NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.2976 8.4093 119.1790 53.6524 40.0375 173.0562 4 Y 4.6110 6.9503 121.1259 54.8938 40.6559 170.9917 5 T 4.7985 8.8355 110.8411 60.2909 73.3714 173.0426 6 Y 5.2405 8.8231 118.5397 56.7378 39.8052 175.3743 7 I 4.8502 8.7573 122.8042 59.1122 41.4704 175.4062 8 K 4.6565 9.5633 128.2929 55.3162 33.0919 176.3735 9 P 4.5859 0.0000 0.0000 66.2985 31.2244 178.8835 10 E 4.3961 8.2834 118.0047 59.0558 29.4494 179.1725 11 E 4.0145 8.2053 118.2349 59.0969 29.6175 178.9038 12 L 3.9071 8.1516 120.5605 58.0247 42.1683 179.1027 13 V 3.5279 8.1580 118.5406 66.0833 31.1760 177.5056 14 E 3.9353 7.9529 116.8844 59.8133 29.5209 179.2979 15 L 4.1085 7.9056 118.5491 57.6865 41.4522 179.3476 16 L 4.1343 7.7964 117.4666 56.7153 41.7682 178.0986 17 D 4.6148 7.7982 117.1430 53.6458 41.7056 175.5403 18 N 4.8025 7.4000 120.1194 51.2551 40.2980 173.4682 19 P 4.2522 0.0000 0.0000 66.1033 31.6908 178.1862 20 D 4.4159 8.1258 118.8770 56.1063 39.7359 178.0625 21 S 4.0828 7.6529 117.5781 61.0677 62.9147 176.6596 22 L 3.9339 7.9329 122.5052 58.3993 41.6209 179.5311 23 V 3.6995 7.5326 110.6769 63.8261 31.6663 177.9244 24 K 4.1547 7.9578 116.3114 56.4338 32.2408 175.8852 25 A 5.2674 7.2861 121.0094 50.0302 21.3324 176.1053 26 A 4.6215 8.8925 122.1116 49.9722 22.7014 175.2536 27 V 4.4261 8.2070 121.3408 61.2345 33.9468 174.3309 28 I 4.4429 8.5945 129.9455 59.5054 39.0544 174.5347 29 D 4.6004 8.9285 129.2026 53.3590 42.0162 175.9730 30 C 5.2832 8.8594 123.8308 59.1350 29.2867 174.4782 31 R 4.4937 8.0754 119.1519 55.6590 30.3850 174.3721 32 D 4.6659 8.0596 116.5944 53.9753 41.3920 177.1703 33 S 4.3110 8.1864 116.3935 59.4049 64.6737 175.8334 34 D 4.5913 7.9451 119.1344 53.5374 39.9226 177.7979 35 R 3.7396 7.9213 121.5610 59.8254 30.0835 177.1760 36 D 4.7259 7.4269 114.3894 54.8547 40.7136 177.1199 37 C 4.1615 7.7525 118.3177 61.4406 28.3031 172.8947 38 G 3.9129 6.0702 104.6529 43.3960 0.0000 172.3317 39 F 3.9492 7.3318 116.7468 54.7781 41.4155 173.4849 40 I 4.6768 8.3264 121.9738 60.6089 37.7077 176.4141 41 V 3.6541 7.3678 124.9452 62.9061 31.5903 176.4610 42 N 4.5379 8.7529 119.0358 52.9165 36.4284 174.9416 43 S 4.4103 7.5762 112.9189 58.4103 64.1408 173.6880 44 I 4.2613 8.5095 123.2698 59.7089 39.2749 174.2312 45 N 4.8606 8.5151 125.8352 53.2344 39.8058 174.5633 46 M 4.5474 8.7819 127.2238 52.0526 33.5947 171.3738 47 P 4.6721 0.0000 0.0000 62.9171 31.3757 176.9763 48 T 4.0147 8.9336 123.0489 66.7636 68.6198 176.2544 49 I 3.9178 7.7474 119.5457 62.4783 38.2549 175.9162 50 S 4.7021 7.3766 112.0035 57.9325 64.3168 174.2981 51 C 4.2106 8.1324 119.8370 59.9124 28.5801 173.0849 52 T 4.6607 8.0190 112.9469 59.5465 71.2681 174.8098 53 E 4.1200 8.9763 121.6265 59.9235 29.3332 178.4940 54 E 4.0701 8.2102 118.4187 59.3351 29.7621 178.3962 55 M 4.0614 7.9787 118.5675 58.5233 31.8856 178.3210 56 Y 4.1896 7.9143 116.4632 60.9866 38.1802 177.8332 57 E 4.0377 8.4189 119.6952 59.4754 29.5051 179.4487 58 K 4.0373 8.1961 119.6153 59.3479 32.2740 178.7381 59 L 4.0097 8.2012 120.6157 57.9218 41.9920 178.6001 60 A 4.3030 8.5511 121.0356 55.2195 18.3193 179.6230 61 K 3.8897 8.2070 117.9003 60.0119 32.3711 179.1069 62 T 3.9024 8.2286 116.2928 66.8643 68.4149 176.6380 63 L 4.0620 8.7285 121.0891 57.3615 41.6176 179.2552 64 F 3.8711 8.3146 120.8639 61.4322 39.0748 177.1721 65 E 3.9404 8.5690 116.6805 58.8347 29.2296 178.1936 66 E 4.2858 7.8375 116.6126 54.8875 29.9297 176.1403 67 K 3.5945 7.6758 117.2566 56.8965 30.4388 175.7644 68 K 4.2474 7.8631 116.5536 56.8982 32.7716 177.1829 69 E 4.7544 9.0557 120.7305 56.2740 32.2353 175.7238 70 L 5.5370 7.9405 118.7305 52.7566 46.3891 175.2132 71 A 4.9357 9.7643 124.6889 50.2496 21.9483 175.1616 72 V 4.8097 8.7306 124.1705 61.6781 33.2469 174.6298 73 F 4.9261 9.7226 128.5343 57.0033 40.5426 174.9590 74 H 5.3997 9.2672 118.0699 53.8851 32.3959 171.7042 75 C 5.1909 8.7739 116.6664 58.0812 32.5318 176.3179 76 A 4.2627 9.1614 115.8828 54.6547 18.7334 179.0614 77 Q 4.6804 8.3507 111.3313 55.0150 30.4258 175.8885 78 S 3.6490 8.0646 112.6405 59.7057 60.6854 173.0721 79 L 4.5455 8.1627 119.5976 55.6272 43.1766 176.8599 80 V 4.2943 7.3732 114.4451 64.2588 34.0036 177.5504 81 R 3.9546 7.9965 117.7386 59.0549 30.0678 178.9855 82 A 4.0368 7.9339 120.3210 54.6843 18.5839 177.7266 83 P 3.6269 0.0000 0.0000 65.7470 31.2707 178.7289 84 K 4.0354 8.1041 118.3752 59.2439 32.0293 179.6514 85 G 3.6993 8.5553 106.1368 47.5260 0.0000 175.7033 86 A 2.6773 8.1321 123.3985 54.4928 18.2486 179.4724 87 N 4.2584 8.4349 115.4343 56.5717 38.5771 177.7989 88 R 3.6605 7.6650 119.3420 59.0840 30.0130 178.9768 89 F 4.2703 7.9851 120.1058 61.2673 39.4616 177.0778 90 A 4.0261 8.1370 120.5083 55.1128 18.1273 179.6479 91 L 3.8535 7.9953 117.3292 57.6989 41.6974 179.5252 92 A 3.9365 8.1445 121.0581 55.2680 18.2674 179.6205 93 Q 3.8855 7.7620 116.4733 59.0414 28.6152 179.1826 94 K 3.8495 7.9078 120.5696 59.1937 32.0098 178.7988 95 K 3.8333 7.9446 119.1949 59.0811 32.1811 178.0240 96 L 4.1783 7.3975 116.7065 54.7547 41.8894 177.6629 97 G 3.6530 7.3322 107.0488 45.3861 0.0000 172.8064 98 Y 4.7688 7.1980 116.2443 56.4694 39.5651 176.1256 99 V 4.5079 8.3722 112.0381 60.5478 33.9501 175.7006 100 L 5.0587 7.8998 119.4831 51.6875 44.4055 174.4072 101 P 4.7343 0.0000 0.0000 62.8183 32.1806 175.9835 102 A 4.3528 8.8881 123.3911 52.1880 19.9849 176.3745 103 V 5.0163 8.0862 118.7769 61.4621 34.3202 174.1631 104 Y 5.1774 9.6640 124.6280 56.2142 42.7021 174.3009 105 V 4.6740 8.4476 121.4790 60.7386 34.2896 174.3528 106 L 4.6385 9.2333 131.0006 54.8664 42.9250 176.1993 107 R 4.2373 9.0385 128.5306 58.3325 30.4793 176.8712 108 G 3.9358 9.1223 113.7690 44.1900 0.0000 174.4397 109 G 4.3755 8.1159 109.0452 45.0321 0.0000 173.5988 110 W 4.3426 8.9985 127.2845 60.7375 30.4958 178.7955 111 E 3.9812 8.6693 118.2302 59.6955 29.0289 179.4153 112 A 4.0143 8.0240 120.1954 54.8511 18.3469 179.5664 113 F 4.1143 8.0960 119.3915 61.6677 39.5495 176.8820 114 Y 3.3657 8.1280 119.5913 60.5353 38.2294 177.0660 115 H 4.0093 8.0715 118.4346 59.5847 29.9922 176.5629 116 M 3.7667 7.6948 118.6188 57.5985 32.2573 176.7376 117 Y 4.3278 7.3611 114.2983 57.4066 39.2429 177.9050 118 G 2.4048 7.5584 109.5689 47.4079 0.0000 174.2175 119 D 4.5619 7.4840 116.8484 53.1712 40.2133 177.0321 120 V 4.2724 7.3089 117.3204 61.6479 34.0339 175.7667 121 R 4.7455 8.1866 119.5670 54.3364 30.4329 174.6023 122 P 4.3446 0.0000 0.0000 64.7296 31.9039 178.4393 123 D 4.3752 7.9568 118.0231 55.5646 39.6119 177.0383 124 L 4.4938 8.2692 119.6182 55.7731 42.5338 175.5954 125 M 5.3256 7.8590 119.7108 53.8125 34.4016 174.7663 126 Y 4.8391 8.8987 120.6764 56.2733 42.1842 174.9929 127 V 4.6656 8.3015 113.5222 59.9109 36.9576 174.1140 128 K 5.1250 8.7411 121.0382 54.9032 34.1080 175.8674 129 L 4.6190 8.9859 126.7105 54.3254 45.3147 177.3189 130 G 4.3500 8.5026 111.1041 45.2529 0.0000 173.3396 131 P 3.9769 0.0000 0.0000 65.2996 31.5372 177.2234 132 E 4.2748 8.0650 114.8160 55.6687 30.2340 176.2024 133 Q 3.5192 8.2765 117.3857 56.8833 26.6523 173.9467 134 K 4.4612 7.8064 116.9132 55.6679 34.1493 178.5418 135 L 4.8811 8.5446 123.9294 55.2244 42.7668 176.2862 136 I 4.5860 8.4150 120.8800 59.7761 41.9499 174.3520 137 S 3.6706 8.0893 123.1702 57.7358 63.7052 175.1145 138 E 3.9180 8.9167 121.9945 59.0464 29.0355 179.1889 139 E 3.8526 8.0095 119.3421 59.6136 29.6737 178.4587 140 D 4.3802 8.4404 119.1131 57.1670 40.7862 178.6261 141 L 3.9074 8.2013 121.2832 58.1739 42.0848 178.8774 142 N 4.2988 8.3267 116.8129 56.3265 38.2674 177.4599 143 S 4.0925 8.2212 115.5529 61.7172 63.0514 176.4314 144 A 4.1174 7.9345 122.0578 55.1485 18.1742 179.5503 145 V 3.8338 7.8181 116.0723 64.9496 31.6638 176.0583 146 D 4.3093 8.2577 119.0659 55.8055 40.6071 176.0302 147 H 4.3206 7.7494 120.7364 54.9508 28.0778 174.7302 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 3 N 8.41 4.30 0.00 2.43 2.63 0.00 0.00 6.84 6.66 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 4 Y 6.95 4.61 0.00 2.81 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 5 T 8.84 4.80 4.38 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 1.18 0.00 0.00 6 Y 8.82 5.24 0.00 3.03 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.76 4.85 1.83 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.88 1.05 0.00 0.00 8 K 9.56 4.66 0.00 1.90 1.93 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.53 1.62 7.81 9 P 0.00 4.59 0.00 2.39 2.51 0.00 3.71 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 10 E 8.28 4.40 0.00 2.14 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 2.49 2.52 0.00 11 E 8.21 4.01 0.00 2.12 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 2.42 2.41 0.00 12 L 8.15 3.91 0.00 1.75 1.91 0.83 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.16 3.53 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 0.75 0.00 0.00 0.25 0.00 0.00 14 E 7.95 3.94 0.00 2.25 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 2.35 2.38 0.00 15 L 7.91 4.11 0.00 1.77 1.67 0.80 0.35 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 16 L 7.80 4.13 0.00 1.75 1.73 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 17 D 7.80 4.61 0.00 2.85 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 18 N 7.40 4.80 0.00 2.65 2.65 0.00 0.00 6.81 7.97 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 19 P 0.00 4.25 0.00 2.25 2.17 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 20 D 8.13 4.42 0.00 2.96 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 21 S 7.65 4.08 0.00 3.84 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 22 L 7.93 3.93 0.00 1.99 1.77 0.89 0.88 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 23 V 7.53 3.70 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 0.82 0.00 0.00 0.91 0.00 0.00 24 K 7.96 4.15 0.00 2.01 1.83 0.00 1.62 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.52 7.81 25 A 7.29 5.27 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 26 A 8.89 4.62 1.08 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 27 V 8.21 4.43 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 1.00 0.00 0.00 0.84 0.00 0.00 28 I 8.59 4.44 0.56 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 -0.36 0.55 0.00 0.00 29 D 8.93 4.60 0.00 2.55 2.38 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 30 C 8.86 5.28 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 31 R 8.08 4.49 0.00 1.91 1.97 0.00 3.23 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.58 0.00 32 D 8.06 4.67 0.00 2.76 2.53 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 33 S 8.19 4.31 0.00 4.01 4.14 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 34 D 7.95 4.59 0.00 2.85 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 35 R 7.92 3.74 0.00 1.73 1.84 0.00 2.87 0.00 0.00 2.73 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 36 D 7.43 4.73 0.00 2.53 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 37 C 7.75 4.16 0.00 2.91 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 38 G 6.07 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 39 F 7.33 3.95 0.00 3.06 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 40 I 8.33 4.68 1.93 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 1.32 1.01 0.93 0.00 0.00 41 V 7.37 3.65 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 0.46 0.00 0.00 0.41 0.00 0.00 42 N 8.75 4.54 0.00 2.82 3.09 0.00 0.00 7.00 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 43 S 7.58 4.41 0.00 3.86 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 44 I 8.51 4.26 1.67 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.45 0.77 0.00 0.00 45 N 8.52 4.86 0.00 2.50 2.58 0.00 0.00 6.92 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 46 M 8.78 4.55 0.00 1.77 1.91 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 47 P 0.00 4.67 0.00 2.05 1.99 0.00 3.54 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 48 T 8.93 4.01 4.30 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 1.27 0.00 0.00 49 I 7.75 3.92 1.89 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 1.48 0.76 0.92 0.00 0.00 50 S 7.38 4.70 0.00 4.15 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 51 C 8.13 4.21 0.00 2.95 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 52 T 8.02 4.66 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 1.23 0.00 0.00 53 E 8.98 4.12 0.00 2.12 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 0.00 2.52 2.45 0.00 54 E 8.21 4.07 0.00 2.10 1.95 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 2.39 2.42 0.00 55 M 7.98 4.06 0.00 1.90 2.09 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 56 Y 7.91 4.19 0.00 3.31 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.42 4.04 0.00 2.22 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 2.37 2.50 0.00 58 K 8.20 4.04 0.00 2.02 1.98 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 59 L 8.20 4.01 0.00 2.07 2.13 0.78 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 60 A 8.55 4.30 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 61 K 8.21 3.89 0.00 2.07 2.06 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.52 1.60 7.81 62 T 8.23 3.90 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 1.23 0.00 0.00 63 L 8.73 4.06 0.00 1.84 1.80 0.76 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 64 F 8.31 3.87 0.00 2.39 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 65 E 8.57 3.94 0.00 1.94 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 2.52 2.77 0.00 66 E 7.84 4.29 0.00 1.90 1.92 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 2.28 2.57 0.00 67 K 7.68 3.59 0.00 1.77 1.72 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.21 1.31 7.81 68 K 7.86 4.25 0.00 1.88 1.76 0.00 1.65 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.53 7.81 69 E 9.06 4.75 0.00 1.91 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 2.24 2.25 0.00 70 L 7.94 5.54 0.00 1.60 1.56 0.93 0.46 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 71 A 9.76 4.94 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 8.73 4.81 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 0.98 0.00 0.00 0.91 0.00 0.00 73 F 9.72 4.93 0.00 3.01 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 H 9.27 5.40 0.00 3.29 3.42 0.00 5.40 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 C 8.77 5.19 0.00 2.95 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 76 A 9.16 4.26 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 8.35 4.68 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.28 0.00 0.00 0.00 0.00 0.00 2.51 2.41 0.00 78 S 8.06 3.65 0.00 4.19 4.06 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 79 L 8.16 4.55 0.00 1.67 1.75 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.37 4.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.97 0.00 0.00 81 R 8.00 3.95 0.00 1.93 2.00 0.00 3.21 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 82 A 7.93 4.04 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 83 P 0.00 3.63 0.00 2.26 2.04 0.00 3.62 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.14 0.00 84 K 8.10 4.04 0.00 1.98 1.88 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.67 7.81 85 G 8.56 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 0.00 0.00 0.00 86 A 8.13 2.68 0.77 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 0.00 0.00 87 N 8.43 4.26 0.00 2.79 2.83 0.00 0.00 7.02 7.39 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 88 R 7.66 3.66 0.00 0.91 0.89 0.00 2.76 0.00 0.00 2.60 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.54 0.00 89 F 7.99 4.27 0.00 3.44 3.01 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 90 A 8.14 4.03 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 91 L 8.00 3.85 0.00 1.86 1.64 0.85 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.14 3.94 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 93 Q 7.76 3.89 0.00 2.10 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.77 0.00 0.00 0.00 0.00 0.00 2.14 1.43 0.00 94 K 7.91 3.85 0.00 1.82 1.84 0.00 1.58 0.00 0.00 1.51 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.37 7.81 95 K 7.94 3.83 0.00 1.73 1.95 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.42 7.81 96 L 7.40 4.18 0.00 1.52 1.19 1.06 1.08 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 97 G 7.33 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 7.20 4.77 0.00 2.85 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 99 V 8.37 4.51 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 0.75 0.00 0.00 1.00 0.00 0.00 100 L 7.90 5.06 0.00 1.81 1.69 1.02 1.12 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 0.00 101 P 0.00 4.73 0.00 2.27 2.19 0.00 4.04 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.17 0.00 102 A 8.89 4.35 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 0.00 103 V 8.09 5.02 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 1.05 0.00 0.00 1.32 0.00 0.00 104 Y 9.66 5.18 0.00 2.93 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.45 4.67 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 0.94 0.00 0.00 0.10 0.00 0.00 106 L 9.23 4.64 0.00 1.84 1.68 1.06 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 107 R 9.04 4.24 0.00 1.91 1.96 0.00 3.15 0.00 0.00 2.88 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 108 G 9.12 3.94 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 0.00 109 G 8.12 4.38 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 0.00 110 W 9.00 4.34 0.00 3.55 3.32 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 0.00 111 E 8.67 3.98 0.00 2.25 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 0.00 2.48 2.63 0.00 112 A 8.02 4.01 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 0.00 113 F 8.10 4.11 0.00 3.21 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 0.00 114 Y 8.13 3.37 0.00 1.76 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 0.00 115 H 8.07 4.01 0.00 3.22 3.43 0.00 6.00 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 M 7.69 3.77 0.00 1.62 1.80 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 2.06 1.03 0.00 117 Y 7.36 4.33 0.00 2.47 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.56 2.40 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 0.00 119 D 7.48 4.56 0.00 2.66 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 0.00 120 V 7.31 4.27 1.95 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 0.86 0.00 0.00 0.89 0.00 0.00 121 R 8.19 4.75 0.00 1.69 1.88 0.00 3.27 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 122 P 0.00 4.34 0.00 2.25 2.26 0.00 3.74 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 2.03 1.91 0.00 123 D 7.96 4.38 0.00 2.85 3.01 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 0.00 124 L 8.27 4.49 0.00 1.94 2.01 0.80 0.94 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 0.00 125 M 7.86 5.33 0.00 2.27 2.10 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.84 0.00 126 Y 8.90 4.84 0.00 2.38 2.31 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 0.00 127 V 8.30 4.67 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 0.82 0.00 0.00 0.91 0.00 0.00 128 K 8.74 5.13 0.00 1.72 1.79 0.00 1.87 0.00 0.00 1.82 0.00 0.00 2.59 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.47 1.69 7.81 129 L 8.99 4.62 0.00 1.68 1.48 0.92 1.07 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 0.00 130 G 8.50 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 0.00 0.00 0.00 0.00 131 P 0.00 3.98 0.00 2.10 2.06 0.00 3.94 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 2.03 2.05 0.00 132 E 8.06 4.27 0.00 1.96 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 2.27 2.32 0.00 133 Q 8.28 3.52 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.31 0.00 134 K 7.81 4.46 0.00 1.78 1.75 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.44 7.81 135 L 8.54 4.88 0.00 1.65 1.88 1.09 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 136 I 8.41 4.59 1.88 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 1.19 1.04 0.90 0.00 0.00 137 S 8.09 3.67 0.00 3.52 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 0.00 138 E 8.92 3.92 0.00 1.99 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 2.34 2.43 0.00 139 E 8.01 3.85 0.00 1.95 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 2.34 2.38 0.00 140 D 8.44 4.38 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 0.00 141 L 8.20 3.91 0.00 1.91 1.75 0.90 0.56 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 0.00 142 N 8.33 4.30 0.00 2.94 2.82 0.00 0.00 7.04 7.11 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 0.00 143 S 8.22 4.09 0.00 3.97 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 0.00 144 A 7.93 4.12 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 0.00 145 V 7.82 3.83 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 0.84 0.00 0.00 0.98 0.00 0.00 146 D 8.26 4.31 0.00 2.84 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 H 7.75 4.32 0.00 3.17 3.14 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00