NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3881 8.3044 120.3494 54.8483 33.4040 174.9536 2 I 3.6460 8.3710 126.2114 61.1454 38.8534 173.2339 3 Q 4.8623 8.3362 124.6277 54.1864 33.6578 173.8229 4 S 5.1116 8.5467 116.0744 56.9322 66.2890 173.2512 5 Q 4.7730 8.9347 121.1874 54.7882 30.1946 175.7232 6 I 4.4249 8.4040 111.9108 60.1266 39.3768 174.7178 7 N 4.8968 7.8375 120.3201 51.0211 41.0047 174.7372 8 R 4.0671 8.6741 123.5144 59.4666 29.3065 178.4291 9 N 4.3547 8.7330 117.4043 55.9232 38.3846 177.1790 10 I 3.6733 7.3377 120.1491 64.7542 37.2036 178.7097 11 R 4.0089 7.8865 118.0715 59.0371 29.9629 179.0199 12 L 3.9929 8.1444 119.1472 57.7116 41.6721 179.1568 13 D 4.3485 8.5328 119.4374 57.1882 40.6637 178.4500 14 L 3.9314 7.9621 120.6440 58.0967 42.0276 178.8311 15 A 4.1713 8.0890 122.1848 54.7734 18.3270 179.2007 16 D 4.3101 8.1429 117.1077 57.5052 40.9122 179.0079 17 A 3.9746 7.9314 120.8277 55.2717 18.4377 179.6409 18 I 3.6731 8.0062 118.5185 64.6891 37.1595 178.7254 19 L 4.1232 8.1809 119.8097 57.5372 41.3121 179.3725 20 L 3.9287 7.9484 120.4638 58.0047 41.9614 178.9116 21 S 4.0259 8.1191 113.0730 61.3130 62.3737 175.8420 22 K 3.7478 8.5255 122.3763 59.5675 31.8313 178.4819 23 A 3.9359 8.1138 120.8433 55.1729 18.1035 179.7753 24 K 3.9494 8.1443 116.1700 59.1351 32.2157 178.8243 25 K 4.2334 8.1956 116.0152 55.2232 32.7086 175.9202 26 D 4.2957 7.6697 117.9810 55.0007 40.2071 173.3153 27 L 4.6187 7.7207 116.1839 53.7872 43.4312 177.5287 28 S 4.5435 8.5217 116.2673 57.0572 66.2573 175.5302 29 F 4.1873 8.2460 120.9211 60.5187 38.4294 177.7680 30 A 4.0780 8.0299 119.3120 55.2840 18.4166 179.0852 31 E 4.0739 8.3463 117.0525 59.5828 29.3165 179.5833 32 I 3.7014 7.5041 118.4271 64.3687 37.1357 177.9795 33 A 4.2874 8.2733 120.5222 52.7536 18.2844 176.7694 34 D 4.4359 7.1793 118.3968 55.5332 41.5372 176.2919 35 G 4.0236 9.1610 114.6166 45.5735 0.0000 173.4699 36 T 4.1048 7.5118 113.3860 61.7497 67.9325 175.9129 37 G 3.9797 8.3597 107.4331 45.3013 0.0000 172.7653 38 L 4.7626 7.4140 117.6312 51.8481 45.2315 176.7934 39 A 4.1941 8.2815 122.8077 51.9045 20.3284 178.4440 40 E 3.8984 8.9080 122.8154 59.6233 29.7097 179.5106 41 A 3.9437 7.9410 120.2014 54.7647 18.5238 179.3412 42 F 3.8854 8.1244 118.8243 61.4742 39.7322 177.4290 43 V 3.6121 8.1141 117.9825 66.2254 31.2932 178.0873 44 T 3.7525 8.0941 115.2599 66.6023 68.3247 176.2623 45 A 3.8170 7.8322 122.3427 55.1143 18.2793 179.4301 46 A 4.0809 7.5486 120.2228 54.8721 18.5714 179.9081 47 L 3.9987 7.9425 117.2557 57.4794 41.4101 178.7567 48 L 4.5671 7.5083 116.5074 54.4153 41.7386 177.4003 49 G 3.9229 8.1034 107.3324 45.5494 0.0000 174.3119 50 Q 4.5039 8.2296 116.2828 55.4926 29.8064 175.0205 51 Q 4.4333 7.4229 115.9286 54.6166 32.9028 172.4673 52 A 4.9411 8.2696 120.7913 50.3834 21.1477 176.3250 53 L 4.6458 8.6887 122.1460 52.9746 43.6183 174.9633 54 P 4.4944 0.0000 0.0000 62.8900 32.3148 177.1356 55 A 3.9828 8.8794 123.7602 55.7846 18.2511 180.1039 56 D 4.2892 8.0673 116.5241 57.3426 40.8948 178.7262 57 A 4.0089 7.9991 120.7432 54.9110 18.5069 179.2631 58 A 3.9551 8.2329 119.4451 55.4074 18.4776 179.9970 59 R 3.8535 8.1653 116.5804 59.2732 30.1615 178.9770 60 L 3.9312 8.0239 119.9140 58.4979 42.1813 179.5630 61 V 3.7919 8.2611 112.7654 64.1760 31.4226 178.7368 62 G 3.6722 8.6846 105.8946 47.7122 0.0000 175.6580 63 A 3.9782 8.0738 122.9704 54.9134 18.2520 179.7249 64 K 3.8801 7.7548 115.6901 59.3884 32.2956 178.6909 65 L 4.3247 7.8467 115.4883 53.5762 42.6056 176.0042 66 D 4.3864 7.6191 117.3927 55.2303 38.6989 173.8371 67 L 4.4141 8.1585 118.1575 53.7585 43.2914 177.8095 68 D 4.7061 8.2359 121.9247 52.9227 41.9175 177.2273 69 E 4.0348 8.5465 118.1330 59.4222 29.4127 179.1017 70 D 4.3569 8.0758 118.6158 57.5134 41.0489 178.9017 71 S 4.1480 8.5438 115.6413 61.7065 62.6260 176.8412 72 I 3.7560 7.5951 121.4313 64.0416 37.0718 177.9742 73 L 4.2381 8.1931 121.4518 58.2866 42.0231 178.8890 74 L 3.9935 8.3455 119.2727 58.0404 41.4829 179.6465 75 L 4.0740 7.9100 118.1173 57.5080 41.2794 179.0871 76 Q 4.5510 7.6887 117.9655 56.4573 29.2417 176.3066 77 M 4.4912 7.1810 119.9101 54.9958 33.0081 176.4839 78 I 4.0139 8.9640 124.6847 60.7359 38.0729 174.1927 79 P 4.6436 0.0000 0.0000 62.3580 32.6517 176.5578 80 L 4.2830 8.3552 123.6160 54.4549 41.2926 176.3963 81 R 4.1469 8.2899 124.5196 55.5098 30.9274 175.1251 82 G 3.0752 8.0601 109.4296 44.8514 0.0000 173.0588 83 C 4.2920 8.0895 122.5958 58.6293 30.6319 174.2326 84 I 4.0294 7.5299 122.1493 60.4477 37.5145 174.7366 85 D 4.5026 8.9454 125.7578 57.1022 41.3642 176.7035 86 D 4.6379 7.2719 115.5276 53.1897 41.4517 174.3723 87 R 4.1886 8.2780 126.2248 56.4809 29.5917 177.1194 88 I 4.0961 7.1800 116.6506 58.2827 39.3730 173.6960 89 P 4.4319 0.0000 0.0000 62.8364 31.8205 176.5835 90 T 4.1474 8.3522 111.7665 63.5151 69.8661 175.4813 91 D 4.4775 7.9838 122.3152 53.2001 42.5039 174.4545 92 P 4.3359 0.0000 0.0000 66.2750 31.2079 178.7237 93 T 3.9604 8.0130 112.5809 67.1229 68.6492 176.1851 94 M 4.4596 8.2258 120.7230 58.3935 31.9228 178.0282 95 Y 4.0482 8.8819 120.2067 60.9134 38.9495 178.2533 96 R 3.8362 8.1003 118.7385 59.6764 29.9949 178.9819 97 F 4.0876 7.9376 117.3870 60.3914 38.8743 177.0643 98 Y 3.8995 7.9530 118.8421 60.6922 38.5145 177.7273 99 E 3.6780 7.9951 120.5097 59.2285 29.6428 178.2490 100 M 4.0488 8.0066 118.3462 58.6732 32.1563 178.2286 101 L 3.9221 7.4250 119.0530 57.9803 41.5669 179.5894 102 Q 3.8055 7.3308 116.7048 58.4611 28.5962 178.6051 103 V 3.6547 7.8149 118.7885 65.1042 32.0625 176.8279 104 Y 4.6967 8.1426 114.0686 57.4224 38.6307 177.7766 105 G 3.6721 8.2480 108.9389 48.2045 0.0000 176.1076 106 T 3.9960 7.8376 111.8068 64.5308 68.8062 176.7662 107 T 3.9403 7.8771 118.4112 66.2559 68.5255 176.4091 108 L 3.9705 8.3247 121.3825 57.7331 41.7196 179.1771 109 K 3.7048 8.0791 119.0601 59.6526 32.0865 178.2874 110 A 4.0307 8.1161 120.6722 55.4575 18.3564 179.6796 111 L 4.0123 8.3520 117.7474 57.6284 41.6251 179.7749 112 V 3.8089 8.1627 118.7260 66.5213 30.9926 177.9080 113 H 5.0138 8.2366 117.2497 58.2998 28.2969 177.4812 114 E 3.9417 8.1438 120.2930 59.3611 29.6210 178.7601 115 K 3.9455 8.4356 117.5097 58.0773 32.1556 177.4105 116 F 4.1150 9.3155 115.3677 59.5839 41.1431 175.7688 117 G 3.9149 7.7226 105.2984 43.3729 0.0000 171.0016 118 D 4.7185 8.6721 120.4592 52.8940 42.2099 176.5053 119 G 4.0444 7.7844 114.2140 46.3744 0.0000 171.1297 120 I 4.8060 7.8083 114.7755 59.2107 41.7242 174.7852 121 I 4.6648 8.2214 123.7512 59.9651 37.9687 175.7725 122 A 4.1173 9.1473 129.9474 52.0661 18.7456 177.0928 123 A 3.8574 8.5121 122.8506 51.9668 19.4648 177.6045 124 I 4.1775 7.2894 116.5525 63.7050 38.7172 177.1048 125 N 4.8255 7.6840 121.6333 52.8871 37.0515 171.5729 126 F 5.3923 8.0656 122.3120 56.2552 43.2625 173.0859 127 K 4.6838 8.3746 124.9315 54.3859 35.5973 175.2270 128 L 5.6790 8.4266 123.1324 53.4533 43.9725 175.0311 129 D 4.7332 8.3292 117.7797 52.2935 42.8629 173.8091 130 V 4.7314 8.3626 120.2057 61.1393 33.7005 174.6528 131 K 4.6833 8.9535 127.1487 54.3964 35.3266 175.0229 132 K 4.7796 8.6607 125.9908 55.6247 32.8229 175.9174 133 V 4.5808 8.8699 126.4698 60.8698 35.1222 174.3364 134 A 4.0573 8.7363 129.1457 52.1513 19.4706 175.9743 135 D 4.8042 9.0968 121.5319 52.3412 42.2060 175.9564 136 P 4.4996 0.0000 0.0000 65.2987 31.5820 176.7361 137 E 4.2166 8.4694 117.6406 56.3517 29.4371 177.3541 138 G 3.8613 8.1281 106.5019 46.7347 0.0000 175.2952 139 G 3.8219 8.6515 108.2418 44.1980 0.0000 171.5981 140 E 5.1619 8.4382 116.6300 54.5660 32.5491 175.9916 141 R 4.7595 9.9704 121.6116 54.3674 33.4211 174.6214 142 A 4.9413 8.5737 124.6270 50.6872 20.7678 176.6450 143 V 4.2434 8.8561 122.8648 61.2419 33.8355 174.1881 144 I 4.7576 8.3916 129.1587 60.4166 38.7520 175.4981 145 T 4.5068 8.6701 123.6026 61.7894 71.0861 173.1811 146 L 4.5198 8.5943 127.3541 53.3995 43.1387 176.0523 147 D 4.7233 8.3571 125.3980 52.2753 42.7702 174.6267 148 G 4.9838 8.4405 111.7570 43.6627 0.0000 170.5429 149 K 4.3350 8.5712 123.4291 56.1800 34.0133 175.0925 150 Y 4.7396 8.6140 128.2502 57.2874 40.4277 173.7380 151 L 4.4233 8.5800 127.2806 51.9299 44.1687 174.3785 152 P 4.6973 0.0000 0.0000 62.3014 32.6419 175.8165 153 T 4.5959 9.0833 118.7148 62.0313 70.2367 174.0818 154 K 4.6890 8.5537 125.2390 53.3792 35.5403 174.3024 155 P 4.2922 0.0000 0.0000 63.0792 31.9342 176.5577 156 F 4.5566 7.7235 114.0738 57.1622 37.9771 174.6721 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 M 8.30 4.39 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.37 3.65 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.05 0.91 0.00 0.00 3 Q 8.34 4.86 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.61 0.00 0.00 0.00 0.00 0.00 2.50 2.27 0.00 4 S 8.55 5.11 0.00 3.80 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.93 4.77 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 6 I 8.40 4.42 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 1.30 0.66 0.91 0.00 0.00 7 N 7.84 4.90 0.00 2.76 2.67 0.00 0.00 6.93 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.67 4.07 0.00 2.06 2.30 0.00 3.12 0.00 0.00 3.32 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.73 4.35 0.00 2.85 2.91 0.00 0.00 6.86 7.26 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 10 I 7.34 3.67 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 1.52 0.84 0.91 0.00 0.00 11 R 7.89 4.01 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.46 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.14 3.99 0.00 1.69 1.71 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.53 4.35 0.00 2.92 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 14 L 7.96 3.93 0.00 1.77 1.87 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.09 4.17 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 16 D 8.14 4.31 0.00 2.91 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 17 A 7.93 3.97 1.40 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 18 I 8.01 3.67 2.12 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.65 0.96 0.00 0.00 19 L 8.18 4.12 0.00 1.87 1.75 0.99 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.95 3.93 0.00 1.78 1.80 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.12 4.03 0.00 3.93 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 22 K 8.53 3.75 0.00 1.77 1.91 0.00 1.18 0.00 0.00 1.20 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 1.23 7.81 23 A 8.11 3.94 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 24 K 8.14 3.95 0.00 1.87 1.87 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.59 7.81 25 K 8.20 4.23 0.00 1.67 1.81 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.54 7.81 26 D 7.67 4.30 0.00 2.75 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 27 L 7.72 4.62 0.00 1.54 1.44 1.02 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.52 4.54 0.00 4.03 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 29 F 8.25 4.19 0.00 3.21 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.03 4.08 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 31 E 8.35 4.07 0.00 2.16 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 2.32 2.34 0.00 32 I 7.50 3.70 2.04 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.53 0.96 0.00 0.00 33 A 8.27 4.29 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 34 D 7.18 4.44 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 35 G 9.16 4.02 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 0.00 0.00 0.00 36 T 7.51 4.10 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 37 G 8.36 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 38 L 7.41 4.76 0.00 1.70 1.64 1.06 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.28 4.19 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 40 E 8.91 3.90 0.00 2.08 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 2.43 2.48 0.00 41 A 7.94 3.94 1.32 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 0.00 0.00 42 F 8.12 3.89 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 43 V 8.11 3.61 2.16 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 1.04 0.00 0.00 1.08 0.00 0.00 44 T 8.09 3.75 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 0.43 0.00 0.00 45 A 7.83 3.82 1.21 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 46 A 7.55 4.08 1.17 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 0.00 0.00 47 L 7.94 4.00 0.00 1.89 1.80 1.14 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.51 4.57 0.00 1.65 1.62 0.72 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 49 G 8.10 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 50 Q 8.23 4.50 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.50 6.61 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 51 Q 7.42 4.43 0.00 1.41 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.88 0.00 0.00 0.00 0.00 0.00 2.06 1.53 0.00 52 A 8.27 4.94 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 53 L 8.69 4.65 0.00 1.64 1.65 0.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.49 0.00 2.10 2.01 0.00 3.74 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.15 0.00 55 A 8.88 3.98 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 56 D 8.07 4.29 0.00 2.71 2.74 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 0.00 0.00 0.00 0.00 57 A 8.00 4.01 1.37 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 0.00 0.00 58 A 8.23 3.96 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 59 R 8.17 3.85 0.00 2.08 2.00 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 60 L 8.02 3.93 0.00 1.87 1.84 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.26 3.79 2.11 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 0.92 0.00 0.00 1.02 0.00 0.00 62 G 8.68 3.67 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 0.00 0.00 0.00 63 A 8.07 3.98 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 64 K 7.75 3.88 0.00 1.91 1.89 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.72 7.81 65 L 7.85 4.32 0.00 1.73 1.69 0.93 0.91 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 66 D 7.62 4.39 0.00 2.83 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 67 L 8.16 4.41 0.00 1.59 1.59 0.93 1.01 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 68 D 8.24 4.71 0.00 2.95 2.83 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 69 E 8.55 4.03 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 70 D 8.08 4.36 0.00 2.72 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.54 4.15 0.00 4.05 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 72 I 7.60 3.76 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.56 0.97 0.00 0.00 73 L 8.19 4.24 0.00 1.86 1.89 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.35 3.99 0.00 1.84 1.71 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.91 4.07 0.00 1.92 1.73 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.69 4.55 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.86 0.00 0.00 0.00 0.00 0.00 2.56 2.37 0.00 77 M 7.18 4.49 0.00 1.93 2.11 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 2.85 2.53 0.00 78 I 8.96 4.01 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.83 0.92 0.00 0.00 79 P 0.00 4.64 0.00 2.12 2.04 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 80 L 8.36 4.28 0.00 1.67 1.65 0.91 0.93 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 81 R 8.29 4.15 0.00 1.82 1.81 0.00 3.25 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 82 G 8.06 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 0.00 0.00 0.00 83 C 8.09 4.29 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 84 I 7.53 4.03 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.54 0.92 0.00 0.00 85 D 8.95 4.50 0.00 2.62 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 D 7.27 4.64 0.00 2.60 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 8.28 4.19 0.00 1.98 2.04 0.00 3.19 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 88 I 7.18 4.10 1.72 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.75 0.49 0.00 0.00 89 P 0.00 4.43 0.00 2.19 2.05 0.00 3.38 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 90 T 8.35 4.15 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 91 D 7.98 4.48 0.00 2.85 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 92 P 0.00 4.34 0.00 2.24 2.14 0.00 3.69 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 93 T 8.01 3.96 4.48 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 1.35 0.00 0.00 94 M 8.23 4.46 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.58 0.00 95 Y 8.88 4.05 0.00 3.22 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 96 R 8.10 3.84 0.00 1.55 1.70 0.00 3.35 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.79 0.00 97 F 7.94 4.09 0.00 3.25 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 7.95 3.90 0.00 2.97 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.00 3.68 0.00 1.84 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 2.28 2.33 0.00 100 M 8.01 4.05 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.86 0.00 101 L 7.42 3.92 0.00 1.38 1.51 0.88 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.33 3.81 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.92 0.00 0.00 0.00 0.00 0.00 1.76 2.35 0.00 103 V 7.81 3.65 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 0.19 0.00 0.00 0.88 0.00 0.00 104 Y 8.14 4.70 0.00 3.20 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 0.00 105 G 8.25 3.67 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 0.00 0.00 0.00 106 T 7.84 4.00 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 1.20 0.00 0.00 107 T 7.88 3.94 4.59 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 1.33 0.00 0.00 108 L 8.32 3.97 0.00 1.85 1.73 0.95 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.08 3.70 0.00 1.82 2.01 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.47 7.81 110 A 8.12 4.03 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.35 4.01 0.00 1.75 1.75 0.94 0.70 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 0.00 112 V 8.16 3.81 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 1.08 0.00 0.00 0.95 0.00 0.00 113 H 8.24 5.01 0.00 3.25 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.14 3.94 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 115 K 8.44 3.95 0.00 1.68 1.21 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.49 7.81 116 F 9.32 4.11 0.00 2.52 1.45 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 0.00 117 G 7.72 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 0.00 118 D 8.67 4.72 0.00 2.75 2.78 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 0.00 0.00 0.00 119 G 7.78 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 0.00 0.00 0.00 120 I 7.81 4.81 1.86 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 1.19 1.20 0.93 0.00 0.00 121 I 8.22 4.66 1.82 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.68 0.91 0.00 0.00 122 A 9.15 4.12 1.21 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 0.00 123 A 8.51 3.86 0.94 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 0.00 124 I 7.29 4.18 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.91 0.93 0.00 0.00 125 N 7.68 4.83 0.00 2.80 2.75 0.00 0.00 6.40 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 0.00 126 F 8.07 5.39 0.00 2.87 2.89 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 0.00 127 K 8.37 4.68 0.00 1.52 1.50 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 1.25 7.81 128 L 8.43 5.68 0.00 1.57 1.08 1.08 0.81 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 0.00 129 D 8.33 4.73 0.00 2.67 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 0.00 130 V 8.36 4.73 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 0.88 0.00 0.00 0.91 0.00 0.00 131 K 8.95 4.68 0.00 1.83 1.66 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.49 7.81 132 K 8.66 4.78 0.00 1.78 1.72 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.44 7.81 133 V 8.87 4.58 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 0.90 0.00 0.00 0.94 0.00 0.00 134 A 8.74 4.06 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 0.00 135 D 9.10 4.80 0.00 2.72 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 0.00 136 P 0.00 4.50 0.00 2.22 2.17 0.00 3.81 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 137 E 8.47 4.22 0.00 2.05 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 2.33 2.40 0.00 138 G 8.13 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 0.00 139 G 8.65 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 0.00 140 E 8.44 5.16 0.00 1.84 1.85 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 2.21 2.30 0.00 141 R 9.97 4.76 0.00 1.84 1.80 0.00 3.25 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 142 A 8.57 4.94 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 0.00 143 V 8.86 4.24 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 1.05 0.00 0.00 0.94 0.00 0.00 144 I 8.39 4.76 2.01 0.00 0.00 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 1.51 0.66 0.96 0.00 0.00 145 T 8.67 4.51 4.43 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 1.17 0.00 0.00 146 L 8.59 4.52 0.00 1.67 2.06 1.04 1.22 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 0.00 147 D 8.36 4.72 0.00 2.61 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.44 4.98 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 0.00 149 K 8.57 4.34 0.00 1.93 1.70 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.51 1.51 7.81 150 Y 8.61 4.74 0.00 2.61 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 0.00 151 L 8.58 4.42 0.00 1.39 1.38 0.86 0.66 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 0.00 152 P 0.00 4.70 0.00 2.04 2.01 0.00 3.07 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 1.88 1.74 0.00 153 T 9.08 4.60 4.29 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 1.26 0.00 0.00 154 K 8.55 4.69 0.00 1.75 1.71 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.44 7.81 155 P 0.00 4.29 0.00 2.01 1.92 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 156 F 7.72 4.56 0.00 3.03 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00