NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5925 8.3649 120.1922 53.8410 42.8672 176.2040 3 K 4.2974 7.8219 114.0343 55.5965 33.5874 174.8022 4 I 4.1506 8.3042 121.9127 61.0211 39.0550 175.1713 5 I 3.9965 8.7663 128.3356 61.0385 38.4537 174.9717 6 H 4.9686 8.7478 125.0883 54.6664 28.3035 175.1310 7 L 4.5409 8.8768 124.1886 54.4134 42.5806 176.5264 8 T 4.8490 8.1694 110.1307 59.6441 71.8330 173.5955 9 D 4.4379 8.6854 120.7154 58.4229 41.1939 179.7098 10 D 4.4413 8.0894 118.9713 57.1438 41.2080 177.6928 11 S 4.5261 8.1184 111.8485 58.6213 63.9718 175.9014 12 F 3.9179 8.3855 124.0458 61.8815 39.0966 175.7495 13 D 4.3652 8.4798 116.6973 58.3788 40.6207 178.6341 14 T 3.7981 7.6546 114.9205 66.9460 68.8000 176.2135 15 D 4.3775 8.0836 119.3386 56.0346 40.5580 177.3651 16 V 3.7253 7.4345 116.4954 64.3587 32.7471 177.7261 17 L 3.9442 7.3893 116.5889 57.3348 41.7083 178.0798 18 K 4.3069 8.0037 115.1568 55.9728 32.1561 176.3721 19 A 4.1753 7.4305 123.5298 51.8537 19.0925 177.5780 20 D 4.8001 8.6726 123.6497 50.3573 40.2030 176.7672 21 G 3.7018 6.9192 106.8526 44.6479 0.0000 168.0220 22 A 5.7802 8.0100 121.8767 50.2034 21.0704 176.8001 23 I 4.8523 8.2117 122.7145 59.3410 40.8551 174.6399 24 L 4.8160 8.7070 130.3863 54.2793 42.5303 175.1141 25 V 4.4725 9.2261 127.9010 61.9888 33.3005 174.0287 26 D 5.2387 9.1229 128.4809 52.8739 42.9388 175.0687 27 F 5.0485 9.5843 127.2719 56.2400 40.3263 175.2598 28 W 5.5594 8.4549 120.6991 55.2324 32.4065 173.3841 29 A 3.9228 7.9806 119.3489 49.8745 21.4575 177.1393 30 E 4.1132 8.2160 120.5888 58.7252 29.9134 177.9307 31 W 4.4612 7.1648 113.1377 57.0114 29.0714 176.7847 32 C 4.7984 7.5494 120.7672 55.2398 39.0723 173.7377 33 G 3.6546 8.7428 115.6034 47.7018 0.0000 172.7892 34 P 4.2950 0.0000 0.0000 65.2093 30.9112 179.2583 35 C 4.2447 8.1976 114.8225 60.2342 39.9921 176.3252 36 K 3.7855 7.7076 117.9557 59.5308 31.6456 179.1353 37 M 4.2017 7.8258 118.6719 58.0454 32.0864 178.3033 38 I 3.8974 7.6867 112.1128 62.7478 37.8375 177.8964 39 A 3.7687 7.4434 123.1982 54.7095 18.1794 177.6211 40 P 4.5586 0.0000 0.0000 64.5888 31.5230 178.5312 41 I 3.8744 7.4394 120.0886 64.2302 37.1604 177.7658 42 L 3.9523 8.1515 120.2189 57.8359 41.4636 179.2440 43 D 4.3139 7.8079 118.7228 57.5576 40.6943 178.8268 44 E 4.1276 7.8489 117.5514 59.3064 29.4761 179.3721 45 I 3.7862 7.8676 119.7872 64.3897 36.9183 178.3478 46 A 4.0378 8.0210 120.8005 54.9115 18.2192 179.1211 47 E 4.0399 7.6181 116.7550 59.6242 29.9161 178.6176 48 E 4.1822 8.4251 117.3925 58.5064 29.8838 177.5283 49 Y 4.6139 8.1781 116.3863 56.5641 39.2047 175.3673 50 Q 4.1906 7.7515 119.8360 57.7508 29.0964 175.9893 51 G 4.1372 9.1354 111.6251 45.4933 0.0000 174.4079 52 K 4.3069 7.9981 117.5344 57.8087 33.0064 175.8296 53 L 4.9443 7.7516 115.5355 54.9494 44.1976 175.0357 54 T 4.6969 8.6524 114.7840 61.7289 72.2278 173.7079 55 V 4.6861 8.2751 124.4424 61.8652 33.7487 174.3955 56 A 5.0983 8.7101 127.5308 50.3283 22.9222 175.0730 57 K 4.9259 9.3356 120.0721 54.6877 36.0640 175.4597 58 L 4.7073 8.9538 124.8907 52.8240 43.6821 173.3975 59 N 3.8936 8.4727 123.3333 52.9421 39.8376 174.7995 60 I 4.2063 8.4885 119.8057 61.8969 38.3733 177.5527 61 D 4.5885 7.9820 122.1927 56.5584 41.6364 177.7946 62 Q 4.1110 8.4609 117.6340 57.9744 28.6114 175.8466 63 N 4.9119 8.3996 116.1991 50.5592 39.0858 172.7975 64 P 4.5694 0.0000 0.0000 64.0722 32.4763 179.0063 65 G 3.7600 8.0622 108.1410 49.0308 0.0000 175.0479 66 T 3.8447 7.9684 117.3882 66.0751 68.8300 176.8084 67 A 3.8359 8.1387 122.7539 54.6188 18.2634 177.6669 68 P 4.1702 0.0000 0.0000 65.6517 31.1546 178.8812 69 K 3.7711 7.6922 116.2062 58.7025 31.8451 177.3309 70 Y 4.3979 7.4007 114.2496 56.9022 38.0040 175.4068 71 G 3.9466 8.0584 107.5790 46.3285 0.0000 174.4614 72 I 3.8235 7.4013 120.2754 61.3918 37.3968 177.5705 73 R 4.6299 7.8225 124.2758 54.0054 31.3242 175.1245 74 G 4.6237 7.2840 112.9651 45.4983 0.0000 172.8755 75 I 4.7918 8.0140 117.3444 57.8085 40.7570 173.3725 76 P 4.8219 0.0000 0.0000 63.3657 32.9028 174.9570 77 T 5.0284 8.8057 118.2455 61.8795 71.9076 172.7389 78 L 5.2906 8.9736 126.8181 53.2107 43.9662 175.2899 79 L 5.0413 8.9826 124.4072 52.9645 44.3661 175.1830 80 L 5.0610 9.0134 126.4536 53.8132 43.7306 174.9559 81 F 5.2081 9.8093 125.6389 55.8128 41.8017 175.1158 82 K 4.6092 8.7886 122.0389 54.5333 34.3935 176.3160 83 N 4.4408 9.2403 125.1313 53.1825 36.5270 175.8132 84 G 4.0831 8.7518 104.2720 45.1870 0.0000 173.1260 85 E 4.7098 7.9618 119.9541 53.9057 31.9561 175.5764 86 V 3.5518 8.4824 123.7976 63.0582 31.8849 175.0398 87 A 4.5089 8.7756 129.3639 53.5638 20.4153 177.2272 88 A 4.5465 7.4569 114.6367 51.3664 22.6596 175.5243 89 T 5.1033 8.8341 118.6295 61.5621 71.7021 173.5202 90 K 4.3960 9.0599 126.7720 54.5125 35.3212 174.7154 91 V 4.6090 8.7295 127.0772 62.2950 33.5802 176.1287 92 G 3.9589 9.0703 112.7460 44.8521 0.0000 172.8883 93 A 4.1847 7.9857 121.5900 52.1049 18.9448 176.7918 94 L 4.6479 7.7660 118.9727 53.2565 43.4377 176.0933 95 S 4.4852 8.8952 115.7912 57.3164 65.3813 175.1611 96 K 3.9820 8.5223 122.0100 59.7240 31.9348 178.7908 97 G 3.6028 8.0386 105.4572 47.6362 0.0000 175.7227 98 Q 4.0384 8.1039 120.3726 58.6892 28.7812 178.2974 99 L 3.9425 8.1387 121.5846 57.9416 42.0639 178.4855 100 K 3.8362 8.2547 119.7886 59.9109 32.1087 178.0248 101 E 3.9672 8.1308 118.6339 59.2915 29.2930 178.4492 102 F 4.1561 8.6200 120.9392 61.4174 39.3917 177.1137 103 L 3.8325 8.4022 118.7517 57.8044 40.9330 178.7865 104 D 4.4899 8.5346 118.9359 57.6997 40.6848 179.4076 105 A 4.2183 7.8053 120.2868 54.5774 18.4872 177.9437 106 N 4.6103 7.3996 110.7853 53.5996 39.3347 176.1395 107 L 4.1164 7.8142 117.5882 56.4412 42.2559 176.7540 108 A 4.1573 7.2637 126.2675 52.3176 18.2406 176.9696 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 D 8.36 4.59 0.00 2.63 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 3 K 7.82 4.30 0.00 1.82 1.79 0.00 1.92 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.52 7.81 4 I 8.30 4.15 1.76 0.00 0.00 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 1.26 0.40 0.70 0.00 0.00 5 I 8.77 4.00 1.78 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.52 0.86 0.00 0.00 6 H 8.75 4.97 0.00 3.04 3.35 0.00 5.89 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.88 4.54 0.00 1.67 1.71 0.90 0.55 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 8 T 8.17 4.85 4.36 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 1.24 0.00 0.00 9 D 8.69 4.44 0.00 2.84 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 10 D 8.09 4.44 0.00 2.69 2.76 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 0.00 0.00 0.00 11 S 8.12 4.53 0.00 4.04 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 12 F 8.39 3.92 0.00 3.46 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 13 D 8.48 4.37 0.00 2.92 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 14 T 7.65 3.80 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 1.18 0.00 0.00 15 D 8.08 4.38 0.00 2.50 2.57 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 0.00 0.00 0.00 0.00 16 V 7.43 3.73 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 -0.32 0.00 0.00 0.01 0.00 0.00 17 L 7.39 3.94 0.00 1.81 1.75 1.17 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.00 4.31 0.00 1.85 1.80 0.00 1.71 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 1.53 1.51 7.81 19 A 7.43 4.18 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 20 D 8.67 4.80 0.00 2.62 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 21 G 6.92 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 22 A 8.01 5.78 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 23 I 8.21 4.85 1.68 0.00 0.00 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 1.12 0.87 0.84 0.00 0.00 24 L 8.71 4.82 0.00 1.81 1.58 1.13 0.76 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 25 V 9.23 4.47 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 0.44 0.00 0.00 0.69 0.00 0.00 26 D 9.12 5.24 0.00 2.75 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 27 F 9.58 5.05 0.00 3.15 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 28 W 8.45 5.56 0.00 3.54 3.36 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 29 A 7.98 3.92 0.17 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 30 E 8.22 4.11 0.00 1.92 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 2.37 2.45 0.00 31 W 7.16 4.46 0.00 3.58 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 32 C 7.55 4.80 0.00 2.10 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 33 G 8.74 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 34 P 0.00 4.29 0.00 2.18 2.13 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.21 0.00 35 C 8.20 4.24 0.00 3.21 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 36 K 7.71 3.79 0.00 1.90 1.85 0.00 1.73 0.00 0.00 1.93 0.00 0.00 3.32 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.53 7.81 37 M 7.83 4.20 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.85 0.00 38 I 7.69 3.90 1.80 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 1.63 1.06 0.97 0.00 0.00 39 A 7.44 3.77 1.11 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 0.00 0.00 40 P 0.00 4.56 0.00 2.24 2.27 0.00 3.81 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.86 0.00 41 I 7.44 3.87 1.97 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.54 0.88 0.00 0.00 42 L 8.15 3.95 0.00 1.71 1.62 0.77 1.04 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 43 D 7.81 4.31 0.00 2.81 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 44 E 7.85 4.13 0.00 2.22 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 2.33 2.52 0.00 45 I 7.87 3.79 1.96 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 1.63 0.95 0.71 0.00 0.00 46 A 8.02 4.04 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 47 E 7.62 4.04 0.00 1.97 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 2.32 2.39 0.00 48 E 8.43 4.18 0.00 2.14 1.97 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 2.37 2.71 0.00 49 Y 8.18 4.61 0.00 3.14 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 50 Q 7.75 4.19 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.80 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 51 G 9.14 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 0.00 0.00 0.00 52 K 8.00 4.31 0.00 1.92 1.98 0.00 1.56 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.37 7.81 53 L 7.75 4.94 0.00 1.75 1.65 0.94 0.74 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 54 T 8.65 4.70 4.19 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 1.17 0.00 0.00 55 V 8.28 4.69 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 0.82 0.00 0.00 0.89 0.00 0.00 56 A 8.71 5.10 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 57 K 9.34 4.93 0.00 1.71 1.73 0.00 1.39 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.15 1.20 7.81 58 L 8.95 4.71 0.00 1.44 1.03 0.78 0.61 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 59 N 8.47 3.89 0.00 2.09 2.42 0.00 0.00 6.85 7.84 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 60 I 8.49 4.21 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.15 1.08 0.00 0.00 61 D 7.98 4.59 0.00 2.71 2.76 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 0.00 0.00 0.00 62 Q 8.46 4.11 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.02 0.00 0.00 0.00 0.00 0.00 2.36 2.24 0.00 63 N 8.40 4.91 0.00 2.73 2.94 0.00 0.00 6.71 7.62 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 64 P 0.00 4.57 0.00 2.18 2.18 0.00 3.37 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.91 0.00 65 G 8.06 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 66 T 7.97 3.84 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 0.60 0.00 0.00 67 A 8.14 3.84 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 68 P 0.00 4.17 0.00 2.11 2.07 0.00 3.68 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 69 K 7.69 3.77 0.00 1.07 1.54 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.48 7.81 70 Y 7.40 4.40 0.00 2.82 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 71 G 8.06 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 0.00 0.00 0.00 72 I 7.40 3.82 1.66 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 -0.14 0.79 0.00 0.00 73 R 7.82 4.63 0.00 1.71 1.86 0.00 3.36 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 74 G 7.28 4.62 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 75 I 8.01 4.79 1.95 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.80 1.03 0.00 0.00 76 P 0.00 4.82 0.00 2.16 2.26 0.00 3.64 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 77 T 8.81 5.03 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 78 L 8.97 5.29 0.00 1.42 1.59 0.74 0.37 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 79 L 8.98 5.04 0.00 1.82 1.18 0.75 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 80 L 9.01 5.06 0.00 1.85 1.61 0.94 0.59 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 81 F 9.81 5.21 0.00 2.86 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 82 K 8.79 4.61 0.00 1.70 1.73 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.36 7.81 83 N 9.24 4.44 0.00 2.86 2.88 0.00 0.00 7.15 7.05 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 84 G 8.75 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 85 E 7.96 4.71 0.00 2.09 1.87 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 2.27 2.27 0.00 86 V 8.48 3.55 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 0.59 0.00 0.00 0.38 0.00 0.00 87 A 8.78 4.51 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 88 A 7.46 4.55 1.03 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 89 T 8.83 5.10 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 1.21 0.00 0.00 90 K 9.06 4.40 0.00 0.79 1.09 0.00 1.16 0.00 0.00 0.76 0.00 0.00 2.74 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.87 1.14 7.81 91 V 8.73 4.61 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 0.85 0.00 0.00 0.91 0.00 0.00 92 G 9.07 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 93 A 7.99 4.18 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 94 L 7.77 4.65 0.00 1.82 1.53 0.74 0.51 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 95 S 8.90 4.49 0.00 4.07 4.05 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 0.00 0.00 0.00 96 K 8.52 3.98 0.00 1.84 1.86 0.00 1.91 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.53 7.81 97 G 8.04 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 98 Q 8.10 4.04 0.00 2.34 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 99 L 8.14 3.94 0.00 1.78 1.79 0.92 0.70 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 0.00 100 K 8.25 3.84 0.00 2.18 1.89 0.00 1.85 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.61 1.75 7.81 101 E 8.13 3.97 0.00 2.33 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 2.35 2.36 0.00 102 F 8.62 4.16 0.00 3.06 3.19 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 0.00 103 L 8.40 3.83 0.00 1.65 1.47 0.29 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.53 4.49 0.00 2.79 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 0.00 105 A 7.81 4.22 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 0.00 106 N 7.40 4.61 0.00 2.34 2.56 0.00 0.00 7.05 7.61 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 0.00 107 L 7.81 4.12 0.00 1.72 1.74 1.07 0.62 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 0.00 108 A 7.26 4.16 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