NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.7227 8.3033 117.8692 59.5096 29.8485 178.1692 2 K 4.1465 6.4113 114.2879 55.6743 33.8048 174.6313 3 C 4.8043 7.9370 117.9191 56.9719 37.4743 173.7201 4 D 4.6049 8.0062 119.5883 53.7116 41.4572 176.9913 5 I 3.9657 8.1963 116.2458 63.2248 37.3718 177.9621 6 T 3.8784 7.8279 118.4585 66.8856 68.1407 176.0626 7 L 3.9787 7.9298 120.6741 57.9260 41.5747 179.3620 8 Q 4.0397 8.4986 119.7978 59.0174 28.4105 178.1811 9 E 3.9808 8.0164 119.3920 59.3628 29.3892 179.1034 10 I 3.6870 7.7547 118.8878 64.3255 37.4359 178.3473 11 I 3.7776 8.0356 121.1498 64.2500 36.5552 178.7259 12 K 3.9839 8.8997 120.3262 59.7054 31.8410 178.7067 13 T 3.4794 7.4274 115.7180 65.2985 68.6839 176.6508 14 L 3.9862 7.6064 122.5914 57.8596 41.9222 178.5468 15 N 4.4893 7.7903 117.3907 55.3008 38.8091 177.3473 16 S 4.0121 7.2616 116.0696 60.6732 62.4585 176.1013 17 L 4.2236 7.0702 121.5695 57.4726 42.2251 178.0085 18 T 4.1859 7.7671 107.9930 63.2963 68.8413 176.1507 19 E 4.3478 7.6865 122.3701 57.7849 29.8684 176.4083 20 Q 4.0995 7.5333 119.1063 56.0276 28.8499 176.2496 21 K 4.4409 8.2523 122.4913 55.7768 34.1053 175.4058 22 T 4.3860 7.7261 115.1021 63.0090 72.1805 174.6605 23 L 4.0986 8.7546 122.4804 58.1388 41.8262 179.4884 24 C 4.5335 8.1614 117.3304 58.3210 38.4258 174.5828 25 T 4.2822 7.7829 106.8922 62.5625 67.9854 174.9374 26 E 4.7580 7.8691 119.4528 56.3806 31.4778 175.8587 27 L 4.5221 8.6250 121.2980 54.9220 43.2649 175.7301 28 T 5.2203 8.5000 109.4493 60.2580 71.6765 173.8228 29 V 4.5475 8.2217 115.0003 59.4180 35.8073 175.2923 30 T 4.0804 8.3078 120.0711 63.6754 68.7350 175.4046 31 D 4.8983 9.2491 127.7633 53.5054 38.6932 176.4466 32 I 3.9342 7.7726 115.3434 62.0785 38.0454 177.1237 33 F 4.9596 7.6191 119.3968 58.1582 39.2989 175.8025 34 A 4.6358 7.6794 119.0993 51.8621 19.1812 177.0232 35 A 4.6857 7.8340 121.9960 52.1644 21.0384 177.7811 36 S 4.4822 8.1630 110.2115 60.2762 65.4626 176.1735 37 K 4.2538 8.0324 120.9996 58.7008 32.5164 172.2001 38 N 4.1072 8.0604 121.3300 53.3579 38.6508 173.7904 39 T 4.1183 8.4535 119.0689 66.4066 69.7703 175.5643 40 T 3.4324 8.3208 114.4496 61.5789 68.0700 171.4745 41 E 3.5275 9.0336 128.3313 59.5159 29.3802 179.2583 42 K 3.8580 7.7988 118.6660 59.4934 32.4518 178.1402 43 E 4.2931 8.0016 117.2616 58.2869 29.7185 178.8056 44 T 3.9170 7.6617 116.5385 66.7102 68.4296 176.5490 45 F 4.5437 7.8861 119.4520 60.7421 38.9271 176.9873 46 C 4.0891 8.2676 118.2720 59.6072 44.5869 175.9098 47 R 3.8504 8.1522 119.5704 59.0773 29.6093 178.9259 48 A 4.1068 8.1136 120.4694 54.9689 18.4319 179.4343 49 A 3.6292 7.9556 119.6305 55.4249 18.3321 179.8796 50 T 3.8127 7.7577 114.2945 66.8546 68.5720 176.6954 51 V 3.4733 7.7714 119.9914 66.4251 31.3949 178.1745 52 L 4.0492 8.0300 118.3837 57.5613 41.4320 179.4311 53 R 3.0847 7.9746 118.9008 58.9641 29.9927 178.3819 54 Q 3.8537 7.7824 117.5030 59.6616 28.7999 178.1145 55 F 3.9007 8.0739 121.3068 61.4192 39.2754 176.3069 56 Y 4.4027 8.6719 117.3295 60.4240 37.6008 179.0723 57 S 4.1317 7.2975 115.0830 61.6663 63.2398 175.9874 58 H 4.3262 8.1730 118.3265 57.2513 28.4606 175.6963 59 H 4.9069 7.5780 115.2602 54.9531 30.2312 173.8305 60 E 4.1432 8.5357 122.5385 58.7544 29.9267 177.4680 61 K 4.7425 7.7030 115.3079 55.2436 33.0045 175.7005 62 D 4.7770 7.7701 118.8203 53.0291 42.7882 176.6232 63 T 3.8288 8.7218 123.6295 67.0917 68.5283 176.2708 64 R 4.0871 8.5017 118.3626 58.2246 29.9603 177.1988 65 C 4.7494 8.6177 116.2628 57.9019 38.4924 175.6155 66 L 3.7568 7.7892 120.3619 55.3074 41.1054 178.6129 67 G 4.2825 7.1445 100.9726 45.9625 0.0000 173.0877 68 A 4.2190 8.4694 123.1577 54.5469 19.7429 179.3574 69 T 4.2849 7.8132 105.2738 61.2840 71.0989 174.8922 70 A 4.4094 8.4267 121.9813 53.8105 18.7582 179.7812 71 Q 4.0014 7.9862 116.5497 59.5929 28.8387 178.4985 72 Q 4.0645 8.2220 120.4445 58.4318 28.6501 178.5376 73 F 5.4252 8.2725 122.8301 61.1151 39.4558 176.6815 74 H 3.9104 8.0044 117.6771 59.4200 29.6372 177.5258 75 R 3.8498 8.0134 119.8395 59.2813 29.7422 178.5864 76 H 4.2095 7.9706 117.8529 59.2991 30.0435 177.4236 77 K 3.7109 7.9471 120.4845 59.4325 31.7883 179.4076 78 Q 3.5028 7.7678 118.1545 58.6527 28.5500 178.2115 79 L 4.0647 8.0851 121.7411 58.6364 41.7969 179.2398 80 I 3.7370 7.4670 119.1628 63.9252 37.1159 178.4335 81 R 3.7207 7.4662 119.2517 59.2878 29.8069 178.6398 82 F 4.5278 7.8851 117.4005 60.8784 39.1634 177.6182 83 L 4.0382 8.2617 118.7058 57.8849 41.3510 179.6843 84 K 3.9884 7.5883 117.7592 58.4071 31.9933 179.2663 85 R 3.8794 7.8021 118.8337 59.4876 30.1137 178.4139 86 L 3.9613 8.2401 120.3382 57.8790 42.0490 178.3160 87 D 4.2603 8.0010 117.8563 57.3356 41.1543 177.9228 88 R 4.1186 8.3454 119.5508 59.8885 30.0305 178.1503 89 N 4.3773 7.9543 115.9941 56.2631 38.4527 177.5042 90 L 3.8124 8.3437 120.6729 57.6106 41.8602 179.6362 91 W 4.5179 8.3212 118.3715 59.1020 28.7075 178.7037 92 G 3.7276 7.7576 105.7217 47.0419 0.0000 175.0705 93 L 4.3666 7.4901 119.8068 57.9097 42.4873 177.5359 94 A 4.2374 8.5200 120.6726 50.3557 18.1977 177.2420 95 G 3.8910 9.3339 104.6400 45.3273 0.0000 172.9613 96 L 4.7329 7.8270 118.3218 53.7008 44.9865 174.6769 97 N 5.0752 8.6149 118.2415 52.4654 40.5369 174.8171 98 S 4.3552 8.1631 113.5038 58.0366 62.7275 174.3671 99 C 4.9146 8.6793 123.0070 54.7418 43.3851 173.8571 100 P 4.6173 0.0000 0.0000 60.9979 29.9481 175.9981 101 V 3.6788 7.5342 118.4664 63.8101 32.4089 175.1675 102 K 4.4125 8.1006 124.5523 57.6443 34.4879 176.4817 103 E 4.0018 8.1365 117.2460 56.5901 30.1134 175.9803 104 A 4.5053 8.3430 120.2686 53.8054 21.0837 176.8504 105 N 4.5802 7.9441 113.6234 54.0965 40.2854 173.7302 106 Q 5.2724 8.5320 121.8807 54.7658 31.1892 175.1612 107 S 4.8864 9.1692 115.7715 56.5235 66.8326 173.9835 108 T 4.2330 8.6335 111.9863 61.7809 69.4269 174.8375 109 L 3.7979 8.7833 124.0664 58.1630 41.9760 178.4665 110 E 3.9748 7.9924 118.8976 59.7824 29.5382 178.7199 111 N 4.4781 7.9966 115.0375 55.6750 38.6784 177.2359 112 F 4.1914 8.0308 122.0631 61.4372 39.4805 177.2072 113 L 3.9848 8.6660 118.9084 57.6899 41.1789 178.8522 114 E 3.8400 7.9203 118.8263 59.5447 29.5854 179.1017 115 R 3.6619 7.7488 118.0012 59.1997 30.0627 178.2095 116 L 3.5943 7.8386 120.3019 57.5859 41.7532 178.8394 117 K 3.8170 7.7360 119.2980 59.6786 32.3227 178.7451 118 T 3.9024 7.3817 115.7110 66.6503 68.4800 176.5244 119 I 3.5607 7.2913 121.3320 65.1733 37.3475 178.2676 120 M 4.2114 8.2787 118.9916 57.8891 31.8021 178.5910 121 R 4.0687 8.1506 119.1304 58.4874 30.1838 178.1659 122 E 3.8930 8.0491 119.0644 59.3403 29.6209 178.3747 123 K 3.8999 7.8758 117.0810 59.8411 32.3468 178.2558 124 Y 3.9669 7.7580 118.1386 60.8618 38.7478 178.0959 125 S 4.1954 8.2982 115.9269 61.8579 62.8825 176.9550 126 K 4.1373 7.9816 118.7283 58.4149 31.8341 177.4898 127 C 4.6973 8.4331 115.9577 56.9060 40.8384 174.2082 128 S 4.2651 7.5044 111.7607 58.8907 65.2943 173.8489 129 S 4.2430 8.4414 119.6888 58.3155 62.0301 173.3174 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 H 8.30 4.72 0.00 3.31 3.44 0.00 5.79 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 K 6.41 4.15 0.00 1.90 1.84 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.54 7.81 3 C 7.94 4.80 0.00 2.91 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.01 4.60 0.00 2.80 2.55 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 5 I 8.20 3.97 1.90 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 1.65 0.88 0.93 0.00 0.00 6 T 7.83 3.88 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 1.24 0.00 0.00 7 L 7.93 3.98 0.00 1.84 1.88 1.00 0.83 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 8 Q 8.50 4.04 0.00 2.31 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 9 E 8.02 3.98 0.00 2.25 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 10 I 7.75 3.69 1.94 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.61 0.79 0.00 0.00 11 I 8.04 3.78 1.93 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.61 0.74 0.00 0.00 12 K 8.90 3.98 0.00 1.80 2.01 0.00 1.26 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.60 7.81 13 T 7.43 3.48 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 1.04 0.00 0.00 14 L 7.61 3.99 0.00 2.00 1.56 0.89 0.60 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 15 N 7.79 4.49 0.00 2.66 2.76 0.00 0.00 7.63 7.69 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 16 S 7.26 4.01 0.00 2.72 3.39 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 17 L 7.07 4.22 0.00 1.75 1.70 1.07 1.03 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 18 T 7.77 4.19 4.21 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 1.20 0.00 0.00 19 E 7.69 4.35 0.00 1.90 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 2.44 2.47 0.00 20 Q 7.53 4.10 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.82 0.00 0.00 0.00 0.00 0.00 2.76 2.52 0.00 21 K 8.25 4.44 0.00 1.79 1.81 0.00 1.82 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.41 7.81 22 T 7.73 4.39 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 1.34 0.00 0.00 23 L 8.75 4.10 0.00 1.67 1.77 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 24 C 8.16 4.53 0.00 3.06 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 25 T 7.78 4.28 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 1.27 0.00 0.00 26 E 7.87 4.76 0.00 1.87 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 2.23 2.27 0.00 27 L 8.63 4.52 0.00 1.94 1.70 0.60 0.52 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 28 T 8.50 5.22 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 1.24 0.00 0.00 29 V 8.22 4.55 1.62 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 0.25 0.00 0.00 0.49 0.00 0.00 30 T 8.31 4.08 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 1.18 0.00 0.00 31 D 9.25 4.90 0.00 2.69 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 32 I 7.77 3.93 1.76 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 -0.28 0.88 0.00 0.00 33 F 7.62 4.96 0.00 3.02 2.98 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 34 A 7.68 4.64 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 35 A 7.83 4.69 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 36 S 8.16 4.48 0.00 3.93 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 37 K 8.03 4.25 0.00 1.75 1.87 0.00 1.94 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.53 7.81 38 N 8.06 4.11 0.00 2.91 2.81 0.00 0.00 6.86 7.54 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 39 T 8.45 4.12 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 1.19 0.00 0.00 40 T 8.32 3.43 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 1.30 0.00 0.00 41 E 9.03 3.53 0.00 1.88 1.72 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 1.55 2.13 0.00 42 K 7.80 3.86 0.00 1.82 1.78 0.00 1.80 0.00 0.00 2.00 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.71 1.55 7.81 43 E 8.00 4.29 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 2.40 2.40 0.00 44 T 7.66 3.92 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 1.37 0.00 0.00 45 F 7.89 4.54 0.00 3.11 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 46 C 8.27 4.09 0.00 3.15 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 47 R 8.15 3.85 0.00 2.03 1.94 0.00 3.19 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.95 0.00 48 A 8.11 4.11 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 49 A 7.96 3.63 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.76 3.81 4.41 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 1.29 0.00 0.00 51 V 7.77 3.47 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 0.27 0.00 0.00 0.86 0.00 0.00 52 L 8.03 4.05 0.00 1.92 1.89 0.74 0.87 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 53 R 7.97 3.08 0.00 2.11 1.88 0.00 3.45 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.18 0.00 54 Q 7.78 3.85 0.00 2.41 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 55 F 8.07 3.90 0.00 3.13 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 56 Y 8.67 4.40 0.00 3.32 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 57 S 7.30 4.13 0.00 3.95 3.87 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 58 H 8.17 4.33 0.00 2.83 3.04 0.00 5.79 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 H 7.58 4.91 0.00 2.78 3.11 0.00 5.67 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 60 E 8.54 4.14 0.00 2.23 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 0.00 2.39 2.35 0.00 61 K 7.70 4.74 0.00 1.77 1.74 0.00 1.93 0.00 0.00 1.80 0.00 0.00 3.07 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.39 7.81 62 D 7.77 4.78 0.00 2.72 2.55 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 63 T 8.72 3.83 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 1.19 0.00 0.00 64 R 8.50 4.09 0.00 1.73 1.98 0.00 3.17 0.00 0.00 3.43 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 65 C 8.62 4.75 0.00 2.97 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.79 3.76 0.00 1.60 1.60 0.87 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 67 G 7.14 4.28 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 0.00 68 A 8.47 4.22 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 69 T 7.81 4.28 4.28 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 1.27 0.00 0.00 70 A 8.43 4.41 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 71 Q 7.99 4.00 0.00 2.33 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.86 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 72 Q 8.22 4.06 0.00 2.31 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.85 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 73 F 8.27 5.43 0.00 3.13 3.15 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 74 H 8.00 3.91 0.00 3.23 3.49 0.00 5.64 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 75 R 8.01 3.85 0.00 1.95 1.99 0.00 3.22 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.98 0.00 76 H 7.97 4.21 0.00 3.20 3.55 0.00 5.59 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 77 K 7.95 3.71 0.00 1.62 1.53 0.00 1.45 0.00 0.00 1.36 0.00 0.00 2.13 0.00 0.00 2.24 0.00 0.00 0.00 0.00 1.17 0.64 7.81 78 Q 7.77 3.50 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 1.99 1.92 0.00 79 L 8.09 4.06 0.00 1.86 1.94 1.11 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 80 I 7.47 3.74 1.84 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 1.39 0.59 0.84 0.00 0.00 81 R 7.47 3.72 0.00 1.84 1.60 0.00 3.01 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.47 0.00 82 F 7.89 4.53 0.00 3.22 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 83 L 8.26 4.04 0.00 1.95 1.82 1.04 1.26 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 84 K 7.59 3.99 0.00 1.63 1.66 0.00 1.48 0.00 0.00 1.38 0.00 0.00 2.78 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.30 1.34 7.81 85 R 7.80 3.88 0.00 2.17 2.26 0.00 3.31 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 86 L 8.24 3.96 0.00 1.96 1.69 0.97 1.37 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 87 D 8.00 4.26 0.00 3.42 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.35 4.12 0.00 2.21 2.14 0.00 3.19 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 89 N 7.95 4.38 0.00 2.91 2.81 0.00 0.00 7.12 6.72 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 90 L 8.34 3.81 0.00 1.51 1.48 0.86 0.61 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 91 W 8.32 4.52 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 92 G 7.76 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 0.00 0.00 0.00 93 L 7.49 4.37 0.00 1.82 1.70 1.02 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.52 4.24 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 95 G 9.33 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 96 L 7.83 4.73 0.00 1.66 1.62 0.98 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.61 5.08 0.00 2.66 2.69 0.00 0.00 6.99 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 98 S 8.16 4.36 0.00 4.02 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 99 C 8.68 4.91 0.00 3.11 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 0.00 100 P 0.00 4.62 0.00 2.18 2.10 0.00 3.81 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 101 V 7.53 3.68 2.08 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 0.80 0.00 0.00 0.93 0.00 0.00 102 K 8.10 4.41 0.00 1.95 1.86 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.65 1.37 7.81 103 E 8.14 4.00 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 104 A 8.34 4.51 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 N 7.94 4.58 0.00 2.88 2.72 0.00 0.00 7.06 7.56 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 0.00 106 Q 8.53 5.27 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.51 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 107 S 9.17 4.89 0.00 3.90 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 0.00 108 T 8.63 4.23 4.28 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 1.24 0.00 0.00 109 L 8.78 3.80 0.00 1.23 1.48 0.20 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 110 E 7.99 3.97 0.00 2.13 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 0.00 2.34 2.40 0.00 111 N 8.00 4.48 0.00 2.87 2.90 0.00 0.00 6.64 8.01 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 0.00 112 F 8.03 4.19 0.00 3.14 3.24 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 0.00 113 L 8.67 3.98 0.00 1.70 1.71 0.93 0.99 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 0.00 114 E 7.92 3.84 0.00 2.06 2.22 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 2.27 2.46 0.00 115 R 7.75 3.66 0.00 1.93 1.74 0.00 3.17 0.00 0.00 2.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 1.24 0.00 116 L 7.84 3.59 0.00 1.75 1.62 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 117 K 7.74 3.82 0.00 1.82 1.94 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.39 7.81 118 T 7.38 3.90 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 119 I 7.29 3.56 1.71 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.62 0.89 0.00 0.00 120 M 8.28 4.21 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.85 0.00 121 R 8.15 4.07 0.00 1.87 1.85 0.00 3.10 0.00 0.00 2.99 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.61 0.00 122 E 8.05 3.89 0.00 2.10 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 2.35 2.45 0.00 123 K 7.88 3.90 0.00 1.89 1.99 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.81 7.81 124 Y 7.76 3.97 0.00 3.24 3.12 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 0.00 0.00 0.00 125 S 8.30 4.20 0.00 4.06 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 0.00 126 K 7.98 4.14 0.00 1.93 1.86 0.00 1.79 0.00 0.00 1.90 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.48 7.81 127 C 8.43 4.70 0.00 2.77 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 0.00 128 S 7.50 4.27 0.00 3.86 3.75 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 0.00 129 S 8.44 4.24 0.00 3.80 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00