421 173.7351 95 N 5.4647 9.7477 118.7597 52.0334 40.9545 174.6172 96 T 5.2971 8.8810 112.9740 60.1778 73.0627 172.7287 97 Y 4.9498 8.5958 118.6870 56.6938 41.7580 174.1410 98 I 4.5989 8.6362 126.1040 59.1585 39.7731 175.5073 99 S 3.9984 9.1972 122.0980 58.6173 62.8225 174.9763 100 K 3.8410 8.6277 129.0427 59.3657 32.1844 178.8032 101 A 3.9330 7.7056 120.0259 54.6218 18.5947 177.0996 102 H 4.7581 7.7899 113.2251 55.1868 30.0301 175.9235 103 A 4.0880 7.9950 124.6204 54.5530 18.3503 180.6408 104 E 4.0429 7.9915 112.2018 58.3696 29.8262 177.5991 105 K 4.0517 7.5037 117.5411 55.5036 32.8216 175.7364 106 N 3.8857 7.5402 115.6857 53.9335 36.5480 174.7587 107 W 5.0499 7.7017 117.6558 55.8719 30.9214 177.2785 108 F 5.4220 9.0179 123.7229 55.4981 41.1278 175.6700 109 V 3.9860 8.9135 121.4264 63.0051 32.4665 175.2223 110 G 4.4388 8.5777 112.6974 45.2930 0.0000 171.4951 111 L 5.3090 8.4724 121.0605 52.5301 45.4999 177.0962 112 K 4.1721 9.1418 122.7633 55.3378 33.0195 178.4283 113 K 3.9294 8.3968 119.4943 59.1817 31.9590 177.9481 114 N 4.5364 8.0649 114.0448 52.6937 37.7576 175.9218 115 G 3.5311 8.2501 108.8712 45.2540 0.0000 173.6048 116 S 4.7388 8.4881 115.0800 57.0013 64.5292 173.4719 117 C 4.7292 8.2944 119.7233 59.9987 28.5358 173.6754 118 K 4.3763 8.7061 122.4253 55.9973 33.2188 176.5026 119 R 4.3384 8.3132 120.8395 54.8890 31.7899 177.5624 120 G 3.4252 9.0465 114.2475 48.3015 0.0000 174.1873 121 P 4.3711 0.0000 0.0000 64.3988 31.3770 177.3529 122 R 4.4166 7.8921 116.0362 56.0664 30.2852 176.0868 123 T 5.2212 7.5774 108.2909 59.7550 71.0445 173.3112 124 H 4.7241 7.9078 114.8604 54.9253 30.5112 173.0979 125 Y 3.9151 8.7180 118.4598 60.0622 38.1013 177.1473 126 G 4.0752 9.0422 111.1891 45.4186 0.0000 173.8746 127 Q 4.2605 7.3918 119.1121 54.9478 29.8924 177.2439 128 K 3.7896 8.3329 119.9102 58.8211 32.7786 179.3262 129 A 3.9716 8.0947 121.3144 53.9189 18.2985 178.4654 130 I 4.4520 6.7119 105.5760 60.3424 38.4564 175.4122 131 L 4.3957 7.1895 123.3035 53.9666 42.6922 175.7533 132 F 5.5174 9.4172 122.3679 55.5945 43.3454 173.9984 133 L 5.2265 9.2443 121.9810 52.3721 44.5310 173.8605 134 P 5.1280 0.0000 0.0000 62.4399 32.2263 175.3737 135 L 4.9022 9.0590 125.3713 51.8664 44.5179 174.7278 136 P 4.6367 0.0000 0.0000 62.6404 32.3635 176.9585 137 V 3.7665 8.1781 113.9845 61.8217 31.6092 176.3892 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 1C H 8.30 4.50 0.00 3.26 3.35 0.00 5.71 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 1D H 8.34 4.07 0.00 3.34 3.35 0.00 5.64 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.48 5.07 0.00 3.37 3.27 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.94 4.62 0.00 3.32 3.39 0.00 5.66 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 1G F 8.38 4.83 0.00 2.86 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.49 4.65 0.00 2.96 2.79 0.00 0.00 6.88 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.12 4.81 0.00 1.50 1.43 0.65 0.37 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 4 P 0.00 4.48 0.00 2.17 2.11 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 5 P 0.00 4.35 0.00 2.17 2.08 0.00 3.71 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 6 G 8.83 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 N 7.88 4.33 0.00 2.61 2.64 0.00 0.00 5.81 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 8 Y 7.95 4.86 0.00 3.05 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 9 K 8.32 4.08 0.00 1.88 1.91 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.53 7.81 10 K 7.60 4.74 0.00 1.71 1.69 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.39 7.81 11 P 0.00 4.74 0.00 2.07 2.05 0.00 3.74 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 12 K 9.52 4.90 0.00 1.66 1.86 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.58 1.64 7.81 13 L 9.28 5.16 0.00 1.73 1.77 0.58 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.63 5.05 0.00 1.57 1.61 0.33 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.17 4.74 0.00 3.16 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 16 C 8.59 4.07 0.00 2.44 2.42 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 17 S 8.15 3.89 0.00 3.83 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 18 N 8.14 4.14 0.00 2.50 2.67 0.00 0.00 6.71 7.98 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 19 G 7.51 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 20 G 7.60 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 0.00 0.00 0.00 21 H 7.35 4.77 0.00 3.02 3.26 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 9.02 5.12 0.00 3.09 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 23 L 9.00 4.57 0.00 1.70 1.59 0.96 0.58 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 24 R 9.53 4.82 0.00 1.90 2.04 0.00 3.25 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.80 0.00 25 I 8.18 4.78 1.84 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 1.18 0.73 0.89 0.00 0.00 26 L 8.73 4.11 0.00 1.79 1.52 0.91 0.93 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 27 P 0.00 4.17 0.00 1.99 2.11 0.00 3.53 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.93 0.00 28 D 8.00 4.54 0.00 2.78 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 29 G 8.45 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 0.00 0.00 0.00 30 T 8.08 4.41 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 1.30 0.00 0.00 31 V 8.00 4.85 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 0.92 0.00 0.00 0.94 0.00 0.00 32 D 8.59 4.58 0.00 2.86 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 33 G 8.70 4.56 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 0.00 34 T 8.84 5.00 4.33 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 1.36 0.00 0.00 35 R 8.86 4.48 0.00 1.89 2.02 0.00 3.22 0.00 0.00 3.11 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.43 0.00 36 D 8.12 4.58 0.00 2.85 2.63 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 37 R 8.58 3.76 0.00 1.80 1.81 0.00 3.43 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.74 0.00 38 S 8.57 4.26 0.00 3.91 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 39 D 7.42 4.31 0.00 2.71 2.63 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 40 Q 8.44 4.53 0.00 1.89 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.04 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 41 H 9.13 4.89 0.00 3.32 3.43 0.00 5.78 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.55 4.49 1.91 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.51 1.07 0.00 0.00 43 Q 7.85 4.26 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 44 L 9.15 4.96 0.00 1.47 1.44 0.82 0.56 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 45 Q 9.33 4.70 0.00 2.10 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 46 L 8.59 5.29 0.00 1.73 1.40 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.57 4.52 0.00 3.90 3.93 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 48 A 8.30 4.49 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 49 E 9.32 3.94 0.00 1.72 1.77 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 2.26 2.32 0.00 50 S 6.56 4.71 0.00 4.11 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 51 V 8.18 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 0.96 0.00 0.00 1.04 0.00 0.00 52 G 9.16 3.89 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 0.00 53 E 8.33 5.24 0.00 1.99 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 54 V 9.01 4.89 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 0.63 0.00 0.00 1.17 0.00 0.00 55 Y 8.79 5.15 0.00 2.99 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 56 I 8.63 4.39 1.75 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.65 0.69 0.00 0.00 57 K 8.89 4.59 0.00 1.28 1.50 0.00 1.24 0.00 0.00 1.17 0.00 0.00 2.66 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.91 0.31 7.81 58 S 8.78 4.47 0.00 3.83 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 59 T 8.54 3.82 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 1.17 0.00 0.00 60 E 8.38 4.03 0.00 1.97 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 2.22 2.35 0.00 61 T 8.00 4.27 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 1.25 0.00 0.00 62 G 8.25 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 63 Q 7.59 4.43 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.73 0.00 0.00 0.00 0.00 0.00 2.54 2.33 0.00 64 Y 8.86 4.78 0.00 2.93 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 65 L 9.02 4.38 0.00 1.61 1.50 0.80 0.33 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 66 A 8.64 5.19 0.55 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 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.70 5.40 0.00 2.20 2.23 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.63 0.00 68 D 9.44 5.42 0.00 3.01 2.94 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 69 T 8.51 4.13 4.36 0.00 0.00 0.00 0.00 0.00 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 70 D 8.39 4.61 0.00 2.77 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 71 G 8.58 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 0.00 0.00 0.00 72 L 7.95 4.77 0.00 2.01 1.60 0.88 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.31 5.12 0.00 1.57 1.61 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 8.73 4.92 0.00 3.11 2.99 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 75 G 9.16 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 0.00 0.00 0.00 0.00 76 S 9.11 5.03 0.00 3.75 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 77 Q 9.01 4.31 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.54 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 78 T 7.70 4.68 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 1.24 0.00 0.00 79 P 0.00 4.02 0.00 1.04 0.49 0.00 3.52 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.35 0.00 80 N 8.17 4.94 0.00 2.90 2.93 0.00 0.00 6.08 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.64 3.91 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 82 E 8.88 4.19 0.00 2.21 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 2.38 2.37 0.00 83 C 7.91 5.05 0.00 3.21 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 84 L 7.00 4.39 0.00 1.34 1.27 0.76 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.91 5.21 0.00 3.12 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 86 L 9.14 4.83 0.00 1.52 1.61 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.73 4.41 0.00 2.14 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 2.17 1.88 0.00 88 R 8.60 4.80 0.00 1.76 1.78 0.00 3.05 0.00 0.00 2.85 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.62 0.00 89 L 8.76 4.73 0.00 1.52 1.70 1.01 0.74 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 90 E 9.07 4.71 0.00 2.25 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 2.31 2.45 0.00 91 E 9.74 4.00 0.00 2.38 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 2.29 2.41 0.00 92 N 8.50 4.32 0.00 2.85 2.89 0.00 0.00 6.86 8.16 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 93 H 8.60 4.82 0.00 2.86 2.97 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.80 4.70 0.00 3.02 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 9.75 5.46 0.00 3.06 2.63 0.00 0.00 6.93 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 96 T 8.88 5.30 4.55 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 0.00 0.00 0.00 1.36 0.00 0.00 97 Y 8.60 4.95 0.00 2.75 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 98 I 8.64 4.60 1.68 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.24 0.67 0.00 0.00 99 S 9.20 4.00 0.00 4.05 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.63 3.84 0.00 1.65 1.61 0.00 1.63 0.00 0.00 1.48 0.00 0.00 2.75 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.21 1.15 7.81 101 A 7.71 3.93 1.05 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 0.00 0.00 102 H 7.79 4.76 0.00 3.15 2.40 0.00 5.63 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.99 4.09 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 0.00 104 E 7.99 4.04 0.00 1.93 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 0.00 2.11 2.15 0.00 105 K 7.50 4.05 0.00 0.79 1.09 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.58 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.03 0.92 7.81 106 N 7.54 3.89 0.00 3.01 3.04 0.00 0.00 6.90 7.82 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 0.00 107 W 7.70 5.05 0.00 3.26 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 0.00 108 F 9.02 5.42 0.00 2.89 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 0.00 109 V 8.91 3.99 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 0.59 0.00 0.00 0.45 0.00 0.00 110 G 8.58 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.47 5.31 0.00 1.45 1.43 0.99 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.14 4.17 0.00 1.94 1.67 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.48 7.81 113 K 8.40 3.93 0.00 1.70 1.84 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.37 7.81 114 N 8.06 4.54 0.00 2.78 2.89 0.00 0.00 6.19 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.25 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.49 4.74 0.00 3.93 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 0.00 117 C 8.29 4.73 0.00 2.88 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.71 4.38 0.00 1.72 1.70 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.37 7.81 119 R 8.31 4.34 0.00 1.63 1.61 0.00 3.06 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 120 G 9.05 3.43 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 0.00 121 P 0.00 4.37 0.00 1.95 2.22 0.00 3.12 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.37 0.00 122 R 7.89 4.42 0.00 1.86 1.93 0.00 3.30 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 123 T 7.58 5.22 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 1.38 0.00 0.00 124 H 7.91 4.72 0.00 3.45 3.53 0.00 5.67 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 0.00 125 Y 8.72 3.92 0.00 3.13 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 0.00 126 G 9.04 4.08 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 0.00 0.00 0.00 127 Q 7.39 4.26 0.00 1.80 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.76 0.00 0.00 0.00 0.00 0.00 2.16 1.96 0.00 128 K 8.33 3.79 0.00 1.76 1.63 0.00 1.55 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.27 7.81 129 A 8.09 3.97 1.20 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 0.00 0.00 130 I 6.71 4.45 1.59 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.81 0.50 0.00 0.00 131 L 7.19 4.40 0.00 1.10 0.63 0.37 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.42 5.52 0.00 3.38 3.10 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 0.00 133 L 9.24 5.23 0.00 1.86 1.68 1.06 1.10 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 0.00 134 P 0.00 5.13 0.00 2.17 2.24 0.00 3.82 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 135 L 9.06 4.90 0.00 1.70 1.65 1.01 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.64 0.00 1.93 1.99 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 137 V 8.18 3.77 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 0.64 0.00 0.00 0.92 0.00 0.00