NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6004 8.3049 120.3615 55.6819 32.2604 174.1205 2 M 4.5465 9.8317 122.5535 54.5267 34.8664 175.0240 3 L 4.4742 8.5178 115.1896 54.0829 47.9376 174.6106 4 G 4.1472 8.5217 104.8649 44.2438 0.0000 171.7039 5 P 4.5969 0.0000 0.0000 62.2220 31.7006 176.0204 6 E 4.0251 8.1602 117.3399 57.3695 29.8758 176.6702 7 G 4.0409 8.2447 106.4820 43.1276 0.0000 172.3599 8 G 4.0110 7.2887 108.8196 46.1555 0.0000 170.0237 9 E 4.1452 8.7634 116.1981 57.7114 30.2631 176.7141 10 G 3.9643 7.3974 106.1575 43.8692 0.0000 171.8873 11 F 4.9155 7.9484 118.1410 57.5437 39.0414 175.9359 12 V 4.2578 7.9949 118.8223 63.2265 33.0821 174.9519 13 V 4.9397 8.8526 120.7860 59.3817 34.5248 175.1915 14 K 3.7502 8.8773 126.5084 55.8812 33.6216 175.4268 15 L 5.2163 8.2679 125.0087 52.9407 45.4887 175.5951 16 R 4.7301 9.4236 122.6364 55.1959 33.1402 174.5788 17 G 3.7634 9.6971 116.8711 46.3064 0.0000 174.3387 18 L 3.7622 7.8190 120.2674 54.6934 40.9636 175.0157 19 P 3.7305 0.0000 0.0000 62.5323 31.7075 177.3512 20 W 4.8945 7.8883 118.2809 58.1734 28.7173 177.3700 21 S 4.6521 7.8896 111.7965 58.2009 63.2699 173.8844 22 C 4.1854 8.2191 120.6103 60.6361 31.9134 172.1077 23 S 3.5463 7.9861 116.1080 55.1059 65.2981 174.8773 24 V 3.7087 8.1371 119.4541 66.6719 30.8397 177.5301 25 E 4.1295 7.9599 116.3908 58.5582 29.3605 178.0479 26 D 4.5470 8.2738 118.0957 55.9683 41.3761 178.4656 27 V 3.9389 7.8283 119.4009 64.6245 31.8283 178.1644 28 Q 4.1383 7.7773 116.7594 57.9860 28.7155 177.8949 29 N 4.4393 8.1376 118.6630 56.7738 38.9028 176.5913 30 F 4.2872 8.2831 120.6394 60.2098 40.0643 175.0527 31 L 4.5935 7.9390 118.3683 53.7976 42.2320 178.0778 32 S 4.2193 7.7846 113.7849 60.6314 62.6517 174.6812 33 D 4.4180 7.9474 118.7466 57.1228 40.7240 175.3675 34 C 4.8791 7.7818 117.4279 57.8867 35.4406 173.0503 35 T 4.6189 9.0618 119.4563 62.0248 70.1254 174.4074 36 I 4.6247 8.2675 126.7107 59.2615 39.3918 175.3912 37 H 4.6479 8.1642 123.4515 54.9075 28.7775 173.9343 38 D 4.9572 8.6745 128.0982 55.4501 38.8493 175.5294 39 G 3.5772 7.0722 112.3900 45.2249 0.0000 174.0173 40 A 4.5361 8.0782 120.7615 52.3991 21.2084 176.7274 41 A 4.6037 8.8826 117.4509 52.6285 18.1926 177.8501 42 G 4.2306 7.9166 102.8249 46.7082 0.0000 173.0642 43 V 4.9264 7.5955 113.1646 60.2350 34.1932 175.0523 44 H 5.1207 8.8351 118.5647 54.6470 33.6185 172.5027 45 F 4.6387 8.6157 119.2363 55.6331 42.0514 174.9248 46 I 4.0538 8.2837 123.3837 60.7687 38.9447 174.4837 47 Y 5.6136 8.1785 121.4497 56.6830 40.9461 175.9993 48 T 4.1043 9.0892 114.0066 63.9171 69.2674 175.6010 49 R 4.6206 7.7639 119.7638 55.7670 30.8442 176.3472 50 E 4.2045 7.8898 115.2340 56.4822 28.9195 177.1386 51 G 3.8148 9.2066 102.3875 46.8200 0.0000 173.1036 52 R 4.7423 7.4633 117.4857 54.5909 33.7702 173.5300 53 Q 5.0825 8.7369 124.8733 55.7553 30.1626 175.3694 54 S 4.6209 8.7507 120.6115 57.0068 63.9840 173.8796 55 G 4.1117 8.8412 109.0326 45.1626 0.0000 172.9646 56 E 5.2679 7.9451 117.1084 55.0281 35.0632 175.5866 57 A 4.6901 8.5134 122.9978 51.4342 23.6280 174.9335 58 F 5.0029 8.8322 116.4933 56.3352 44.1547 174.8699 59 V 4.6997 9.1493 122.7022 61.2716 34.7876 173.6676 60 E 4.6373 9.3719 129.2965 56.8880 29.9538 177.2119 61 L 4.6251 8.9970 125.6559 54.4980 42.5772 177.8345 62 G 3.9317 8.9096 108.6496 46.3726 0.0000 173.8896 63 S 3.3529 7.1679 113.1346 55.9894 67.0390 174.9047 64 E 3.8224 6.7645 121.0483 58.8644 29.2819 178.0073 65 D 4.3190 7.7379 118.4879 56.8537 40.7987 178.0846 66 D 4.2724 7.9157 119.9152 57.3105 40.7146 178.8856 67 V 3.6280 7.3853 112.3468 64.6009 31.4752 178.7353 68 K 3.9125 8.1413 117.9539 59.8630 31.6496 179.3227 69 M 4.0063 7.9571 117.7595 58.1604 32.0671 178.3504 70 A 4.0777 8.1967 121.3659 54.8990 18.6568 179.5864 71 L 3.9616 8.2666 117.7244 57.6189 41.3477 179.5087 72 K 3.8438 7.4185 118.1715 58.9729 32.1532 177.5946 73 K 4.4598 7.7481 116.3748 56.1038 32.3123 177.5625 74 D 4.6751 7.9813 118.8176 55.2364 39.0570 178.1717 75 R 4.4023 7.5973 116.5364 56.8700 32.6218 174.8032 76 E 4.6378 8.4983 122.0529 55.2411 31.7389 175.0578 77 S 4.9294 8.5892 111.8008 56.9303 65.9341 173.8442 78 M 4.4969 8.3323 118.0809 55.6377 31.7261 177.9034 79 G 4.8656 7.1964 119.0632 47.4572 0.0000 174.0352 80 H 4.7287 7.2085 111.7160 55.5130 29.6393 172.7125 81 R 4.4623 7.2518 117.2738 55.6976 34.7689 173.6343 82 Y 4.5491 8.3174 118.4049 57.6335 39.8968 174.9006 83 I 4.2346 8.5489 122.8047 59.0603 37.9123 172.7065 84 E 4.4733 9.2008 125.3679 55.7225 30.8121 175.2271 85 V 4.6098 8.1417 127.6382 61.7131 32.9385 174.8406 86 F 4.8994 9.0805 126.6604 55.2585 41.9686 175.0264 87 K 4.4959 8.6935 123.4511 56.8966 32.9353 175.5120 88 S 4.9210 8.6225 120.0111 57.6148 66.3707 172.1350 89 H 5.1033 8.7898 116.6642 53.2065 32.3658 175.2792 90 R 3.8479 9.1399 120.6867 60.0159 29.7991 179.1225 91 T 3.8504 8.8030 115.8198 66.5500 68.4758 176.2816 92 E 4.0752 8.1482 120.6934 59.5519 29.9030 178.2648 93 M 3.1637 8.1969 118.5558 58.5888 32.0427 177.9362 94 D 4.3627 8.0933 117.8036 56.4205 41.1582 178.4111 95 W 4.4352 7.8392 129.3500 60.7686 30.6246 178.5964 96 V 2.2952 6.9437 111.0780 63.6907 30.9159 178.4215 97 L 4.0886 7.3245 117.5988 56.3584 41.4566 177.8890 98 K 4.5713 7.4437 115.4948 55.8577 33.1710 176.2356 99 H 4.4577 8.2594 120.2849 59.4252 30.0346 175.2330 100 S 4.6756 7.8061 113.9643 57.5321 63.5437 172.0947 101 G 4.2047 7.5682 109.3119 42.7841 0.0000 171.4249 102 P 4.4142 0.0000 0.0000 63.1468 31.3260 176.3189 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 M 8.30 4.60 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.59 0.00 2 M 9.83 4.55 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 3 L 8.52 4.47 0.00 1.54 1.62 0.93 1.10 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 4 G 8.52 4.15 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 0.00 5 P 0.00 4.60 0.00 2.20 2.17 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 6 E 8.16 4.03 0.00 2.18 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 2.34 2.44 0.00 7 G 8.24 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 G 7.29 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 0.00 0.00 0.00 9 E 8.76 4.15 0.00 2.01 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 0.00 2.21 2.31 0.00 10 G 7.40 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 11 F 7.95 4.92 0.00 3.28 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 12 V 7.99 4.26 2.19 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 1.29 0.00 0.00 1.00 0.00 0.00 13 V 8.85 4.94 2.18 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 0.72 0.00 0.00 1.02 0.00 0.00 14 K 8.88 3.75 0.00 1.30 1.54 0.00 1.37 0.00 0.00 1.13 0.00 0.00 2.54 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.06 0.21 7.81 15 L 8.27 5.22 0.00 1.31 1.27 0.79 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 16 R 9.42 4.73 0.00 1.74 1.80 0.00 3.27 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 17 G 9.70 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 18 L 7.82 3.76 0.00 1.75 1.71 0.92 0.52 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 19 P 0.00 3.73 0.00 2.09 1.86 0.00 3.46 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 20 W 7.89 4.89 0.00 3.28 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 21 S 7.89 4.65 0.00 3.93 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 22 C 8.22 4.19 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 23 S 7.99 3.55 0.00 3.74 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 24 V 8.14 3.71 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 1.11 0.00 0.00 1.04 0.00 0.00 25 E 7.96 4.13 0.00 2.13 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 2.32 2.36 0.00 26 D 8.27 4.55 0.00 2.78 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 27 V 7.83 3.94 2.20 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 1.09 0.00 0.00 0.97 0.00 0.00 28 Q 7.78 4.14 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.03 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 29 N 8.14 4.44 0.00 2.92 2.97 0.00 0.00 6.99 8.12 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 30 F 8.28 4.29 0.00 3.09 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 31 L 7.94 4.59 0.00 1.89 1.51 1.13 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 32 S 7.78 4.22 0.00 3.94 3.85 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 33 D 7.95 4.42 0.00 2.54 2.62 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 34 C 7.78 4.88 0.00 2.86 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 35 T 9.06 4.62 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 1.22 0.00 0.00 36 I 8.27 4.62 2.01 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 1.26 0.84 1.01 0.00 0.00 37 H 8.16 4.65 0.00 3.30 3.53 0.00 5.81 0.00 0.00 0.00 0.00 8.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 D 8.67 4.96 0.00 2.73 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.07 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.08 4.54 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 41 A 8.88 4.60 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 42 G 7.92 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 0.00 0.00 0.00 0.00 43 V 7.60 4.93 2.21 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 0.77 0.00 0.00 1.22 0.00 0.00 44 H 8.84 5.12 0.00 3.07 3.14 0.00 5.75 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.62 4.64 0.00 2.76 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 46 I 8.28 4.05 1.97 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.07 0.91 0.00 0.00 47 Y 8.18 5.61 0.00 2.83 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 48 T 9.09 4.10 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 1.29 0.00 0.00 49 R 7.76 4.62 0.00 1.80 1.96 0.00 3.22 0.00 0.00 3.39 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 50 E 7.89 4.20 0.00 2.08 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 2.28 2.29 0.00 51 G 9.21 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.46 4.74 0.00 1.86 1.81 0.00 3.10 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 53 Q 8.74 5.08 0.00 2.34 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.92 0.00 0.00 0.00 0.00 0.00 2.63 2.63 0.00 54 S 8.75 4.62 0.00 4.02 3.84 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 55 G 8.84 4.11 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 0.00 56 E 7.95 5.27 0.00 1.89 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 2.24 2.34 0.00 57 A 8.51 4.69 0.40 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 58 F 8.83 5.00 0.00 2.88 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 59 V 9.15 4.70 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 1.10 0.00 0.00 0.87 0.00 0.00 60 E 9.37 4.64 0.00 2.22 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 0.00 2.41 2.44 0.00 61 L 9.00 4.63 0.00 1.70 1.74 1.00 0.80 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 62 G 8.91 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 63 S 7.17 3.35 0.00 3.65 3.71 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 64 E 6.76 3.82 0.00 1.97 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 2.45 2.67 0.00 65 D 7.74 4.32 0.00 2.68 2.62 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 66 D 7.92 4.27 0.00 2.86 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 67 V 7.39 3.63 2.21 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 1.00 0.00 0.00 1.02 0.00 0.00 68 K 8.14 3.91 0.00 1.99 1.83 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.44 1.47 7.81 69 M 7.96 4.01 0.00 1.92 2.21 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.69 0.00 70 A 8.20 4.08 1.38 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 71 L 8.27 3.96 0.00 1.82 1.70 0.91 0.92 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 72 K 7.42 3.84 0.00 1.64 1.84 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.68 7.81 73 K 7.75 4.46 0.00 1.80 1.71 0.00 1.54 0.00 0.00 1.59 0.00 0.00 2.69 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.12 0.78 7.81 74 D 7.98 4.68 0.00 2.91 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 75 R 7.60 4.40 0.00 1.73 1.85 0.00 3.12 0.00 0.00 3.06 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.50 0.00 76 E 8.50 4.64 0.00 2.12 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 0.00 2.30 2.53 0.00 77 S 8.59 4.93 0.00 3.77 3.31 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 78 M 8.33 4.50 0.00 1.95 2.26 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.55 0.00 79 G 7.20 4.87 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 0.00 0.00 0.00 80 H 7.21 4.73 0.00 3.11 3.25 0.00 5.74 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 R 7.25 4.46 0.00 1.47 1.56 0.00 3.26 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.34 0.00 82 Y 8.32 4.55 0.00 2.86 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 83 I 8.55 4.23 0.56 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 -0.36 -0.03 0.00 0.00 84 E 9.20 4.47 0.00 2.01 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 1.80 2.01 0.00 85 V 8.14 4.61 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 0.88 0.00 0.00 1.24 0.00 0.00 86 F 9.08 4.90 0.00 2.94 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 87 K 8.69 4.50 0.00 1.81 1.76 0.00 1.91 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.48 7.81 88 S 8.62 4.92 0.00 4.10 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 89 H 8.79 5.10 0.00 3.22 3.41 0.00 5.88 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 R 9.14 3.85 0.00 1.82 1.91 0.00 3.38 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 91 T 8.80 3.85 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 1.21 0.00 0.00 92 E 8.15 4.08 0.00 2.14 2.18 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 2.52 2.52 0.00 93 M 8.20 3.16 0.00 2.05 1.91 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 2.42 2.07 0.00 94 D 8.09 4.36 0.00 2.80 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 95 W 7.84 4.44 0.00 3.21 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 96 V 6.94 2.30 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 0.20 0.00 0.00 -0.16 0.00 0.00 97 L 7.32 4.09 0.00 1.48 1.68 0.59 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.44 4.57 0.00 1.92 1.82 0.00 1.90 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.30 7.81 99 H 8.26 4.46 0.00 2.53 3.21 0.00 5.70 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 0.00 100 S 7.81 4.68 0.00 3.81 3.74 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 0.00 101 G 7.57 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 0.00 0.00 0.00 0.00 102 P 0.00 4.41 0.00 2.06 2.04 0.00 3.72 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 2.05 2.14 0.00