NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2058 8.1744 110.9390 61.5328 69.7719 172.6104 2 D 4.5753 8.7115 126.7055 52.2789 42.1006 173.9138 3 L 4.9247 8.2081 125.7623 54.5958 43.2814 178.1363 4 S 4.1930 8.3705 116.9893 61.1198 62.6823 176.4150 5 A 4.1008 7.9415 124.4239 55.2491 18.3545 179.4450 6 Q 4.0977 8.1339 116.0567 58.9886 28.4842 178.9243 7 K 4.2231 8.2403 119.6494 59.0248 30.3809 179.2965 8 R 4.0519 7.6077 117.9942 59.1383 30.1309 178.3899 9 L 4.3578 8.0676 118.6299 57.4059 41.7259 179.2123 10 A 4.1291 8.7417 121.2619 54.8009 18.3522 178.8653 11 A 4.3115 7.8732 116.4849 53.5735 18.5042 178.3471 12 D 4.5414 7.5318 115.5712 55.5874 42.0718 178.6535 13 V 3.6592 7.7003 118.1092 64.0436 31.6380 176.8410 14 L 4.2599 7.8634 117.7493 54.0369 42.4967 175.8316 15 D 4.3400 7.5816 117.4824 54.5040 39.6170 172.2115 16 V 4.5279 7.7946 118.0952 59.6200 35.5177 175.6748 17 G 3.8574 8.5334 109.3424 45.6817 0.0000 174.9768 18 K 4.0065 8.5184 120.3934 59.0319 32.2240 178.0822 19 N 4.5869 8.0422 113.6692 54.1774 39.0607 175.6549 20 R 4.3906 7.6769 116.9457 56.7403 31.1440 176.6783 21 V 4.3226 7.6323 111.6372 60.9335 32.5603 175.2637 22 W 4.8407 9.4190 134.9714 55.6305 33.1496 174.0800 23 F 5.0235 8.1406 125.1248 55.3079 41.2614 174.6967 24 N 3.4159 7.6533 122.3295 52.4346 38.9734 174.1329 25 P 4.1906 0.0000 0.0000 64.9123 31.6450 177.0732 26 E 4.3190 7.7629 115.0436 57.1423 30.3675 177.0456 27 R 4.5178 7.8323 117.5841 55.9003 30.7315 177.9377 28 Q 3.9285 8.3138 120.3734 59.2029 29.0950 179.7340 29 G 3.6124 8.0328 106.0448 48.2983 0.0000 174.7995 30 D 4.5642 7.7704 118.0918 55.8096 41.5285 177.9760 31 I 3.8997 7.3352 119.0967 62.8498 37.2088 177.6124 32 A 4.0535 7.6994 121.2811 54.7062 18.2946 178.4523 33 D 4.7682 7.4380 113.2416 54.0703 41.6378 177.1197 34 A 4.2077 7.3577 123.0877 51.7685 17.0679 177.6962 35 I 3.9597 8.2111 122.0427 64.6787 37.9019 178.2954 36 T 4.3567 7.6080 109.8627 60.8634 71.3851 175.6022 37 R 3.9315 8.3351 119.8371 59.2928 30.0549 178.9219 38 E 4.0240 8.1120 118.7178 59.1129 29.5722 178.3874 39 D 4.3717 7.9224 118.9028 57.1261 40.5855 178.8001 40 V 3.6023 7.2826 118.3585 65.8091 31.7002 178.0277 41 R 4.0694 7.9704 118.0216 59.1542 29.9964 178.6657 42 E 3.9577 8.2641 119.1864 59.1349 29.7495 178.3111 43 L 4.2347 7.7017 117.4872 55.9638 41.5969 179.1563 44 V 4.0586 7.2821 120.8644 65.0675 31.6033 177.6564 45 D 4.3962 8.0210 116.1697 56.9285 40.8812 177.3083 46 E 4.0598 7.9228 117.2263 57.3218 29.6515 177.9174 47 G 4.0267 8.2872 106.8795 44.9341 0.0000 174.3097 48 A 4.2080 8.0150 121.7958 54.0913 19.8347 177.0529 49 I 4.9040 8.1515 117.3272 60.0943 39.3561 175.3827 50 Q 4.9727 9.3565 124.9375 53.8908 33.0554 174.2998 51 A 5.1811 8.3713 121.0292 50.0623 21.3140 176.3136 52 K 4.2091 8.8117 123.8039 56.1650 33.2309 176.3432 53 D 4.7033 8.4520 124.2723 53.1871 41.9230 176.4711 54 K 4.1885 8.3016 121.8104 56.1324 33.5958 176.9966 55 K 4.2726 8.4580 123.7677 56.0419 33.0516 175.9219 56 G 4.1284 8.0530 109.9976 43.4115 0.0000 172.3057 57 N 4.3083 8.7051 120.1925 52.7303 38.3767 175.3544 58 S 4.1636 8.5706 120.6270 59.0171 62.2083 175.0784 59 R 4.4192 8.5536 122.9839 56.4892 29.1974 178.3092 60 G 3.7404 7.7701 108.6170 48.3508 0.0000 176.3727 61 R 4.1071 7.9724 119.7492 58.1482 30.1865 178.9008 62 A 4.0743 7.7848 120.6196 55.1864 18.5741 179.6697 63 R 4.2972 8.1473 118.2032 58.9736 29.4080 178.9477 64 E 4.1371 8.0141 116.2598 58.1988 29.4260 178.4445 65 R 4.4103 7.4303 117.4481 57.8806 30.4998 178.0593 66 Q 4.0946 8.0282 118.0892 58.4017 28.4924 178.5450 67 K 3.9980 7.8864 119.3080 59.6056 32.1386 179.5863 68 K 4.0888 7.5896 119.0176 59.4669 31.4865 179.5373 69 R 4.5875 8.2909 118.7637 57.8072 29.8723 178.3121 70 A 4.2416 7.6998 119.5531 54.0012 18.7503 177.9883 71 Y 4.3608 7.7392 116.0841 57.7162 39.3009 175.7504 72 G 3.9643 7.4755 105.3460 45.9292 0.0000 173.4423 73 H 4.7609 8.5150 117.5462 55.5423 30.0685 176.5592 74 Q 3.7771 8.6056 117.2162 56.7343 27.1263 174.1889 75 K 4.4415 7.7188 117.7567 55.9454 32.3740 176.8036 76 G 3.8428 7.7044 107.3894 44.7568 0.0000 174.6745 77 A 4.2493 8.6141 119.2269 53.0472 17.8186 178.3033 78 G 4.1669 7.9510 103.7013 46.0330 0.0000 173.9254 79 S 4.6370 8.4727 112.8603 57.5961 64.6824 173.8565 80 R 4.4890 7.9130 120.1599 54.7753 31.2908 175.1738 81 K 4.3123 8.7548 122.8546 57.8370 33.8333 176.8012 82 G 3.8132 7.7350 105.4615 44.4055 0.0000 172.7653 83 K 4.1419 8.3086 121.3684 55.5353 33.5250 177.7943 84 A 3.9649 8.7554 123.6579 55.3863 18.1458 179.8006 85 G 3.8356 8.0801 100.6020 46.1102 0.0000 173.8013 86 A 4.4424 7.5239 122.0579 53.6144 20.0711 179.0464 87 R 4.1164 7.8491 114.0200 58.6292 30.4257 176.9940 88 Q 4.4146 8.0633 118.5489 53.3177 32.2649 172.9969 89 N 4.6760 8.7682 124.0003 52.9808 40.7015 175.5908 90 S 4.1267 8.6313 123.3317 61.6724 63.2953 176.6311 91 K 4.0249 7.9925 123.2309 59.0621 32.1142 178.4977 92 E 4.0884 8.5919 119.0150 59.2823 29.3735 178.7616 93 D 4.4048 8.3349 118.3351 56.6849 41.2485 178.2134 94 W 4.1881 8.1912 128.6994 60.5422 30.6609 177.7158 95 E 3.9107 8.3997 118.6249 59.5046 28.7338 179.4919 96 S 4.0404 7.9865 112.6468 61.4719 62.4169 176.4379 97 R 3.8103 7.8885 120.6371 59.3390 29.9899 179.0475 98 I 3.2807 7.7299 118.6180 63.7676 37.7575 178.1516 99 R 3.8691 7.5946 119.0443 58.9124 30.0166 178.7588 100 A 4.0035 7.7370 120.6546 54.8931 18.2615 179.1976 101 Q 4.2033 7.6902 115.7680 57.4815 28.9035 177.5402 102 R 4.4961 7.4626 116.7510 57.0822 30.6703 177.5235 103 T 4.3602 7.7155 114.8278 64.5308 69.4515 176.6109 104 K 4.1004 7.4642 120.8689 59.4299 32.3388 178.8672 105 L 4.2325 7.8622 118.6276 57.2775 41.4915 179.6956 106 R 3.9517 8.0478 118.8323 59.4086 30.0836 177.8973 107 E 4.1240 7.9504 115.8100 58.3674 29.6991 178.3172 108 L 4.3596 7.6885 118.3736 56.2222 41.8053 178.4850 109 R 4.1280 7.6560 119.0717 58.5225 29.7785 176.6326 110 D 4.6226 7.6639 117.0533 54.4581 41.0792 176.7519 111 E 4.4636 8.0940 118.9359 55.0068 31.4138 176.1546 112 G 4.0159 7.8529 105.2885 45.4821 0.0000 174.7383 113 T 3.9822 7.8561 115.7918 65.9845 68.6649 174.3631 114 L 4.7562 7.6277 119.7280 52.8939 44.0091 176.9679 115 S 4.6882 8.2336 117.3498 57.0075 66.1198 175.3402 116 S 4.3018 8.6059 117.3627 61.4980 62.2076 176.4171 117 S 4.2874 8.0159 116.8700 60.6858 63.0326 176.1942 118 Q 4.1051 7.7929 120.6263 58.5762 28.4564 177.7528 119 Y 4.2269 8.6238 121.4190 60.5445 38.9570 177.6996 120 R 3.7883 7.7820 119.4264 59.2058 29.6688 177.8624 121 D 4.3946 7.9172 118.0453 57.6191 41.2092 178.4164 122 L 4.3238 7.7642 118.8678 57.7969 41.6875 178.7781 123 Y 3.9458 8.1014 119.6960 60.8370 38.6038 177.8865 124 D 4.4230 8.1784 119.3400 57.0576 40.8506 178.7775 125 K 3.9179 7.8673 118.0230 58.8018 32.0591 179.2561 126 A 4.0850 8.4141 122.0117 54.9049 18.1647 179.6958 127 G 3.7248 8.0121 102.8513 46.6851 0.0000 175.2235 128 G 3.9046 7.6120 105.9164 43.8393 0.0000 173.5693 129 G 3.9742 7.8946 108.6204 46.8899 0.0000 175.0138 130 E 3.8579 7.8469 120.1694 57.0677 29.9572 177.3261 131 F 5.1536 7.0723 117.0585 55.4900 40.5270 174.7476 132 D 4.4793 8.1755 126.2588 55.4539 40.9961 178.3853 133 S 4.9863 7.3975 113.9591 56.4232 66.3862 174.5687 134 V 3.6098 8.2474 117.4096 66.1926 31.1178 178.4223 135 A 4.2553 7.7517 122.3325 54.4010 18.4197 178.8382 136 D 4.4330 8.0443 115.8313 56.6158 41.4222 178.1448 137 L 3.0860 7.3528 120.3886 57.9143 41.7969 178.7301 138 E 4.0196 8.0350 118.4200 59.1537 29.1308 178.6921 139 R 4.4381 7.5771 114.5277 56.8704 30.0041 176.2756 140 Y 4.6179 7.0606 118.3789 58.6070 41.1348 177.0439 141 I 3.8562 7.8713 119.9492 64.4508 37.3151 176.9386 142 D 4.4299 7.7338 121.0873 53.7278 38.9306 176.3693 143 A 3.9520 7.9321 124.7846 52.4098 18.6222 177.7683 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 T 8.17 4.21 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 2 D 8.71 4.58 0.00 2.73 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 3 L 8.21 4.92 0.00 1.91 1.93 1.05 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.37 4.19 0.00 4.06 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 A 7.94 4.10 1.36 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 0.00 0.00 0.00 6 Q 8.13 4.10 0.00 2.58 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.85 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 7 K 8.24 4.22 0.00 1.91 1.73 0.00 1.41 0.00 0.00 1.27 0.00 0.00 2.13 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.45 1.04 7.81 8 R 7.61 4.05 0.00 1.93 2.16 0.00 3.10 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 9 L 8.07 4.36 0.00 1.96 1.73 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.74 4.13 1.55 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 11 A 7.87 4.31 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 12 D 7.53 4.54 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 13 V 7.70 3.66 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 0.88 0.00 0.00 0.95 0.00 0.00 14 L 7.86 4.26 0.00 1.82 1.78 1.02 1.12 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 15 D 7.58 4.34 0.00 2.67 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 16 V 7.79 4.53 2.24 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 0.73 0.00 0.00 0.95 0.00 0.00 17 G 8.53 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 18 K 8.52 4.01 0.00 1.74 1.86 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 19 N 8.04 4.59 0.00 2.70 2.85 0.00 0.00 6.86 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 R 7.68 4.39 0.00 2.09 1.98 0.00 3.13 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 21 V 7.63 4.32 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 0.69 0.00 0.00 0.78 0.00 0.00 22 W 9.42 4.84 0.00 3.35 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 23 F 8.14 5.02 0.00 2.58 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.65 3.42 0.00 2.45 2.45 0.00 0.00 7.02 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 25 P 0.00 4.19 0.00 2.08 2.09 0.00 3.69 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 26 E 7.76 4.32 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 27 R 7.83 4.52 0.00 1.71 1.79 0.00 3.13 0.00 0.00 3.11 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 28 Q 8.31 3.93 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.90 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 29 G 8.03 3.61 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 0.00 0.00 0.00 0.00 30 D 7.77 4.56 0.00 2.79 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.34 3.90 1.76 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.91 0.27 0.00 0.00 32 A 7.70 4.05 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 33 D 7.44 4.77 0.00 2.69 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 34 A 7.36 4.21 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 35 I 8.21 3.96 1.86 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 1.53 0.86 0.91 0.00 0.00 36 T 7.61 4.36 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 37 R 8.34 3.93 0.00 1.88 2.03 0.00 3.13 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 38 E 8.11 4.02 0.00 2.07 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 2.37 2.45 0.00 39 D 7.92 4.37 0.00 3.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 V 7.28 3.60 2.24 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 0.85 0.00 0.00 1.01 0.00 0.00 41 R 7.97 4.07 0.00 2.09 1.97 0.00 3.49 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 1.66 1.86 0.00 42 E 8.26 3.96 0.00 2.13 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 2.29 2.34 0.00 43 L 7.70 4.23 0.00 1.73 1.58 0.82 0.71 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 44 V 7.28 4.06 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 1.01 0.00 0.00 45 D 8.02 4.40 0.00 2.85 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 46 E 7.92 4.06 0.00 1.99 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 2.34 2.49 0.00 47 G 8.29 4.03 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 0.00 0.00 0.00 48 A 8.02 4.21 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 49 I 8.15 4.90 1.90 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.54 1.15 0.00 0.00 50 Q 9.36 4.97 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.63 0.00 51 A 8.37 5.18 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 52 K 8.81 4.21 0.00 1.94 1.73 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.39 7.81 53 D 8.45 4.70 0.00 2.68 2.56 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 54 K 8.30 4.19 0.00 1.86 1.81 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.42 7.81 55 K 8.46 4.27 0.00 1.73 1.74 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.43 7.81 56 G 8.05 4.13 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 0.00 57 N 8.71 4.31 0.00 2.71 2.81 0.00 0.00 7.01 7.57 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 58 S 8.57 4.16 0.00 3.88 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 59 R 8.55 4.42 0.00 1.85 1.94 0.00 3.15 0.00 0.00 3.34 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 60 G 7.77 3.74 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 0.00 0.00 0.00 61 R 7.97 4.11 0.00 1.87 1.99 0.00 3.13 0.00 0.00 3.34 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 62 A 7.78 4.07 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 63 R 8.15 4.30 0.00 2.00 1.99 0.00 3.13 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 64 E 8.01 4.14 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 65 R 7.43 4.41 0.00 2.18 2.03 0.00 3.10 0.00 0.00 3.18 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 66 Q 8.03 4.09 0.00 2.36 2.14 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 2.39 2.60 0.00 67 K 7.89 4.00 0.00 1.95 1.84 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.47 7.81 68 K 7.59 4.09 0.00 2.04 1.95 0.00 1.85 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.71 7.81 69 R 8.29 4.59 0.00 1.94 1.99 0.00 3.14 0.00 0.00 3.28 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.66 0.00 70 A 7.70 4.24 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 71 Y 7.74 4.36 0.00 2.96 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 72 G 7.48 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 0.00 0.00 0.00 73 H 8.52 4.76 0.00 3.43 3.27 0.00 5.74 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.61 3.78 0.00 2.25 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.61 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 75 K 7.72 4.44 0.00 1.75 1.81 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.64 7.81 76 G 7.70 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.61 4.25 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 78 G 7.95 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 0.00 0.00 0.00 0.00 79 S 8.47 4.64 0.00 4.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 R 7.91 4.49 0.00 1.79 1.86 0.00 3.17 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.80 0.00 81 K 8.75 4.31 0.00 1.67 1.79 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.46 7.81 82 G 7.73 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 83 K 8.31 4.14 0.00 1.80 1.71 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.44 7.81 84 A 8.76 3.96 1.31 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 85 G 8.08 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.52 4.44 1.31 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 87 R 7.85 4.12 0.00 1.96 2.00 0.00 3.18 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 88 Q 8.06 4.41 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 7.02 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 89 N 8.77 4.68 0.00 2.81 2.76 0.00 0.00 6.96 7.63 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 90 S 8.63 4.13 0.00 4.08 4.11 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 91 K 7.99 4.02 0.00 1.82 1.97 0.00 1.88 0.00 0.00 1.90 0.00 0.00 2.95 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.48 1.46 7.81 92 E 8.59 4.09 0.00 2.31 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 2.36 2.46 0.00 93 D 8.33 4.40 0.00 3.04 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 W 8.19 4.19 0.00 3.42 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 95 E 8.40 3.91 0.00 2.30 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 2.45 2.73 0.00 96 S 7.99 4.04 0.00 4.00 4.03 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 97 R 7.89 3.81 0.00 1.89 1.85 0.00 3.33 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 98 I 7.73 3.28 0.56 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 -0.12 0.32 0.00 0.00 99 R 7.59 3.87 0.00 1.89 1.91 0.00 3.27 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 100 A 7.74 4.00 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 0.00 101 Q 7.69 4.20 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.67 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 102 R 7.46 4.50 0.00 1.96 2.09 0.00 2.99 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.58 0.00 103 T 7.72 4.36 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 1.22 0.00 0.00 104 K 7.46 4.10 0.00 2.10 1.78 0.00 1.52 0.00 0.00 1.63 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.51 7.81 105 L 7.86 4.23 0.00 1.95 2.03 0.96 1.31 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 0.00 106 R 8.05 3.95 0.00 2.14 1.97 0.00 3.20 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.71 0.00 107 E 7.95 4.12 0.00 2.17 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 108 L 7.69 4.36 0.00 1.89 1.73 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 109 R 7.66 4.13 0.00 1.47 1.49 0.00 2.66 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.35 0.00 110 D 7.66 4.62 0.00 2.67 2.61 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 0.00 111 E 8.09 4.46 0.00 2.02 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 2.16 2.26 0.00 112 G 7.85 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 0.00 113 T 7.86 3.98 4.35 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 1.21 0.00 0.00 114 L 7.63 4.76 0.00 1.67 1.64 1.06 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 S 8.23 4.69 0.00 4.05 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 0.00 116 S 8.61 4.30 0.00 4.09 4.18 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 0.00 117 S 8.02 4.29 0.00 4.11 4.18 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 0.00 118 Q 7.79 4.11 0.00 2.46 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.40 0.00 119 Y 8.62 4.23 0.00 3.04 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 0.00 120 R 7.78 3.79 0.00 2.32 2.09 0.00 3.21 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 121 D 7.92 4.39 0.00 2.91 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 0.00 122 L 7.76 4.32 0.00 1.81 1.79 0.98 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.10 3.95 0.00 2.60 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 0.00 124 D 8.18 4.42 0.00 2.80 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 0.00 125 K 7.87 3.92 0.00 2.06 1.31 0.00 1.86 0.00 0.00 1.49 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.29 1.49 7.81 126 A 8.41 4.09 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 0.00 127 G 8.01 3.72 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 0.00 0.00 0.00 128 G 7.61 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 0.00 0.00 0.00 129 G 7.89 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 E 7.85 3.86 0.00 1.16 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 2.01 2.03 0.00 131 F 7.07 5.15 0.00 2.99 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 D 8.18 4.48 0.00 2.75 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 0.00 133 S 7.40 4.99 0.00 3.96 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 0.00 134 V 8.25 3.61 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 1.00 0.00 0.00 0.94 0.00 0.00 135 A 7.75 4.26 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 0.00 136 D 8.04 4.43 0.00 2.86 2.77 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 0.00 137 L 7.35 3.09 0.00 1.42 1.57 0.16 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.04 4.02 0.00 2.21 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 2.29 2.44 0.00 139 R 7.58 4.44 0.00 1.96 2.01 0.00 3.13 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 140 Y 7.06 4.62 0.00 3.09 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 0.00 141 I 7.87 3.86 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.77 0.90 0.00 0.00 142 D 7.73 4.43 0.00 2.68 2.61 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 0.00 143 A 7.93 3.95 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00