NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 D 4.4941 8.3601 120.1938 53.6400 41.4369 174.8251 5 A 3.9523 8.5535 129.8590 49.4811 18.9229 174.6346 6 P 4.2824 0.0000 0.0000 64.0559 32.8709 175.0919 7 G 4.0363 8.6680 107.9459 47.4009 0.0000 173.0531 8 R 4.6082 7.9233 117.2299 56.1967 32.6183 177.3700 9 S 4.8341 8.1223 108.4739 58.7118 63.2124 174.9656 10 Q 4.4910 8.0577 119.3775 57.5284 29.1916 176.6548 11 F 4.9339 8.0303 121.6838 57.1725 37.6582 174.7248 12 V 3.9520 7.6196 116.9102 58.8754 33.4286 174.4719 13 P 4.0450 0.0000 0.0000 62.9382 31.7520 177.6205 14 A 3.1796 8.6329 124.5209 55.2230 18.0599 179.2226 15 D 4.7055 7.9182 114.1707 56.3853 41.3847 178.3897 16 Q 3.9364 7.8232 118.0637 58.2402 29.3338 177.3322 17 A 3.1541 7.4573 120.4269 54.1016 18.3155 176.0053 18 F 5.3437 7.6537 114.5966 55.5632 40.6554 173.7730 19 A 4.5319 9.1797 125.1208 50.4057 19.3081 175.6788 20 F 4.7220 8.7070 124.5843 57.7262 40.9078 174.2859 21 D 4.4207 7.7817 124.4640 53.1190 45.2687 173.1967 22 F 5.1759 7.3426 114.6848 55.6015 41.3463 173.7919 23 Q 4.4700 9.0449 117.9640 54.4704 33.0725 173.6703 24 Q 5.0153 8.8589 124.5755 54.3889 32.0043 174.7125 25 N 4.8463 9.2352 124.3326 52.3030 40.9426 176.3985 26 Q 3.3228 8.4159 127.2131 57.3140 28.2960 175.8137 27 H 4.5684 9.0726 126.9863 57.0666 29.3541 173.4922 28 D 5.2029 8.2847 121.4659 52.4642 42.7576 174.9600 29 L 5.1308 9.0024 126.5766 53.1098 45.1030 174.3176 30 N 5.3101 9.3341 125.0562 51.8534 41.4379 172.8801 31 L 4.9579 9.0304 126.5210 53.4212 44.3907 175.6893 32 T 5.1629 8.0405 118.9502 61.5450 72.9520 172.8246 33 W 5.1471 9.6411 125.4384 55.0259 32.4783 174.4694 34 Q 4.6555 9.3765 124.7609 55.0603 29.9107 174.8311 35 I 4.9095 8.4305 125.6276 59.0786 39.2325 175.5928 36 K 3.9518 8.7193 129.5586 56.4172 33.2775 175.6937 37 D 4.5917 8.7269 125.5118 56.1123 41.6826 176.4490 38 G 4.1223 9.7520 113.9578 44.9467 0.0000 171.7663 39 Y 5.3047 7.9783 116.0976 56.5351 42.6663 173.8205 40 Y 5.3306 8.7753 117.8768 56.2155 41.9787 173.3866 41 L 4.6823 8.7508 120.9649 53.4418 44.4216 175.3902 42 Y 4.4586 8.1678 121.1392 57.4188 38.7094 176.5092 43 R 3.4738 8.4761 125.5468 59.3471 30.1777 178.5166 44 K 4.0800 7.7533 114.4150 58.3057 31.9264 177.3396 45 Q 4.3627 7.8652 117.2552 55.6247 29.2321 174.8412 46 I 4.6405 7.2916 119.9101 60.8586 38.1853 175.7294 47 R 4.7408 9.2370 125.3087 54.4745 34.1803 174.2356 48 I 5.1036 8.5152 123.4252 59.8596 40.6169 175.0313 49 T 4.6808 9.0613 123.5521 61.0684 71.9948 171.7541 50 P 4.8807 0.0000 0.0000 62.5800 32.9485 175.6250 51 E 4.3665 8.9854 121.5584 55.2001 32.5623 175.9065 52 H 4.2843 9.0038 121.6129 56.3880 26.2485 174.0012 53 A 5.0734 7.7968 117.9800 50.4919 22.6433 176.4221 54 K 4.6834 9.2729 119.5982 54.5465 34.5759 175.6558 55 I 5.1101 8.3020 117.7123 58.6536 40.5609 175.2072 56 A 4.3399 8.7380 125.6732 51.3864 19.2298 177.3385 57 D 4.3239 8.6873 118.8638 54.9244 41.4026 176.6560 58 V 4.1774 8.2573 122.3764 61.1602 32.7947 174.5648 59 Q 4.4933 8.5099 128.5368 54.2167 29.8339 174.8740 60 L 4.2562 8.3459 126.0221 53.7355 42.4706 175.2093 61 P 4.5375 0.0000 0.0000 61.7894 32.4481 175.3733 62 Q 4.3426 8.5535 120.2810 55.8100 29.5985 175.1557 63 G 4.3697 9.3257 117.9515 44.6356 0.0000 172.4511 64 V 4.4892 7.9666 112.9550 59.3475 35.2018 175.2448 65 W 4.9988 8.6461 121.8983 56.3330 30.6990 175.3390 66 H 4.9449 9.1171 121.4774 54.9575 33.5092 171.5864 67 E 5.3376 8.3655 122.8986 54.8298 32.0885 174.7381 68 D 4.9531 8.9651 122.5425 52.2043 43.3481 175.8448 69 E 4.1441 8.9278 116.9057 58.2167 29.6400 178.4083 70 F 3.8586 8.1697 117.4705 59.8335 39.1468 175.4124 71 Y 4.6989 9.0141 116.0305 57.2455 40.2071 177.2136 72 G 4.0816 8.0811 114.3817 46.8934 0.0000 176.7592 73 K 5.2351 8.8236 129.3558 54.0155 32.4705 174.4700 74 S 4.9920 9.0699 119.1137 56.1490 67.4273 172.4580 75 E 3.8673 8.1982 121.4318 55.0292 30.5580 174.9538 76 I 4.8334 8.6230 119.5255 59.1907 41.9515 173.4501 77 Y 5.2519 8.7533 120.0729 56.4019 40.7768 175.3980 78 R 4.8718 8.5096 121.2758 55.6313 33.9428 174.2122 79 D 4.8684 10.0496 122.3967 54.0582 39.2124 173.7732 80 R 5.0377 7.2058 116.0846 55.3532 33.3742 172.9503 81 L 4.5927 8.9973 126.6153 53.4968 44.9107 174.9510 82 T 5.0529 8.5145 122.6477 61.7305 70.9450 173.5550 83 L 4.7553 9.1870 128.6399 52.4807 45.0099 173.5627 84 P 4.9628 0.0000 0.0000 62.7039 32.4369 175.8771 85 V 4.5143 9.2994 122.6956 61.4537 35.1531 174.0495 86 T 4.9270 8.4859 123.3852 62.1454 70.9256 173.4853 87 I 4.4404 8.9362 128.9345 60.1650 37.7935 176.4133 88 N 4.6949 9.3611 127.0251 55.9188 39.8607 175.3746 89 Q 4.8161 7.9040 117.2757 54.9468 33.0998 173.3903 90 A 4.9963 9.0828 126.3815 50.7435 23.0801 176.4995 91 S 4.7903 9.1140 119.2612 57.5992 64.8595 173.6559 92 A 4.1835 8.3227 124.5985 53.6748 18.3465 178.1007 93 G 3.8855 8.9831 111.1677 44.8028 0.0000 173.3041 94 A 4.5164 7.7543 121.9911 52.4671 19.8067 176.8706 95 T 5.1117 8.8608 108.8408 59.9985 73.4357 172.2950 96 L 5.0693 8.7082 123.5289 53.5998 45.1497 175.0062 97 T 4.8075 9.0729 123.8043 62.3175 70.3861 173.8250 98 V 4.8389 9.0139 127.5302 61.4856 33.9635 174.3216 99 T 5.2423 9.0055 125.2647 62.2099 71.8515 172.8597 100 Y 5.2022 8.0030 121.0384 57.2108 42.0532 172.9834 101 Q 4.6816 8.5131 120.5573 54.5747 32.9817 173.6880 102 G 3.9367 8.5215 111.3375 44.7651 0.0000 171.2150 103 C 5.4153 8.7200 116.4776 54.8928 46.3238 172.8360 104 A 4.5659 7.8912 121.5349 49.9378 20.4572 177.7657 105 D 4.5092 8.8031 121.8049 57.3284 41.5180 178.8802 106 A 4.0325 7.8214 119.9667 53.1118 18.7186 177.1437 107 G 4.4494 7.9553 106.2930 45.4126 0.0000 173.5789 108 F 5.2011 7.6876 111.7647 55.5090 41.0050 173.3599 109 C 5.1085 8.6238 118.2510 55.2711 42.8468 173.6909 110 Y 4.7984 8.7504 120.2682 56.8849 38.6463 173.6961 111 P 4.6582 0.0000 0.0000 61.9367 32.5037 174.3849 112 P 4.5225 0.0000 0.0000 63.1354 32.1367 175.6268 113 E 4.6501 8.9520 122.0436 54.7394 32.9531 175.1147 114 T 5.0278 8.2354 118.4171 61.6616 72.0497 173.4142 115 K 4.6309 9.2545 124.7885 54.8217 35.8369 175.1616 116 T 4.8732 8.4674 120.3378 61.9279 70.3638 173.9052 117 V 3.7619 8.7873 128.2243 60.6475 33.0450 173.0998 118 P 4.6253 0.0000 0.0000 62.6466 31.8843 175.6242 119 L 4.6459 8.4328 125.5163 53.3962 42.7786 177.2408 120 S 4.3292 9.3308 120.2277 57.9183 63.5676 173.9244 121 E 4.2378 8.5722 124.7379 56.6330 30.4297 176.2245 122 V 4.3220 8.6501 125.4469 60.9892 34.5709 174.6185 123 V 4.1519 8.5014 128.1234 61.9973 32.4636 175.6956 124 A 4.7510 8.5813 128.1166 52.1183 18.1804 177.2498 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 4 D 8.36 4.49 0.00 2.65 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 5 A 8.55 3.95 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 6 P 0.00 4.28 0.00 2.21 2.09 0.00 3.93 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 7 G 8.67 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 7.92 4.61 0.00 1.79 1.78 0.00 3.25 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.14 0.00 9 S 8.12 4.83 0.00 4.02 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 10 Q 8.06 4.49 0.00 2.38 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.57 0.00 0.00 0.00 0.00 0.00 2.47 2.30 0.00 11 F 8.03 4.93 0.00 2.40 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 12 V 7.62 3.95 2.15 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 0.83 0.00 0.00 0.83 0.00 0.00 13 P 0.00 4.05 0.00 2.06 1.91 0.00 3.65 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 1.99 0.00 14 A 8.63 3.18 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 15 D 7.92 4.71 0.00 2.71 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 7.82 3.94 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.30 2.21 0.00 17 A 7.46 3.15 -0.14 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 0.00 0.00 18 F 7.65 5.34 0.00 3.12 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 19 A 9.18 4.53 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.71 4.72 0.00 2.73 2.91 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 21 D 7.78 4.42 0.00 2.40 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 0.00 0.00 0.00 22 F 7.34 5.18 0.00 2.86 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 23 Q 9.04 4.47 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.79 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 24 Q 8.86 5.02 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.05 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 25 N 9.24 4.85 0.00 2.64 2.64 0.00 0.00 7.05 7.38 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 26 Q 8.42 3.32 0.00 2.24 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 27 H 9.07 4.57 0.00 3.18 3.41 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 D 8.28 5.20 0.00 2.69 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 9.00 5.13 0.00 1.73 1.67 0.97 0.22 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 30 N 9.33 5.31 0.00 2.79 2.59 0.00 0.00 6.79 6.60 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 31 L 9.03 4.96 0.00 1.70 1.24 1.12 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.04 5.16 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 1.15 0.00 0.00 33 W 9.64 5.15 0.00 3.15 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 34 Q 9.38 4.66 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 35 I 8.43 4.91 2.12 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 1.42 0.94 1.27 0.00 0.00 36 K 8.72 3.95 0.00 1.63 1.49 0.00 1.48 0.00 0.00 1.11 0.00 0.00 2.82 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.39 7.81 37 D 8.73 4.59 0.00 2.72 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 38 G 9.75 4.12 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 0.00 0.00 0.00 39 Y 7.98 5.30 0.00 2.95 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 Y 8.78 5.33 0.00 3.05 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 41 L 8.75 4.68 0.00 1.54 1.34 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 42 Y 8.17 4.46 0.00 2.78 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 43 R 8.48 3.47 0.00 0.86 1.58 0.00 3.05 0.00 0.00 3.09 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.53 0.00 44 K 7.75 4.08 0.00 1.55 1.67 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.30 7.81 45 Q 7.87 4.36 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.97 0.00 0.00 0.00 0.00 0.00 2.09 2.60 0.00 46 I 7.29 4.64 1.85 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 1.06 0.52 0.94 0.00 0.00 47 R 9.24 4.74 0.00 1.71 1.78 0.00 3.05 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 48 I 8.52 5.10 1.93 0.00 0.00 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 1.50 0.73 0.97 0.00 0.00 49 T 9.06 4.68 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 50 P 0.00 4.88 0.00 2.25 2.04 0.00 3.70 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 1.98 2.00 0.00 51 E 8.99 4.37 0.00 1.87 1.76 0.00 0.00 0.00 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 2.23 0.00 52 H 9.00 4.28 0.00 3.39 3.38 0.00 5.61 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.80 5.07 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 54 K 9.27 4.68 0.00 1.65 1.72 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.35 7.81 55 I 8.30 5.11 1.95 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 1.29 0.69 0.92 0.00 0.00 56 A 8.74 4.34 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 57 D 8.69 4.32 0.00 2.69 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 8.26 4.18 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 0.84 0.00 0.00 0.97 0.00 0.00 59 Q 8.51 4.49 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.75 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 60 L 8.35 4.26 0.00 1.74 1.72 0.97 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.54 0.00 2.10 2.01 0.00 3.70 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 62 Q 8.55 4.34 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.76 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 63 G 9.33 4.37 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 0.00 64 V 7.97 4.49 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 0.80 0.00 0.00 0.88 0.00 0.00 65 W 8.65 5.00 0.00 3.20 3.18 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 66 H 9.12 4.94 0.00 3.00 2.88 0.00 5.55 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.37 5.34 0.00 1.87 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.23 0.00 68 D 8.97 4.95 0.00 3.06 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 69 E 8.93 4.14 0.00 1.67 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 70 F 8.17 3.86 0.00 3.30 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 71 Y 9.01 4.70 0.00 2.92 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.08 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 73 K 8.82 5.24 0.00 1.55 1.62 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.74 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.31 1.00 7.81 74 S 9.07 4.99 0.00 3.85 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 75 E 8.20 3.87 0.00 1.16 1.14 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 1.65 1.47 0.00 76 I 8.62 4.83 1.73 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.81 0.67 0.00 0.00 77 Y 8.75 5.25 0.00 2.72 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 78 R 8.51 4.87 0.00 1.70 1.89 0.00 3.31 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.64 0.00 79 D 10.05 4.87 0.00 2.92 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 80 R 7.21 5.04 0.00 1.80 1.75 0.00 3.18 0.00 0.00 3.15 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.77 0.00 81 L 9.00 4.59 0.00 1.47 1.45 0.15 -0.08 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 82 T 8.51 5.05 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 1.25 0.00 0.00 83 L 9.19 4.76 0.00 1.89 1.76 0.95 0.83 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 84 P 0.00 4.96 0.00 2.13 2.04 0.00 3.78 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 85 V 9.30 4.51 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 1.08 0.00 0.00 0.99 0.00 0.00 86 T 8.49 4.93 4.26 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 1.24 0.00 0.00 87 I 8.94 4.44 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.22 0.94 0.00 0.00 88 N 9.36 4.69 0.00 2.76 2.88 0.00 0.00 6.06 7.13 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 89 Q 7.90 4.82 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.83 0.00 0.00 0.00 0.00 0.00 2.53 2.32 0.00 90 A 9.08 5.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.11 4.79 0.00 3.79 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.32 4.18 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 93 G 8.98 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 94 A 7.75 4.52 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 95 T 8.86 5.11 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 1.23 0.00 0.00 96 L 8.71 5.07 0.00 1.68 1.44 0.97 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 97 T 9.07 4.81 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 98 V 9.01 4.84 1.94 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 1.04 0.00 0.00 1.02 0.00 0.00 99 T 9.01 5.24 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 1.20 0.00 0.00 100 Y 8.00 5.20 0.00 2.76 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 8.51 4.68 0.00 2.10 2.00 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 2.39 2.51 0.00 102 G 8.52 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 0.00 103 C 8.72 5.42 0.00 1.50 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 0.00 104 A 7.89 4.57 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 D 8.80 4.51 0.00 2.49 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 7.82 4.03 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 0.00 107 G 7.96 4.45 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 0.00 108 F 7.69 5.20 0.00 3.11 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 0.00 109 C 8.62 5.11 0.00 2.42 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Y 8.75 4.80 0.00 3.21 3.09 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 0.00 111 P 0.00 4.66 0.00 2.12 2.12 0.00 3.86 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.23 0.00 112 P 0.00 4.52 0.00 1.91 1.99 0.00 3.64 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 2.14 0.00 113 E 8.95 4.65 0.00 1.16 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 2.11 2.22 0.00 114 T 8.24 5.03 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 1.16 0.00 0.00 115 K 9.25 4.63 0.00 1.19 1.56 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.25 0.90 7.81 116 T 8.47 4.87 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 1.18 0.00 0.00 117 V 8.79 3.76 1.91 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 0.02 0.00 0.00 0.74 0.00 0.00 118 P 0.00 4.63 0.00 2.14 2.06 0.00 3.40 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 2.11 2.08 0.00 119 L 8.43 4.65 0.00 1.64 1.61 0.95 0.71 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 0.00 120 S 9.33 4.33 0.00 3.92 3.79 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 0.00 121 E 8.57 4.24 0.00 1.97 1.84 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 2.28 2.37 0.00 122 V 8.65 4.32 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 0.67 0.00 0.00 0.95 0.00 0.00 123 V 8.50 4.15 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 0.82 0.00 0.00 0.93 0.00 0.00 124 A 8.58 4.75 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