NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4375 0.0000 0.0000 62.2628 32.6353 175.7162 2 I 3.8167 8.2001 120.9616 60.6778 37.6579 170.7881 3 V 4.5350 8.5359 118.9249 59.7097 35.0592 175.3598 4 D 4.9203 8.5292 120.4457 53.1294 39.7635 175.3940 5 T 4.6723 7.3978 114.2715 63.4812 73.5360 176.0382 6 G 3.8082 8.7096 110.7742 46.6573 0.0000 174.2855 7 S 4.6635 8.3556 117.5885 56.5798 65.5531 173.2489 8 V 4.4564 7.9145 116.4376 58.9088 34.9144 175.8121 9 A 4.1095 8.3796 125.4227 51.3923 18.8544 175.8145 10 P 4.3755 0.0000 0.0000 62.6325 32.0260 175.9925 11 L 4.5217 8.0941 119.9449 54.0808 42.6773 177.9527 12 S 4.4792 9.2713 118.8810 57.5885 65.6259 175.2465 13 A 3.9464 8.5759 124.3412 55.3647 18.0718 180.0793 14 A 3.9519 7.9062 118.7189 55.4361 18.5274 179.5780 15 E 3.9660 8.1868 117.1458 59.4827 29.4415 179.6717 16 K 3.9472 8.2826 118.6610 59.7572 32.1388 179.4826 17 T 3.8908 7.8075 115.4173 66.5998 68.3274 176.8715 18 K 4.0148 7.9357 119.8299 59.4269 32.0021 179.2904 19 I 3.8998 8.0161 120.1698 64.8081 37.1287 178.4797 20 R 4.0848 8.3488 118.8798 59.5499 29.6536 179.3820 21 S 4.1388 7.8639 113.4273 61.7537 62.3361 176.3594 22 A 4.1301 8.4443 123.7463 54.6643 17.9328 179.6315 23 W 4.1542 8.9539 127.2097 60.9947 30.8845 178.0904 24 A 4.0131 8.2035 120.8150 54.8833 17.6312 177.7834 25 P 4.0961 0.0000 0.0000 65.5576 31.6760 178.7520 26 V 3.5316 6.9020 113.7236 66.2538 31.2352 177.5647 27 Y 3.8924 7.1547 117.6901 60.2074 38.5549 177.1492 28 S 4.1638 7.6223 113.9846 60.4376 63.3467 174.1480 29 T 4.4680 7.5389 111.3129 59.6215 68.7375 174.9300 30 Y 4.1557 7.5561 121.7602 61.4468 37.7086 177.6092 31 E 4.0517 7.3334 119.6313 58.9591 29.4838 178.9411 32 T 4.0183 7.7302 115.4790 65.9961 69.0154 176.9962 33 S 4.2060 8.0436 116.5940 61.7647 62.8894 176.6535 34 G 3.9261 8.4158 108.4346 48.2726 0.0000 175.6804 35 V 3.6626 7.4075 120.6643 65.6000 31.4909 177.9035 36 D 4.3465 8.2756 118.6675 57.4235 40.7391 178.6480 37 I 3.7811 8.0849 120.6329 64.5006 37.0696 178.3272 38 L 4.1679 8.2070 121.0931 58.1733 41.9823 179.1149 39 V 3.5806 8.3171 118.7784 65.6200 31.4559 177.9983 40 K 3.9551 8.5934 119.9237 59.4660 31.9235 178.4691 41 F 4.1936 8.1440 119.4503 61.3182 39.0953 176.5323 42 F 3.7731 8.5350 120.5662 61.4284 39.0066 177.2478 43 T 3.8534 7.9043 108.3071 64.2163 68.6790 175.6477 44 S 4.5501 7.6152 113.9200 58.0413 65.1196 174.5890 45 T 4.5090 6.9209 117.7417 60.1807 68.9428 172.2458 46 P 4.0669 0.0000 0.0000 65.8459 31.6217 177.9800 47 A 4.0411 7.9563 117.3206 54.5891 18.7400 178.4178 48 A 4.1190 7.7359 117.5153 52.9120 19.0878 179.2500 49 Q 4.2109 7.7301 117.8180 58.6158 28.5338 178.1765 50 E 4.0183 8.0775 116.1656 58.3287 29.6080 177.2557 51 F 4.4909 7.8896 116.9212 57.7288 39.6415 176.2408 52 F 4.5510 8.1923 120.6896 54.3924 38.7545 173.7148 53 P 4.2524 0.0000 0.0000 65.6880 31.6593 178.8865 54 K 4.2773 8.0000 113.7627 58.0841 32.1246 177.2351 55 F 5.0009 8.4043 118.0529 56.7646 39.4227 175.6691 56 K 4.1487 7.8690 121.1025 58.4930 32.4036 175.2423 57 G 4.3114 9.0855 111.2959 45.6796 0.0000 174.3538 58 L 4.1805 7.5137 119.2244 54.9713 42.0374 175.8262 59 T 4.6912 8.2343 112.5375 62.3965 72.0182 174.9933 60 T 3.9982 7.7506 113.9587 60.7956 70.8735 174.8139 61 A 4.0470 8.5212 124.1834 54.8459 18.2274 179.7690 62 D 4.2284 7.9111 116.0235 57.4230 41.7713 177.7814 63 Q 4.1006 8.4227 118.9852 58.9541 28.7476 178.6139 64 L 3.6503 7.4936 119.7637 57.9091 41.5431 179.7845 65 K 3.8914 7.6392 116.3920 58.7771 32.0731 178.4250 66 K 4.3043 7.4754 117.0747 56.1334 33.4005 176.9305 67 S 4.1391 7.5295 115.1180 57.8270 62.9997 174.8695 68 A 4.1413 8.6098 129.1786 54.9606 18.1672 179.5072 69 D 4.5115 7.8330 116.9107 57.5868 40.9302 179.0366 70 V 3.5570 7.6113 118.2166 66.0896 31.5189 178.1015 71 R 4.0179 7.9220 117.4503 58.9420 29.9009 178.9453 72 W 4.7101 8.5138 128.2137 60.9628 30.8001 177.5145 73 H 3.9964 8.5492 118.0661 59.2955 29.2457 177.0989 74 A 4.1274 8.3931 122.6092 55.2336 18.2897 179.5147 75 E 4.1257 8.6078 117.3111 59.4530 29.2953 179.9034 76 R 3.6497 7.5239 117.3961 59.0993 30.5238 178.7276 77 I 3.8533 7.6693 119.5234 64.5993 37.2329 178.3917 78 I 3.9376 8.0748 119.3571 64.1993 37.8027 177.3900 79 N 4.5519 8.1986 116.2628 55.2859 38.3976 177.4030 80 A 3.9171 7.7563 122.6045 55.0493 18.4285 179.6908 81 V 3.3086 7.7284 116.3308 66.1040 31.5006 177.4566 82 N 3.9478 7.9348 116.2068 56.7278 38.4726 176.5016 83 D 4.2179 7.7818 119.0519 57.1534 41.1185 178.3168 84 A 3.9730 7.6385 121.2178 55.1313 17.8569 179.7540 85 V 3.2380 7.6336 116.8300 65.9985 31.3074 177.7223 86 A 4.2009 8.0209 118.4183 53.5829 18.4859 177.9321 87 S 4.6204 7.7121 112.8145 58.2134 63.6157 175.8562 88 M 4.1582 7.5322 121.0907 58.0988 31.6859 177.0623 89 D 4.6423 7.8974 115.9361 54.8090 42.0458 176.1929 90 D 4.7315 8.3195 119.1544 51.3853 41.2475 175.4274 91 T 3.8707 7.8500 116.9106 64.3752 67.7546 174.5473 92 E 3.9216 8.1158 121.1799 59.0349 29.9193 178.3721 93 K 3.9238 8.0490 119.5602 59.5796 32.3636 178.3422 94 M 3.9495 7.9842 118.5567 58.7504 32.0698 178.4483 95 S 4.0158 7.8753 114.5613 61.8331 63.0699 176.1749 96 M 3.9229 7.7044 120.8304 58.5733 31.8737 178.7979 97 K 3.8744 7.8193 118.8319 59.5879 32.3732 178.8391 98 L 3.9392 7.7324 118.6922 57.7492 41.5686 179.5572 99 R 3.9083 8.4501 118.4323 59.1812 29.8613 178.5297 100 D 4.2617 8.0290 117.7797 57.3979 41.3583 178.1850 101 L 3.9984 7.7365 120.5276 57.9456 42.0130 178.8555 102 S 4.1513 8.5359 113.8102 61.3044 62.3468 176.2499 103 G 3.5601 8.0398 108.3366 47.8553 0.0000 175.7161 104 K 3.6215 7.7074 120.5794 59.3420 31.9653 179.2305 105 H 4.3079 8.1446 116.0496 58.6676 28.4245 177.7738 106 A 3.5724 7.5501 121.6467 54.6954 18.3714 179.3490 107 K 4.0583 8.0382 115.7198 57.7784 32.3921 177.5551 108 S 4.5207 7.3193 111.7157 60.1637 64.7308 175.6611 109 F 4.5026 7.3895 117.3617 58.7027 39.2873 175.6011 110 Q 3.4990 7.9328 118.1226 56.8965 25.8666 173.7486 111 V 4.0141 7.7586 109.6102 59.3123 33.8997 176.4797 112 D 4.1822 6.9300 123.3080 53.5553 41.3421 175.3285 113 P 3.3329 0.0000 0.0000 64.3331 31.3541 178.2239 114 Q 3.6710 7.5651 117.1743 58.8706 28.7783 177.5584 115 Y 4.2999 6.9892 114.5078 59.4625 37.8780 177.3523 116 F 4.4098 7.0734 119.6395 60.8322 39.1074 177.7872 117 K 4.0667 8.0995 117.4749 59.6389 31.9999 179.2676 118 V 3.6695 7.7141 119.1686 65.9646 31.6317 177.6566 119 L 3.7787 8.0913 119.9511 57.8736 41.8014 178.5691 120 A 4.0259 8.2520 120.6822 55.0946 18.1480 179.4836 121 A 4.0132 8.1566 119.2725 55.3889 18.5076 180.0116 122 V 3.6392 7.6244 115.7983 66.3274 31.6149 178.3566 123 I 3.9105 8.0416 119.4121 64.2498 36.9294 178.3464 124 A 4.3730 8.3593 121.8614 55.1967 18.0393 179.3587 125 D 4.3395 8.2894 116.7098 57.9147 41.0457 178.8533 126 T 4.0172 7.6230 114.5723 66.6179 68.5460 176.7123 127 V 3.7295 7.5939 118.3620 64.6785 33.3005 177.0456 128 A 4.5175 7.6379 120.7450 50.0939 20.0802 174.3825 129 A 4.2023 7.8550 123.2219 53.3582 19.2336 177.9290 130 G 4.0816 8.9935 111.2907 45.7767 0.0000 173.9517 131 D 4.4258 8.0429 119.6711 54.1162 42.0276 176.7509 132 A 4.1592 8.7766 129.4366 54.9362 18.6150 179.3049 133 G 3.6744 8.1699 103.9389 48.2466 0.0000 175.5172 134 F 4.0961 8.7615 123.5710 60.8199 39.4424 177.0518 135 E 4.0503 8.1279 118.3209 58.9597 29.2667 179.2081 136 K 3.9127 8.1487 120.2165 59.2768 32.2473 178.7043 137 L 3.7970 7.5849 120.6218 58.3084 41.8961 178.8999 138 M 3.8980 7.7414 118.6372 58.0987 31.7198 178.9669 139 S 4.2928 7.6776 116.7830 61.2035 62.9805 176.4532 140 M 3.9744 7.7999 121.1663 58.4793 31.6393 178.9137 141 I 3.5707 7.3808 119.3756 64.5530 37.0371 178.3910 142 C 3.9933 8.1408 117.6308 62.7205 27.7195 176.1752 143 I 3.8477 7.8084 120.9210 64.4397 36.9629 178.2168 144 L 4.1047 7.8882 119.8302 57.5665 41.2630 179.3316 145 L 3.8960 7.8174 117.7637 56.5211 41.8119 178.4970 146 R 4.7912 7.4785 117.0393 56.1456 30.4129 178.0349 147 S 4.2168 7.9410 114.6582 60.8494 63.0007 174.9364 148 A 4.2711 8.2157 124.1248 53.2155 19.1845 176.7170 149 Y 4.1436 7.9339 117.9746 58.2200 37.9372 175.3909 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 P 0.00 4.44 0.00 2.20 2.14 0.00 3.73 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 1.89 2.00 0.00 2 I 8.20 3.82 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.68 0.89 0.00 0.00 3 V 8.54 4.54 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 0.81 0.00 0.00 0.90 0.00 0.00 4 D 8.53 4.92 0.00 2.74 2.69 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 5 T 7.40 4.67 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 1.20 0.00 0.00 6 G 8.71 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 7 S 8.36 4.66 0.00 3.75 3.66 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 8 V 7.91 4.46 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 0.75 0.00 0.00 0.88 0.00 0.00 9 A 8.38 4.11 1.22 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 0.00 0.00 10 P 0.00 4.38 0.00 2.03 2.00 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 11 L 8.09 4.52 0.00 1.59 1.57 0.84 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 12 S 9.27 4.48 0.00 4.00 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 13 A 8.58 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 14 A 7.91 3.95 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 15 E 8.19 3.97 0.00 2.18 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 2.35 2.36 0.00 16 K 8.28 3.95 0.00 1.94 1.86 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.71 7.81 17 T 7.81 3.89 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 1.24 0.00 0.00 18 K 7.94 4.01 0.00 2.00 1.91 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.71 7.81 19 I 8.02 3.90 2.11 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 1.79 1.03 1.03 0.00 0.00 20 R 8.35 4.08 0.00 2.05 2.08 0.00 3.17 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.99 0.00 21 S 7.86 4.14 0.00 4.09 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 22 A 8.44 4.13 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 23 W 8.95 4.15 0.00 3.61 3.30 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 24 A 8.20 4.01 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 0.00 0.00 25 P 0.00 4.10 0.00 1.97 2.08 0.00 3.76 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 2.01 2.13 0.00 26 V 6.90 3.53 1.57 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 0.71 0.00 0.00 0.85 0.00 0.00 27 Y 7.15 3.89 0.00 1.88 2.69 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 28 S 7.62 4.16 0.00 4.10 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 29 T 7.54 4.47 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 30 Y 7.56 4.16 0.00 3.16 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 7.33 4.05 0.00 1.86 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 1.69 2.01 0.00 32 T 7.73 4.02 4.17 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 1.18 0.00 0.00 33 S 8.04 4.21 0.00 3.86 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 34 G 8.42 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 0.00 0.00 0.00 35 V 7.41 3.66 2.20 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 1.03 0.00 0.00 1.04 0.00 0.00 36 D 8.28 4.35 0.00 2.91 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 37 I 8.08 3.78 2.12 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.22 1.03 0.00 0.00 38 L 8.21 4.17 0.00 1.93 1.78 1.10 0.90 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 39 V 8.32 3.58 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 0.94 0.00 0.00 0.89 0.00 0.00 40 K 8.59 3.96 0.00 2.02 2.05 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.49 7.81 41 F 8.14 4.19 0.00 3.16 3.42 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 42 F 8.53 3.77 0.00 2.96 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 43 T 7.90 3.85 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 1.39 0.00 0.00 44 S 7.62 4.55 0.00 4.05 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 45 T 6.92 4.51 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 46 P 0.00 4.07 0.00 2.06 2.01 0.00 3.50 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 2.03 2.03 0.00 47 A 7.96 4.04 1.43 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 48 A 7.74 4.12 0.67 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 49 Q 7.73 4.21 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 1.16 1.71 0.00 50 E 8.08 4.02 0.00 1.82 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 1.57 1.47 0.00 51 F 7.89 4.49 0.00 3.09 2.92 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 F 8.19 4.55 0.00 3.07 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 0.00 0.00 0.00 53 P 0.00 4.25 0.00 2.16 2.13 0.00 3.49 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 54 K 8.00 4.28 0.00 1.81 2.19 0.00 1.77 0.00 0.00 1.80 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.45 7.81 55 F 8.40 5.00 0.00 3.14 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 56 K 7.87 4.15 0.00 1.83 1.83 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.73 7.81 57 G 9.09 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 0.00 0.00 0.00 0.00 58 L 7.51 4.18 0.00 1.77 1.50 0.83 0.93 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 59 T 8.23 4.69 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 1.26 0.00 0.00 60 T 7.75 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 1.21 0.00 0.00 61 A 8.52 4.05 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 62 D 7.91 4.23 0.00 2.67 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 63 Q 8.42 4.10 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.54 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 64 L 7.49 3.65 0.00 1.65 1.43 0.85 0.46 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 65 K 7.64 3.89 0.00 1.72 1.86 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.67 7.81 66 K 7.48 4.30 0.00 1.86 1.82 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.50 7.81 67 S 7.53 4.14 0.00 3.73 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 68 A 8.61 4.14 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 69 D 7.83 4.51 0.00 2.92 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 70 V 7.61 3.56 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 -0.17 0.00 0.00 71 R 7.92 4.02 0.00 2.15 2.25 0.00 3.21 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 72 W 8.51 4.71 0.00 3.48 3.30 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 73 H 8.55 4.00 0.00 3.60 3.66 0.00 5.66 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 74 A 8.39 4.13 1.53 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 75 E 8.61 4.13 0.00 2.51 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 0.00 2.82 2.62 0.00 76 R 7.52 3.65 0.00 1.55 1.69 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.00 77 I 7.67 3.85 1.95 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.45 0.97 0.00 0.00 78 I 8.07 3.94 2.26 0.00 0.00 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 1.75 1.81 1.14 0.00 0.00 79 N 8.20 4.55 0.00 2.96 2.80 0.00 0.00 6.81 7.30 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 80 A 7.76 3.92 1.35 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 0.00 0.00 81 V 7.73 3.31 2.27 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 0.50 0.00 0.00 0.95 0.00 0.00 82 N 7.93 3.95 0.00 2.91 2.80 0.00 0.00 7.25 8.94 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 83 D 7.78 4.22 0.00 2.81 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 84 A 7.64 3.97 1.15 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 0.00 0.00 85 V 7.63 3.24 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 0.83 0.00 0.00 -0.06 0.00 0.00 86 A 8.02 4.20 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 87 S 7.71 4.62 0.00 3.87 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 88 M 7.53 4.16 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.41 0.00 89 D 7.90 4.64 0.00 2.64 2.69 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 90 D 8.32 4.73 0.00 2.56 2.44 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 91 T 7.85 3.87 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 1.18 0.00 0.00 92 E 8.12 3.92 0.00 2.05 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 2.35 2.33 0.00 93 K 8.05 3.92 0.00 1.92 1.89 0.00 1.68 0.00 0.00 1.54 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.41 7.81 94 M 7.98 3.95 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 95 S 7.88 4.02 0.00 4.06 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 96 M 7.70 3.92 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.54 0.00 97 K 7.82 3.87 0.00 1.98 1.75 0.00 1.59 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 1.40 1.46 7.81 98 L 7.73 3.94 0.00 1.76 1.58 0.79 0.77 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 99 R 8.45 3.91 0.00 1.75 1.94 0.00 3.09 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 100 D 8.03 4.26 0.00 2.90 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.74 4.00 0.00 1.97 1.82 1.04 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.54 4.15 0.00 3.97 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 0.00 103 G 8.04 3.56 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 0.00 104 K 7.71 3.62 0.00 1.71 1.00 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.26 1.54 7.81 105 H 8.14 4.31 0.00 3.68 3.85 0.00 5.80 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 0.00 106 A 7.55 3.57 0.31 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 0.00 0.00 0.00 107 K 8.04 4.06 0.00 1.60 1.75 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.30 7.81 108 S 7.32 4.52 0.00 3.23 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 F 7.39 4.50 0.00 3.17 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 0.00 110 Q 7.93 3.50 0.00 2.30 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.55 0.00 111 V 7.76 4.01 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.04 0.00 0.00 112 D 6.93 4.18 0.00 2.29 2.33 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 0.00 113 P 0.00 3.33 0.00 1.70 0.49 0.00 3.48 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.45 0.00 114 Q 7.57 3.67 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.03 0.00 0.00 0.00 0.00 0.00 1.72 1.16 0.00 115 Y 6.99 4.30 0.00 3.06 3.27 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 0.00 116 F 7.07 4.41 0.00 3.14 2.92 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 0.00 117 K 8.10 4.07 0.00 2.00 2.08 0.00 1.50 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.60 1.49 7.81 118 V 7.71 3.67 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 1.42 0.00 0.00 1.06 0.00 0.00 119 L 8.09 3.78 0.00 0.47 1.33 0.75 0.86 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 0.00 120 A 8.25 4.03 1.43 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 0.00 121 A 8.16 4.01 1.49 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 0.00 0.00 122 V 7.62 3.64 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.21 0.00 0.00 123 I 8.04 3.91 2.21 0.00 0.00 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 1.61 0.81 1.29 0.00 0.00 124 A 8.36 4.37 1.63 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 0.00 0.00 125 D 8.29 4.34 0.00 2.84 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 T 7.62 4.02 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 1.23 0.00 0.00 127 V 7.59 3.73 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 0.63 0.00 0.00 1.30 0.00 0.00 128 A 7.64 4.52 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.85 4.20 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 0.00 130 G 8.99 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 0.00 131 D 8.04 4.43 0.00 2.86 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 0.00 132 A 8.78 4.16 1.35 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 0.00 0.00 133 G 8.17 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 0.00 134 F 8.76 4.10 0.00 3.31 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 0.00 135 E 8.13 4.05 0.00 2.24 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 2.42 2.61 0.00 136 K 8.15 3.91 0.00 1.90 1.95 0.00 1.60 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.40 7.81 137 L 7.58 3.80 0.00 1.49 1.30 0.38 0.78 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 0.00 138 M 7.74 3.90 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.27 0.00 139 S 7.68 4.29 0.00 4.02 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 0.00 140 M 7.80 3.97 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.51 0.00 141 I 7.38 3.57 1.86 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.56 0.73 0.00 0.00 142 C 8.14 3.99 0.00 2.92 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 0.00 143 I 7.81 3.85 1.94 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 1.47 0.57 0.93 0.00 0.00 144 L 7.89 4.10 0.00 1.59 1.62 0.83 0.60 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 0.00 145 L 7.82 3.90 0.00 1.18 0.35 0.27 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 146 R 7.48 4.79 0.00 1.85 1.98 0.00 3.30 0.00 0.00 3.46 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 147 S 7.94 4.22 0.00 4.03 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 0.00 148 A 8.22 4.27 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 0.00 149 Y 7.93 4.14 0.00 3.19 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