NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 V 3.9522 8.0544 120.3807 62.3194 32.9340 174.7682 10 Q 4.0729 8.3562 128.5761 55.9599 30.1260 173.5174 11 D 5.3793 8.6941 125.8377 53.9934 42.6288 175.5926 12 V 4.7002 8.4767 120.5467 60.2572 34.7596 174.6216 13 N 5.0350 8.6061 118.7174 50.8111 40.0601 174.2650 14 D 4.3526 8.7069 116.2783 58.0090 40.4493 178.7589 15 S 4.3023 8.2255 114.5464 59.8839 63.2819 175.5273 16 S 4.2074 7.7486 114.6189 57.2972 63.3590 175.3453 17 W 3.9279 7.9365 133.2881 60.8108 30.3663 177.5249 18 K 3.8440 8.1755 117.6030 59.5982 31.3191 178.6548 19 E 4.0482 7.8459 117.2257 59.4788 29.8437 178.3496 20 F 4.3684 8.2087 117.1602 60.0257 38.8550 177.1218 21 V 3.6144 7.3486 117.2721 64.8010 31.5291 178.0989 22 L 3.9130 7.2328 116.5851 56.8669 41.7475 177.7499 23 E 4.5356 7.5471 115.7327 55.7183 29.8222 176.0602 24 S 4.2340 7.4225 114.1443 58.5552 62.7923 174.1433 25 E 4.2766 8.6642 125.1030 57.4979 29.8992 176.4438 26 V 4.6315 7.1579 110.5908 58.2331 35.2261 173.9020 27 P 4.5627 0.0000 0.0000 63.1833 32.7051 175.5058 28 V 4.8195 9.0887 122.6652 61.2906 34.7322 173.7705 29 M 4.7386 8.9127 127.3877 53.6007 34.7218 174.2099 30 V 4.8514 9.0255 126.3832 61.1454 34.7788 173.4484 31 D 5.3183 9.0524 128.3022 52.8759 42.4221 174.8721 32 F 5.1853 9.7134 126.7874 56.4436 40.6306 175.3322 33 W 5.2188 8.9890 120.0125 55.6294 32.3908 173.2620 34 A 3.7680 8.1102 117.6474 50.1383 20.9221 175.7651 35 P 4.2664 0.0000 0.0000 65.3570 31.5065 177.6895 36 W 4.4278 7.3144 112.3345 57.2528 28.4874 176.5864 37 C 4.4597 7.5862 121.4641 55.7045 38.5844 174.0895 38 G 3.4978 8.9040 114.7244 47.6910 0.0000 172.7990 39 P 4.3569 0.0000 0.0000 65.1284 31.1581 179.2803 40 C 4.3416 7.8008 115.2399 60.0253 39.8247 176.2659 41 K 3.8170 7.8622 119.2312 59.2683 31.6514 179.0727 42 L 4.1573 7.8155 118.7945 56.7188 41.8281 178.4041 43 I 4.1884 7.6297 111.2747 61.4339 38.3939 177.2691 44 A 3.8616 7.5595 123.6207 55.0508 18.1388 177.7648 45 P 4.1424 0.0000 0.0000 65.6974 31.4510 179.0165 46 V 3.6300 7.7154 116.5967 65.9202 31.4877 178.0629 47 I 3.6978 7.8962 119.6236 64.4173 36.9657 178.1142 48 D 4.2927 7.9531 119.7131 57.2565 40.6149 178.4229 49 E 3.8941 8.1810 119.6951 59.4668 29.6689 178.9755 50 L 4.1491 8.1555 118.7121 57.5387 41.3980 179.3180 51 A 3.9928 7.8740 120.1341 55.0610 18.6449 179.5847 52 K 4.0408 7.9824 116.8518 59.7718 31.9698 179.3824 53 E 3.9172 8.1317 117.3923 58.9020 29.5272 178.2555 54 Y 4.5493 8.0059 115.5075 56.5363 39.2607 175.4350 55 S 4.1979 7.2397 114.7722 59.9030 62.8150 174.6803 56 G 4.0378 9.0345 115.5592 45.1521 0.0000 173.6833 57 K 4.6740 8.1515 117.8870 56.9950 34.3326 176.3717 58 I 4.9210 7.7329 110.1473 59.1571 41.2435 174.3389 59 A 4.5767 8.7744 124.5370 50.0198 21.4069 175.6843 60 V 4.6082 7.7092 121.2154 61.2452 34.2532 174.1495 61 Y 5.2741 8.6248 123.6912 56.2715 43.1852 173.9494 62 K 5.0821 8.8699 119.0962 55.0889 36.1978 174.7695 63 L 4.8588 9.1004 125.3396 53.1530 45.0381 174.9105 64 N 3.9931 8.7442 125.8249 52.4938 38.0393 175.5299 65 T 3.9749 8.4699 118.0611 64.5121 69.1501 176.4294 66 D 4.6316 8.4556 122.3722 56.8085 40.8138 177.0381 67 E 4.3720 7.8158 115.2739 56.4908 30.7905 175.8236 68 A 4.9724 7.5392 121.5207 48.3805 19.0162 175.3661 69 P 4.4192 0.0000 0.0000 65.1234 31.8711 178.6533 70 G 3.6436 8.1095 105.5131 48.0312 0.0000 175.5271 71 I 3.4792 7.5225 121.1775 63.8791 37.0673 178.3160 72 A 4.0680 7.9990 121.1954 55.5683 18.1719 179.7018 73 T 3.8705 8.2203 114.5648 66.5697 68.2523 176.7247 74 Q 3.7601 7.6381 120.6839 58.9586 29.1073 177.1876 75 Y 4.4314 7.4163 113.6695 56.4926 38.8657 174.8764 76 N 4.0475 7.6227 116.9129 54.5058 37.7908 174.7304 77 I 4.0852 8.1737 118.7020 60.6432 37.7377 176.6302 78 R 4.6113 8.5164 123.1818 55.9927 31.7923 175.9769 79 S 4.8588 7.7146 112.6554 56.8022 66.9682 172.9363 80 I 4.8719 8.0334 114.9410 58.0889 40.7296 173.1086 81 P 4.7501 0.0000 0.0000 63.5181 32.6469 175.2252 82 T 5.1397 8.6375 117.0973 61.9167 73.1555 172.8871 83 V 5.0023 9.1633 125.4810 61.1889 34.4548 174.1449 84 L 5.3507 9.2453 127.8715 53.0403 45.0529 175.2915 85 F 5.2593 8.7719 120.5131 55.7762 42.0222 174.5670 86 F 5.1712 9.4007 121.4017 55.8110 43.2446 174.4872 87 K 4.5223 9.0654 122.2267 56.0133 35.6235 175.5473 88 N 4.3982 9.8525 125.7507 54.5431 35.8096 175.4481 89 G 4.0703 8.7775 105.0056 45.3687 0.0000 173.7920 90 E 4.8320 7.8763 119.1182 54.0174 32.1884 175.3352 91 R 3.3873 8.6091 123.3095 56.0686 30.4260 175.9250 92 K 4.3876 8.3548 125.0814 57.6167 33.8096 176.3331 93 E 4.8220 7.4997 117.5771 55.4175 32.9410 174.3376 94 S 5.3238 8.7585 120.0421 56.8690 66.6983 173.5034 95 I 4.7261 8.8465 123.8939 59.6683 40.8405 174.3358 96 I 4.8024 8.6034 127.0241 60.8265 39.6951 175.0407 97 G 3.7269 8.8900 111.0332 44.5420 0.0000 174.5125 98 A 4.3274 8.0048 121.3969 50.6483 16.8916 176.2218 99 V 3.7699 7.6997 120.1613 61.7107 32.7201 175.0511 100 P 4.5465 0.0000 0.0000 61.7962 33.3711 177.3680 101 K 3.9329 8.6289 120.9231 59.8756 32.2149 179.0792 102 S 4.1545 8.1195 113.9175 61.9849 62.6256 176.6100 103 T 3.9121 7.8507 118.7568 66.2493 68.2227 176.6293 104 L 4.1774 7.8361 120.7208 58.2040 41.5695 179.7457 105 T 3.8346 8.1843 115.7558 66.5271 68.1112 176.4726 106 D 4.2814 7.7525 119.7449 57.4321 41.0090 178.8144 107 S 3.7903 7.6514 115.4128 61.4652 62.6073 176.5998 108 I 3.7504 7.7679 122.6605 64.6931 36.4444 178.3209 109 E 3.9582 8.2678 119.5537 59.1233 29.0155 179.4360 110 K 3.9728 7.2700 117.8158 59.2306 32.8728 177.9901 111 Y 4.5548 6.9994 115.7172 58.4077 38.2344 175.3999 112 L 4.3001 7.4057 124.0464 54.8758 41.8984 176.3650 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 9 V 8.05 3.95 1.99 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 0.92 0.00 0.00 0.94 0.00 0.00 10 Q 8.36 4.07 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.90 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 11 D 8.69 5.38 0.00 2.72 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 12 V 8.48 4.70 1.93 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 0.92 0.00 0.00 0.80 0.00 0.00 13 N 8.61 5.04 0.00 2.89 2.94 0.00 0.00 6.96 8.23 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 14 D 8.71 4.35 0.00 2.67 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 15 S 8.23 4.30 0.00 3.92 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 16 S 7.75 4.21 0.00 2.72 3.37 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 17 W 7.94 3.93 0.00 3.56 3.07 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 18 K 8.18 3.84 0.00 1.83 1.86 0.00 1.74 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.62 7.81 19 E 7.85 4.05 0.00 1.90 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 2.53 2.46 0.00 20 F 8.21 4.37 0.00 2.41 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 0.00 0.00 0.00 21 V 7.35 3.61 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 -0.38 0.00 0.00 -0.54 0.00 0.00 22 L 7.23 3.91 0.00 1.79 1.71 1.11 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 23 E 7.55 4.54 0.00 2.06 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 0.00 2.24 2.49 0.00 24 S 7.42 4.23 0.00 4.04 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 25 E 8.66 4.28 0.00 2.00 1.99 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 2.29 2.27 0.00 26 V 7.16 4.63 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 0.70 0.00 0.00 0.92 0.00 0.00 27 P 0.00 4.56 0.00 2.15 2.05 0.00 3.77 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 2.27 2.16 0.00 28 V 9.09 4.82 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 0.97 0.00 0.00 0.94 0.00 0.00 29 M 8.91 4.74 0.00 1.91 1.67 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 2.07 0.00 30 V 9.03 4.85 2.44 0.00 0.00 0.00 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 0.97 0.00 0.00 31 D 9.05 5.32 0.00 2.82 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 32 F 9.71 5.19 0.00 3.19 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 33 W 8.99 5.22 0.00 3.39 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 34 A 8.11 3.77 0.22 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 35 P 0.00 4.27 0.00 2.09 2.23 0.00 3.50 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.00 0.00 36 W 7.31 4.43 0.00 3.55 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 37 C 7.59 4.46 0.00 1.98 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 38 G 8.90 3.50 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 0.00 39 P 0.00 4.36 0.00 2.20 2.15 0.00 3.66 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 40 C 7.80 4.34 0.00 3.07 3.24 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 41 K 7.86 3.82 0.00 1.89 1.87 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.51 7.81 42 L 7.82 4.16 0.00 1.81 1.74 0.93 0.91 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 43 I 7.63 4.19 1.88 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 1.67 0.90 0.93 0.00 0.00 44 A 7.56 3.86 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 45 P 0.00 4.14 0.00 2.15 2.08 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 46 V 7.72 3.63 2.24 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 1.09 0.00 0.00 0.94 0.00 0.00 47 I 7.90 3.70 1.93 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 1.78 1.13 0.84 0.00 0.00 48 D 7.95 4.29 0.00 2.79 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 49 E 8.18 3.89 0.00 2.16 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 2.31 2.50 0.00 50 L 8.16 4.15 0.00 1.84 1.79 0.97 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 51 A 7.87 3.99 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 52 K 7.98 4.04 0.00 1.97 1.84 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.65 7.81 53 E 8.13 3.92 0.00 2.16 1.70 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 2.25 2.54 0.00 54 Y 8.01 4.55 0.00 3.19 2.97 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 0.00 0.00 0.00 55 S 7.24 4.20 0.00 3.92 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 56 G 9.03 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 57 K 8.15 4.67 0.00 1.95 1.97 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.77 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.39 7.81 58 I 7.73 4.92 1.98 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 1.49 0.62 0.92 0.00 0.00 59 A 8.77 4.58 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 60 V 7.71 4.61 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 0.77 0.00 0.00 0.82 0.00 0.00 61 Y 8.62 5.27 0.00 2.87 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 62 K 8.87 5.08 0.00 1.82 1.81 0.00 1.10 0.00 0.00 1.41 0.00 0.00 2.13 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.36 1.56 7.81 63 L 9.10 4.86 0.00 1.46 0.84 0.76 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 64 N 8.74 3.99 0.00 2.33 2.47 0.00 0.00 6.93 7.22 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 65 T 8.47 3.97 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 1.36 0.00 0.00 66 D 8.46 4.63 0.00 2.74 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 67 E 7.82 4.37 0.00 1.93 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 2.18 2.34 0.00 68 A 7.54 4.97 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 P 0.00 4.42 0.00 2.26 2.32 0.00 3.69 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 70 G 8.11 3.64 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 0.00 0.00 0.00 71 I 7.52 3.48 1.63 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.89 -0.20 0.00 0.00 72 A 8.00 4.07 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 73 T 8.22 3.87 4.34 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 1.16 0.00 0.00 74 Q 7.64 3.76 0.00 1.90 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.01 0.00 0.00 0.00 0.00 0.00 1.66 2.10 0.00 75 Y 7.42 4.43 0.00 3.04 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 76 N 7.62 4.05 0.00 2.78 2.84 0.00 0.00 7.09 9.17 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 77 I 8.17 4.09 1.68 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.01 0.64 0.00 0.00 78 R 8.52 4.61 0.00 1.77 1.94 0.00 3.16 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.76 0.00 79 S 7.71 4.86 0.00 3.82 3.75 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 80 I 8.03 4.87 1.89 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.55 0.99 0.00 0.00 81 P 0.00 4.75 0.00 2.20 2.27 0.00 3.68 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 2.21 2.04 0.00 82 T 8.64 5.14 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 1.08 0.00 0.00 83 V 9.16 5.00 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 0.78 0.00 0.00 0.98 0.00 0.00 84 L 9.25 5.35 0.00 2.05 1.76 0.83 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.77 5.26 0.00 2.85 2.54 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 86 F 9.40 5.17 0.00 2.83 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 87 K 9.07 4.52 0.00 1.62 1.53 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.37 1.44 7.81 88 N 9.85 4.40 0.00 2.95 2.93 0.00 0.00 7.29 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 89 G 8.78 4.07 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 0.00 0.00 0.00 90 E 7.88 4.83 0.00 2.01 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 2.29 2.42 0.00 91 R 8.61 3.39 0.00 1.39 1.76 0.00 3.28 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.03 0.00 92 K 8.35 4.39 0.00 1.23 1.81 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.21 1.10 7.81 93 E 7.50 4.82 0.00 2.08 1.85 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 2.42 2.35 0.00 94 S 8.76 5.32 0.00 3.75 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 95 I 8.85 4.73 2.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.90 0.98 0.00 0.00 96 I 8.60 4.80 1.90 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 1.29 0.60 0.97 0.00 0.00 97 G 8.89 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.00 4.33 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 99 V 7.70 3.77 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 0.89 0.00 0.00 1.04 0.00 0.00 100 P 0.00 4.55 0.00 2.22 1.96 0.00 3.69 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 101 K 8.63 3.93 0.00 1.84 1.84 0.00 1.76 0.00 0.00 1.90 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.56 1.56 7.81 102 S 8.12 4.15 0.00 4.10 4.13 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 0.00 103 T 7.85 3.91 4.40 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 1.23 0.00 0.00 104 L 7.84 4.18 0.00 1.91 1.80 1.08 1.23 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 0.00 105 T 8.18 3.83 4.42 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 1.33 0.00 0.00 106 D 7.75 4.28 0.00 2.79 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 0.00 107 S 7.65 3.79 0.00 3.58 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.77 3.75 1.68 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.99 0.16 0.00 0.00 109 E 8.27 3.96 0.00 2.10 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 0.00 2.49 2.46 0.00 110 K 7.27 3.97 0.00 1.51 1.64 0.00 1.12 0.00 0.00 1.33 0.00 0.00 2.46 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.80 0.21 7.81 111 Y 7.00 4.55 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.41 4.30 0.00 1.85 1.62 1.09 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00