NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3370 0.0000 0.0000 61.7397 32.5786 180.0575 3 R 3.8759 8.9316 130.1846 57.5604 29.8878 174.2258 4 A 5.3124 8.3284 130.7301 53.1440 22.2761 177.0442 5 K 4.1887 7.5021 120.7844 57.7641 30.5651 177.8625 6 T 4.0461 8.1856 111.7425 64.4690 69.0357 176.2892 7 G 3.8995 8.5139 108.9485 48.2976 0.0000 175.7558 8 V 3.5232 8.0801 114.4287 64.1199 31.4937 178.4668 9 V 3.4852 7.7233 116.2614 66.7066 31.4504 178.3688 10 R 3.7742 8.3322 117.9829 59.2786 29.9811 178.4416 11 R 3.9305 8.0431 116.1451 60.5508 29.0279 178.0285 12 R 4.0297 8.6399 119.1192 57.4327 29.8139 179.6960 13 K 4.3941 8.7185 118.1776 60.1815 32.3192 178.0518 14 H 4.2981 8.7304 117.2935 58.1747 28.5990 177.3638 15 K 3.7591 8.7057 121.6324 59.9206 31.9424 178.3107 16 K 3.7659 8.4580 119.8725 59.9210 31.9291 178.2479 17 I 3.5944 8.0368 119.6468 64.4462 36.8986 177.5970 18 L 3.7586 7.8094 120.1963 58.4635 41.8797 178.8660 19 K 4.0601 8.1025 117.9724 59.3406 32.2055 178.2789 20 L 4.1773 7.8118 118.2710 56.9554 41.6839 177.5533 21 A 4.3219 7.9076 124.6041 52.4911 18.4266 177.6627 22 K 3.9893 9.1959 122.7087 60.8704 32.8313 176.9214 23 G 3.2981 7.7114 107.7359 45.1652 0.0000 173.9602 24 Y 4.3095 7.5936 121.7723 56.9534 38.0163 179.6881 25 W 3.9828 9.6523 135.0000 58.2515 30.5185 174.8735 26 G 4.7986 7.9124 114.2025 45.9462 0.0000 171.2434 27 L 4.5586 9.4377 127.0322 54.8346 39.2889 176.2596 28 R 4.4788 7.9184 110.8451 56.4352 30.2406 177.0622 29 S 4.7203 8.2412 113.9074 60.0079 64.2870 176.0027 30 K 3.9356 8.0530 119.4381 57.7429 32.8781 179.1729 31 S 4.1536 8.7161 114.4669 58.9270 63.5742 178.5375 32 F 3.3710 8.5611 119.4503 58.3247 40.6445 177.8951 33 R 4.0003 6.9727 122.9188 59.4971 30.3262 176.3740 34 K 3.8693 9.3854 122.7975 59.9485 32.8528 176.5010 35 A 4.7254 8.3490 122.8080 53.3042 18.1262 179.9513 36 R 3.7697 9.5927 114.7257 59.4255 30.5798 178.1075 37 E 3.7907 8.9793 117.5961 59.9498 29.3372 179.6404 38 T 3.8159 8.6823 109.6735 65.1969 68.9194 175.8315 39 L 3.7376 8.2041 123.2159 57.9462 42.1501 178.6811 40 F 3.8929 8.8595 117.4561 60.9025 38.6120 177.2413 41 A 3.8482 8.2201 119.1196 55.6482 18.4597 178.8988 42 A 4.2193 8.7699 117.6923 56.3302 18.3606 180.0103 43 G 3.6198 8.7856 100.7422 48.2561 0.0000 175.2139 44 N 3.5291 8.4962 118.8073 56.0249 38.6346 176.3520 45 Y 4.2865 8.4602 118.1039 60.8431 37.7887 178.1402 46 A 4.2328 8.3048 120.8806 56.3435 18.6941 178.3127 47 Y 3.9363 8.8253 109.7134 62.7503 37.8143 178.4627 48 A 4.1104 8.0950 125.2477 56.5508 19.1086 178.4407 49 H 4.2134 8.7535 113.6267 59.1630 28.3119 177.3220 50 R 3.9694 8.0913 124.8439 59.8969 30.6456 177.8674 51 K 3.9225 8.0068 117.0701 59.7879 32.4721 178.1949 52 R 4.2294 8.9013 114.3344 58.1244 30.3609 179.3951 53 R 4.9935 8.1620 120.7052 61.0503 30.3118 176.6352 54 K 3.9295 8.8039 117.9703 59.1204 31.7577 179.5842 55 R 3.8282 8.8920 118.1878 60.1296 30.3128 177.7895 56 D 4.2058 8.5346 115.8783 58.9782 40.6533 179.0463 57 F 4.0015 9.2057 118.1368 60.7193 39.4392 177.9172 58 R 3.9851 8.6080 116.4356 59.8220 28.9431 178.7431 59 R 3.9519 8.8127 119.5761 59.4272 30.1664 179.6771 60 L 3.5744 8.1656 117.6833 57.1899 41.4519 179.6863 61 W 4.1414 9.7972 118.9341 61.2102 29.2145 180.1434 62 I 3.5106 8.0793 119.4090 63.9216 36.4370 177.6626 63 V 3.5695 8.3899 119.6309 65.6280 31.4822 178.3278 64 R 3.8177 8.2309 117.5425 59.9554 29.9398 178.3133 65 I 3.8530 8.6514 120.0379 63.8400 37.0279 178.6149 66 N 4.0311 8.6771 117.0986 56.7707 38.4924 176.4227 67 A 3.8321 8.5454 121.3794 56.4519 18.2252 179.4733 68 A 4.0387 8.6170 117.3141 54.7781 18.6939 179.4245 69 C 3.9754 8.6075 113.5233 61.8967 29.3301 176.6727 70 R 3.9896 8.1326 119.6276 58.6342 29.7821 178.4253 71 Q 4.1372 7.9662 116.9506 59.7049 28.8197 179.3769 72 H 4.5392 8.4919 115.7701 58.5063 29.0521 176.2048 73 G 4.0801 8.7344 106.4827 44.8178 0.0000 172.0449 74 L 4.8041 7.7302 119.3470 51.6249 45.7614 175.8980 75 N 4.2117 8.5582 119.0055 52.8324 39.2536 173.4159 76 Y 4.6966 9.8682 120.3307 60.6924 38.3719 179.2158 77 S 3.6268 7.6393 111.4905 60.5191 64.6189 176.1227 78 T 3.8777 8.8987 114.0318 64.6346 68.4799 175.5083 79 F 4.3534 8.7872 124.1486 60.6862 39.2603 176.9206 80 I 2.3951 7.6948 118.7762 64.8592 36.9129 177.2774 81 H 3.9928 8.2699 118.0216 59.6310 29.6398 176.6434 82 G 3.8767 8.3313 106.9392 48.0619 0.0000 174.6365 83 L 3.8793 7.6537 122.7009 57.5806 42.0165 179.1016 84 K 3.9562 7.8237 118.0491 59.4889 32.3730 178.3001 85 K 3.9908 7.9726 118.4858 58.2225 31.9302 175.7188 86 A 4.0172 7.7886 121.6269 52.7072 19.9804 177.0097 87 G 3.9326 8.5434 105.1843 48.3709 0.0000 174.1886 88 I 4.1759 8.9058 123.2609 60.9779 37.1962 174.8460 89 E 4.4728 7.2883 117.8741 54.7836 30.7974 175.9846 90 V 3.9950 8.0874 119.6913 62.4814 34.2782 171.3897 91 D 4.4607 8.1905 124.6057 53.6984 44.1829 175.2774 92 R 4.2756 8.5249 126.2973 58.4084 31.0029 179.8061 93 K 2.7704 7.4751 115.8243 55.3989 31.3503 177.3846 94 N 6.1216 9.8423 115.7207 54.3565 44.5871 177.5379 95 L 4.3842 7.7010 115.7348 57.7769 41.6519 178.9651 96 A 3.9186 9.0115 120.1334 55.9943 18.2045 179.3182 97 D 4.3640 8.0806 116.2449 57.3456 40.9863 179.6149 98 L 4.1182 8.3790 119.0969 57.7381 41.8096 179.2758 99 A 3.6940 6.5738 118.9688 55.2581 18.0051 179.4920 100 V 3.5906 7.4324 111.1567 64.3435 31.6946 178.5104 101 R 4.2126 8.4675 117.4707 57.8895 31.1821 176.7334 102 E 4.6821 8.2844 119.0953 52.0646 30.0188 173.9398 103 P 4.3084 0.0000 0.0000 66.6003 31.3153 177.9950 104 Q 4.0455 8.3729 117.3562 58.3287 28.6541 178.8267 105 V 4.6758 8.2689 121.5897 65.7202 31.5215 178.1858 106 F 3.8633 8.8923 118.8154 60.0407 38.7941 178.6006 107 A 3.8244 8.4397 120.1997 54.4598 18.7774 179.2368 108 E 3.9609 8.4564 117.6631 59.1197 29.9160 179.1066 109 L 3.7548 7.9367 121.1476 57.6240 41.6117 178.8698 110 V 3.4306 8.5323 118.4437 63.9828 30.8932 178.1162 111 E 3.8080 8.0590 116.6135 59.4936 30.1886 179.8547 112 R 3.9467 8.2236 119.9621 58.5447 30.2475 178.9232 113 A 4.0189 8.2504 120.8760 54.8770 18.3589 179.3639 114 K 3.8012 8.4227 117.6980 60.4246 32.2162 178.9178 115 A 4.0451 8.5304 121.9521 55.3562 18.1223 180.1804 116 A 3.8068 7.9521 118.3681 54.9131 18.8033 179.5844 117 Q 4.0733 7.8643 115.5756 59.5407 29.1372 176.6482 118 G 3.6023 7.6716 112.0381 45.1300 0.0000 172.8116 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 2 P 0.00 4.34 0.00 2.06 1.27 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 3 R 8.93 3.88 0.00 1.88 1.94 0.00 3.32 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 4 A 8.33 5.31 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 5 K 7.50 4.19 0.00 1.80 1.75 0.00 1.76 0.00 0.00 1.87 0.00 0.00 3.18 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.44 7.81 6 T 8.19 4.05 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 1.24 0.00 0.00 7 G 8.51 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 8 V 8.08 3.52 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 0.82 0.00 0.00 0.96 0.00 0.00 9 V 7.72 3.49 2.14 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 1.12 0.00 0.00 0.95 0.00 0.00 10 R 8.33 3.77 0.00 1.88 1.84 0.00 3.13 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 1.24 1.48 0.00 11 R 8.04 3.93 0.00 2.09 2.40 0.00 2.84 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 12 R 8.64 4.03 0.00 2.11 1.92 0.00 3.16 0.00 0.00 3.17 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.01 0.00 13 K 8.72 4.39 0.00 1.80 1.88 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.67 1.69 7.81 14 H 8.73 4.30 0.00 3.54 3.34 0.00 5.67 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.71 3.76 0.00 1.81 1.86 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.47 7.81 16 K 8.46 3.77 0.00 1.84 2.10 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.50 7.81 17 I 8.04 3.59 2.02 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 1.81 0.77 0.88 0.00 0.00 18 L 7.81 3.76 0.00 1.45 2.24 0.87 0.45 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 19 K 8.10 4.06 0.00 1.78 1.89 0.00 1.89 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.47 7.81 20 L 7.81 4.18 0.00 1.67 1.74 0.82 0.82 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 21 A 7.91 4.32 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 22 K 9.20 3.99 0.00 1.19 1.66 0.00 1.47 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.47 7.81 23 G 7.71 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 7.59 4.31 0.00 3.10 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 25 W 9.65 3.98 0.00 3.50 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 26 G 7.91 4.80 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 0.00 0.00 0.00 27 L 9.44 4.56 0.00 1.95 2.16 1.01 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 28 R 7.92 4.48 0.00 1.98 2.10 0.00 3.31 0.00 0.00 3.37 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.68 0.00 29 S 8.24 4.72 0.00 4.11 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 8.05 3.94 0.00 1.90 1.88 0.00 1.78 0.00 0.00 1.93 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.65 1.44 7.81 31 S 8.72 4.15 0.00 4.20 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 F 8.56 3.37 0.00 3.22 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 33 R 6.97 4.00 0.00 1.91 1.81 0.00 3.11 0.00 0.00 3.16 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 34 K 9.39 3.87 0.00 1.85 1.91 0.00 1.73 0.00 0.00 1.81 0.00 0.00 3.30 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.49 7.81 35 A 8.35 4.73 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 36 R 9.59 3.77 0.00 2.25 2.34 0.00 3.26 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.04 0.00 37 E 8.98 3.79 0.00 2.04 1.89 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 2.03 2.20 0.00 38 T 8.68 3.82 4.01 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 1.24 0.00 0.00 39 L 8.20 3.74 0.00 1.62 1.50 0.88 1.11 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 40 F 8.86 3.89 0.00 2.99 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 41 A 8.22 3.85 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.77 4.22 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 43 G 8.79 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.50 3.53 0.00 2.47 2.73 0.00 0.00 7.18 7.26 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 45 Y 8.46 4.29 0.00 3.24 2.80 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 46 A 8.30 4.23 1.47 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 0.00 0.00 47 Y 8.83 3.94 0.00 3.23 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 48 A 8.10 4.11 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 49 H 8.75 4.21 0.00 3.48 3.25 0.00 5.65 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.09 3.97 0.00 1.83 2.09 0.00 3.30 0.00 0.00 3.65 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.84 0.00 51 K 8.01 3.92 0.00 2.01 1.89 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.69 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.57 7.81 52 R 8.90 4.23 0.00 2.08 2.22 0.00 2.92 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 53 R 8.16 4.99 0.00 2.12 2.04 0.00 3.26 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.11 0.00 54 K 8.80 3.93 0.00 2.04 1.79 0.00 1.71 0.00 0.00 1.86 0.00 0.00 3.21 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.64 7.81 55 R 8.89 3.83 0.00 2.02 1.99 0.00 3.21 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 56 D 8.53 4.21 0.00 3.07 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 57 F 9.21 4.00 0.00 3.36 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 R 8.61 3.99 0.00 2.05 2.29 0.00 2.82 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.72 0.00 59 R 8.81 3.95 0.00 1.98 2.02 0.00 3.34 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.83 0.00 60 L 8.17 3.57 0.00 1.86 1.36 0.77 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 61 W 9.80 4.14 0.00 3.38 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 8.08 3.51 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.92 0.78 0.00 0.00 63 V 8.39 3.57 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 1.01 0.00 0.00 0.87 0.00 0.00 64 R 8.23 3.82 0.00 1.86 1.87 0.00 2.94 0.00 0.00 2.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.84 0.00 65 I 8.65 3.85 2.39 0.00 0.00 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 1.93 1.00 1.62 0.00 0.00 66 N 8.68 4.03 0.00 2.77 2.77 0.00 0.00 7.02 6.63 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 67 A 8.55 3.83 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 68 A 8.62 4.04 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 69 C 8.61 3.98 0.00 3.25 3.23 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 70 R 8.13 3.99 0.00 1.90 2.09 0.00 3.33 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.02 0.00 71 Q 7.97 4.14 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.98 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 72 H 8.49 4.54 0.00 3.07 3.37 0.00 5.79 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.73 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 74 L 7.73 4.80 0.00 1.66 1.63 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.56 4.21 0.00 2.80 2.88 0.00 0.00 6.67 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 76 Y 9.87 4.70 0.00 3.26 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 77 S 7.64 3.63 0.00 4.11 4.01 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 78 T 8.90 3.88 4.32 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 1.26 0.00 0.00 79 F 8.79 4.35 0.00 3.13 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 80 I 7.69 2.40 1.59 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 -0.36 0.56 0.00 0.00 81 H 8.27 3.99 0.00 3.41 3.55 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.33 3.88 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 0.00 0.00 0.00 83 L 7.65 3.88 0.00 0.90 1.49 1.13 0.66 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 84 K 7.82 3.96 0.00 1.62 1.87 0.00 1.72 0.00 0.00 1.57 0.00 0.00 3.03 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.42 7.81 85 K 7.97 3.99 0.00 1.64 1.90 0.00 1.79 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.43 7.81 86 A 7.79 4.02 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 87 G 8.54 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 I 8.91 4.18 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 1.46 0.85 0.90 0.00 0.00 89 E 7.29 4.47 0.00 2.07 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 0.00 2.17 2.18 0.00 90 V 8.09 4.00 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 0.63 0.00 0.00 0.97 0.00 0.00 91 D 8.19 4.46 0.00 2.74 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 92 R 8.52 4.28 0.00 1.87 1.80 0.00 3.12 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.75 0.00 93 K 7.48 2.77 0.00 1.48 1.22 0.00 1.06 0.00 0.00 0.61 0.00 0.00 2.56 0.00 0.00 2.23 0.00 0.00 0.00 0.00 1.03 1.00 7.81 94 N 9.84 6.12 0.00 2.69 2.95 0.00 0.00 6.96 6.62 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 95 L 7.70 4.38 0.00 2.32 2.40 1.30 1.06 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 96 A 9.01 3.92 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 97 D 8.08 4.36 0.00 3.12 2.85 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 98 L 8.38 4.12 0.00 2.29 2.10 1.02 1.23 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 99 A 6.57 3.69 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.43 3.59 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 0.64 0.00 0.00 0.87 0.00 0.00 101 R 8.47 4.21 0.00 1.95 2.05 0.00 3.05 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.70 0.00 102 E 8.28 4.68 0.00 2.09 2.03 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 2.24 2.28 0.00 103 P 0.00 4.31 0.00 2.28 2.36 0.00 3.82 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 104 Q 8.37 4.05 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.71 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 105 V 8.27 4.68 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 1.11 0.00 0.00 1.07 0.00 0.00 106 F 8.89 3.86 0.00 3.08 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 0.00 107 A 8.44 3.82 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.46 3.96 0.00 2.43 2.16 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 2.26 2.34 0.00 109 L 7.94 3.75 0.00 1.20 1.61 0.80 0.69 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 0.00 110 V 8.53 3.43 2.49 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 1.04 0.00 0.00 0.57 0.00 0.00 111 E 8.06 3.81 0.00 2.22 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 0.00 2.43 2.35 0.00 112 R 8.22 3.95 0.00 1.84 2.01 0.00 3.12 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 113 A 8.25 4.02 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.42 3.80 0.00 1.98 2.12 0.00 1.33 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.86 1.40 7.81 115 A 8.53 4.05 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 0.00 116 A 7.95 3.81 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 0.00 117 Q 7.86 4.07 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.12 0.00 0.00 0.00 0.00 0.00 2.70 2.53 0.00 118 G 7.67 3.60 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 0.00 0.00 0.00