NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1566 8.1727 122.0498 56.2696 34.0991 174.0021 2 V 4.5734 8.1727 127.1240 60.7212 32.4315 174.4675 3 F 4.4843 10.1600 129.1174 57.5297 40.2697 174.8900 4 E 4.3233 9.2135 120.8285 55.4588 31.1430 176.8756 5 R 3.2863 8.9638 120.8087 60.8510 30.0115 179.4170 6 C 4.3451 8.0157 115.3472 59.6255 39.0505 175.6780 7 E 3.8900 8.1278 120.7617 59.2548 29.2190 178.5323 8 L 3.6057 8.0332 120.1181 57.8549 42.0830 178.6177 9 A 3.9297 7.8930 120.7475 55.3763 18.2517 179.9110 10 R 3.9158 8.0308 116.4921 59.4783 30.2356 179.4068 11 T 3.8407 7.8892 115.6302 66.6303 68.4970 176.7127 12 L 3.8362 8.0541 121.1999 57.5388 41.6268 179.4704 13 K 3.8936 8.0456 119.5978 59.5449 31.9225 178.7837 14 R 3.9278 7.9397 117.9604 59.1606 30.0311 177.5481 15 L 4.3503 7.4336 115.7174 54.2983 41.6757 177.0939 16 G 3.8649 7.8660 106.8939 46.7956 0.0000 175.0907 17 M 3.9011 7.7900 121.3812 56.4987 32.3433 175.6308 18 D 4.3411 8.0117 117.5791 55.8288 41.0116 175.7063 19 G 3.9330 9.3739 115.4774 45.5158 0.0000 171.2393 20 Y 4.2245 8.2453 122.0777 58.5299 38.8723 176.3257 21 R 3.4401 8.8022 126.8458 57.3468 27.6424 177.2256 22 G 3.7820 8.1478 103.2738 45.8537 0.0000 174.1213 23 I 4.0832 7.4448 121.9288 58.9871 37.9312 175.8254 24 S 4.6211 8.3191 120.5294 57.7319 63.8290 174.9113 25 L 4.2282 8.6238 123.4463 58.6495 41.6431 179.4590 26 A 4.1489 8.1292 120.1473 55.2224 18.3270 179.2466 27 N 4.4396 8.1520 114.9240 56.3739 38.5749 177.7086 28 W 4.2982 8.0648 119.8661 60.0182 29.1046 178.3759 29 M 4.1386 8.5357 118.9263 58.5511 31.4174 177.9302 30 C 3.1659 8.1719 118.7265 59.0659 42.8296 175.3979 31 L 4.0212 8.2405 121.7333 58.3062 41.7867 178.8344 32 A 3.9960 8.4243 120.8886 54.8259 18.2193 179.4590 33 K 2.8456 8.1881 118.2114 59.4002 32.0664 179.2000 34 W 4.2151 7.8705 117.4591 59.3547 29.0289 178.3215 35 E 4.3436 8.4900 118.9410 58.8170 29.1148 177.9264 36 S 4.4910 7.7250 107.9123 56.9170 65.3193 174.0274 37 G 3.3653 8.0789 109.0400 46.9400 0.0000 173.1963 38 Y 3.6186 7.5885 113.5180 58.8114 34.9046 168.6786 39 N 5.3269 7.8014 118.7475 52.0386 40.3352 175.1965 40 T 4.2458 9.0509 117.5416 63.5583 70.0520 175.9831 41 R 4.5798 8.0745 117.3106 55.7802 30.3778 176.5814 42 A 4.3780 7.9304 122.6495 52.7717 19.5329 177.1176 43 T 5.0213 8.2731 110.3797 60.1421 72.4226 172.8829 44 N 4.8974 8.8984 121.7681 52.2067 41.8392 172.3883 45 Y 4.7762 8.7101 127.7637 57.1349 41.0456 173.8518 46 N 4.6760 8.5054 124.4240 51.1299 39.1073 175.3965 47 A 3.6768 8.2471 127.5448 54.3862 19.0307 179.2603 48 G 3.6962 8.0692 104.7148 48.2014 0.0000 174.2550 49 D 4.7801 7.5888 117.0671 51.9527 39.9310 175.9763 50 R 4.0754 8.0116 115.4921 56.9195 28.2893 175.9217 51 S 5.0033 7.2612 109.8072 57.0304 66.5466 172.7187 52 T 5.1289 8.8233 115.8295 62.0041 72.7975 172.8342 53 D 5.4022 9.1804 125.2233 53.3123 43.3676 175.0984 54 Y 4.8670 9.0809 120.4333 57.5117 41.6794 177.1728 55 G 4.5317 9.0840 112.1906 46.3213 0.0000 173.4723 56 I 3.7364 8.2763 116.8889 62.8069 38.0122 177.5618 57 F 4.6912 8.0455 115.7413 56.2954 39.8455 175.2269 58 Q 3.5594 7.9219 119.2502 57.0713 26.6848 174.4327 59 I 4.3068 8.0189 118.4864 61.2882 39.1575 176.9482 60 N 5.3671 9.1636 125.8995 53.3627 39.8843 175.7166 61 S 4.5811 8.9601 120.0765 60.6689 63.4547 175.3976 62 R 3.7508 8.7689 122.3222 58.7586 30.2854 177.7038 63 Y 4.5536 7.6911 113.6760 57.0008 40.6175 176.6376 64 W 4.9350 8.0763 118.8303 57.5368 31.3322 173.7845 65 C 5.6049 8.1526 111.5293 53.7658 46.2570 172.8739 66 N 5.0373 9.0740 119.2414 51.9942 40.1730 174.7416 67 D 4.8105 8.6663 123.5502 52.2697 40.3758 177.9962 68 G 4.0252 8.6966 107.5864 46.2098 0.0000 174.6507 69 K 4.5142 8.0237 117.0973 56.5275 33.1037 175.6859 70 T 4.6092 7.7587 117.0832 61.4003 69.3659 172.3638 71 P 4.1752 0.0000 0.0000 64.2356 31.7204 176.1403 72 G 3.9735 8.7728 109.7108 46.2101 0.0000 173.1609 73 A 4.2415 7.3665 120.7557 51.2651 19.2669 177.7543 74 V 4.4444 8.1431 112.9094 59.6645 35.3352 176.2943 75 N 4.8899 7.9732 116.0269 51.7629 38.4911 174.1985 76 A 3.8626 8.6500 124.4402 55.0760 19.0520 178.5559 77 C 4.5275 8.4286 110.9805 57.5006 41.1071 173.0385 78 H 4.1243 7.9326 116.5484 56.6096 26.3030 173.9508 79 L 4.8223 8.4861 118.0577 52.9391 46.4461 176.4733 80 S 4.7207 8.3465 115.1739 57.8076 63.3525 175.9582 81 C 3.9372 8.6359 124.5954 59.8241 38.5405 176.3723 82 S 3.9551 7.8108 114.5888 61.4592 61.6757 176.0316 83 A 4.0621 7.9260 122.2614 54.6005 17.8694 177.9641 84 L 4.4725 7.8334 116.2359 55.0684 41.7775 177.5858 85 L 5.0581 8.0747 117.6417 54.5591 42.3639 176.6888 86 Q 4.4055 7.8274 117.6066 55.2685 29.6581 175.9548 87 D 4.4397 8.5651 120.0562 57.1830 41.1459 176.9026 88 N 4.6004 8.0379 118.1202 53.2427 39.3779 174.7068 89 I 4.2411 8.4927 118.5984 60.9504 37.9574 176.9610 90 A 3.9367 8.3133 124.4300 56.1642 18.1085 180.0535 91 D 4.2633 8.0893 116.1225 57.4452 40.8870 178.7659 92 A 4.0713 7.9969 120.8501 55.1007 18.3956 179.7618 93 V 3.2379 8.1307 116.9064 65.9074 31.7018 178.1021 94 A 3.8262 8.0739 120.7356 55.3062 18.0993 178.8471 95 C 4.2753 8.3865 117.0557 59.8491 42.4959 175.9675 96 S 4.0761 8.2418 117.0973 61.4018 62.0403 176.8177 97 K 3.8963 7.6629 120.6093 59.2550 32.0920 179.0400 98 R 4.0824 7.7090 118.5403 59.2988 30.1671 178.4819 99 V 2.4388 7.6471 118.3302 65.8935 31.1816 178.0535 100 V 3.9282 7.5849 108.4797 62.7618 31.5626 177.9106 101 R 4.2065 7.7241 117.4000 57.1564 30.5308 176.5263 102 D 4.7009 7.4578 119.1376 52.7793 41.7530 175.2455 103 P 4.2247 0.0000 0.0000 66.3560 31.1483 177.7983 104 Q 4.0066 8.2108 117.4558 56.4966 29.8924 177.2574 105 G 3.6615 7.9593 107.1186 46.1071 0.0000 175.8505 106 I 3.5544 7.7296 120.0725 63.2527 37.9992 178.0750 107 R 4.2141 7.2771 117.6761 58.2025 30.0640 177.3971 108 A 4.0721 7.6961 121.0506 54.4656 18.6820 177.7375 109 W 4.6704 8.1820 116.9191 55.5279 29.8341 177.4983 110 V 3.7363 8.7785 123.6815 66.0714 30.9290 177.6499 111 A 4.0447 8.2969 120.1007 54.7370 18.1297 179.2613 112 W 3.9896 8.2999 126.6633 60.7161 30.6035 178.3890 113 R 3.6597 8.2245 116.1982 59.2586 29.6383 178.4153 114 N 4.3598 8.0870 114.9709 55.7708 38.7377 176.9044 115 R 4.1212 7.5238 115.0326 55.8297 31.3358 175.7242 116 C 4.5486 7.0981 115.0337 57.9441 42.9147 174.3029 117 Q 3.2826 6.5602 119.5491 57.3975 28.6907 175.3862 118 N 4.1899 8.5927 120.2015 54.1619 36.4064 173.8669 119 R 4.4963 7.2941 114.6028 54.0077 32.9702 175.8142 120 D 4.5309 8.4533 119.0215 54.2980 40.3263 175.8980 121 V 4.5687 8.2074 118.9934 61.1112 32.5181 178.2523 122 R 4.0194 8.1213 122.3499 59.3776 29.7835 178.8279 123 Q 4.0015 8.1558 115.2456 59.2982 28.3968 178.5550 124 Y 3.9802 7.8315 115.6908 60.1652 38.1428 176.9373 125 V 4.3449 7.8786 110.9700 60.8218 33.0356 175.6546 126 Q 4.1727 7.4383 120.2591 57.3631 28.7265 177.0326 127 G 3.9581 8.9704 110.5831 45.9072 0.0000 174.4374 128 C 4.4385 8.1196 116.1422 56.7101 40.6529 173.9661 129 G 3.8350 8.1546 107.2169 46.8222 0.0000 174.1139 130 V 4.0103 7.8738 118.0156 61.0870 32.1102 175.8560 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 K 8.17 4.16 0.00 2.03 1.63 0.00 1.18 0.00 0.00 0.75 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.82 1.09 7.81 2 V 8.17 4.57 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 0.90 0.00 0.00 0.94 0.00 0.00 3 F 10.16 4.48 0.00 2.83 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 4 E 9.21 4.32 0.00 1.95 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 2.31 2.25 0.00 5 R 8.96 3.29 0.00 1.97 1.93 0.00 3.42 0.00 0.00 3.47 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.83 0.00 6 C 8.02 4.35 0.00 3.00 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 7 E 8.13 3.89 0.00 2.06 2.23 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 2.63 2.43 0.00 8 L 8.03 3.61 0.00 1.41 1.36 -0.09 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.89 3.93 1.36 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 0.00 0.00 10 R 8.03 3.92 0.00 1.88 1.98 0.00 3.14 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.89 3.84 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 1.21 0.00 0.00 12 L 8.05 3.84 0.00 1.72 1.56 0.91 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.05 3.89 0.00 1.96 1.93 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.94 3.93 0.00 2.10 1.92 0.00 3.30 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 15 L 7.43 4.35 0.00 1.69 1.54 0.87 0.70 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 16 G 7.87 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 M 7.79 3.90 0.00 1.33 1.96 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.20 0.00 18 D 8.01 4.34 0.00 2.69 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.37 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 20 Y 8.25 4.22 0.00 3.38 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 21 R 8.80 3.44 0.00 1.90 1.85 0.00 3.23 0.00 0.00 2.99 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.41 0.00 22 G 8.15 3.78 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 0.00 0.00 0.00 23 I 7.44 4.08 1.80 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.70 -0.23 0.00 0.00 24 S 8.32 4.62 0.00 4.06 4.03 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 25 L 8.62 4.23 0.00 2.06 1.82 0.98 1.06 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 26 A 8.13 4.15 1.53 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 0.00 0.00 27 N 8.15 4.44 0.00 2.83 2.74 0.00 0.00 7.00 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 28 W 8.06 4.30 0.00 3.54 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 29 M 8.54 4.14 0.00 2.13 2.35 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 2.70 2.93 0.00 30 C 8.17 3.17 0.00 2.63 3.20 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 31 L 8.24 4.02 0.00 1.94 1.95 0.80 -0.13 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 32 A 8.42 4.00 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 33 K 8.19 2.85 0.00 1.68 1.71 0.00 0.67 0.00 0.00 0.98 0.00 0.00 2.57 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.18 0.35 7.81 34 W 7.87 4.22 0.00 3.32 3.25 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 35 E 8.49 4.34 0.00 1.99 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 2.62 2.51 0.00 36 S 7.73 4.49 0.00 4.03 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 37 G 8.08 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 0.00 0.00 0.00 38 Y 7.59 3.62 0.00 3.32 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 39 N 7.80 5.33 0.00 2.77 2.81 0.00 0.00 7.02 8.39 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 40 T 9.05 4.25 4.47 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 1.49 0.00 0.00 41 R 8.07 4.58 0.00 1.89 2.09 0.00 3.08 0.00 0.00 3.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.81 0.00 42 A 7.93 4.38 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.27 5.02 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 1.27 0.00 0.00 44 N 8.90 4.90 0.00 2.89 2.87 0.00 0.00 6.83 7.16 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 45 Y 8.71 4.78 0.00 2.99 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 46 N 8.51 4.68 0.00 2.60 2.59 0.00 0.00 6.67 8.14 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 47 A 8.25 3.68 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 48 G 8.07 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 49 D 7.59 4.78 0.00 2.75 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 50 R 8.01 4.08 0.00 2.05 2.16 0.00 3.11 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.54 0.00 51 S 7.26 5.00 0.00 3.94 3.91 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 52 T 8.82 5.13 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 0.69 0.00 0.00 53 D 9.18 5.40 0.00 2.68 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 54 Y 9.08 4.87 0.00 2.94 2.90 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 55 G 9.08 4.53 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 0.00 0.00 0.00 56 I 8.28 3.74 1.73 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.39 0.36 0.00 0.00 57 F 8.05 4.69 0.00 3.19 3.05 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 58 Q 7.92 3.56 0.00 2.54 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.69 0.00 59 I 8.02 4.31 2.13 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.12 1.12 0.00 0.00 60 N 9.16 5.37 0.00 3.09 3.02 0.00 0.00 6.98 7.21 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 61 S 8.96 4.58 0.00 4.06 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 0.00 62 R 8.77 3.75 0.00 1.56 1.05 0.00 2.71 0.00 0.00 2.91 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.02 0.00 63 Y 7.69 4.55 0.00 1.64 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 0.00 0.00 0.00 64 W 8.08 4.93 0.00 3.56 3.28 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 65 C 8.15 5.60 0.00 3.07 3.06 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 0.00 0.00 0.00 0.00 66 N 9.07 5.04 0.00 2.83 2.69 0.00 0.00 7.08 8.37 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 67 D 8.67 4.81 0.00 2.97 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 68 G 8.70 4.03 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 0.00 69 K 8.02 4.51 0.00 1.80 1.87 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.44 7.81 70 T 7.76 4.61 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 71 P 0.00 4.18 0.00 2.02 2.00 0.00 3.82 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.77 3.97 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 0.00 0.00 0.00 73 A 7.37 4.24 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 74 V 8.14 4.44 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 0.65 0.00 0.00 0.86 0.00 0.00 75 N 7.97 4.89 0.00 2.70 2.60 0.00 0.00 6.76 7.70 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 76 A 8.65 3.86 1.18 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 0.00 0.00 77 C 8.43 4.53 0.00 3.34 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 78 H 7.93 4.12 0.00 3.29 3.35 0.00 5.80 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 79 L 8.49 4.82 0.00 1.66 1.49 0.96 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.35 4.72 0.00 3.83 3.69 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 81 C 8.64 3.94 0.00 2.22 1.18 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 82 S 7.81 3.96 0.00 3.89 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 83 A 7.93 4.06 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 84 L 7.83 4.47 0.00 1.95 1.83 1.06 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.07 5.06 0.00 1.76 1.71 1.13 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.83 4.41 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 7.09 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 87 D 8.57 4.44 0.00 2.64 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.04 4.60 0.00 2.70 2.75 0.00 0.00 6.95 7.94 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 89 I 8.49 4.24 1.82 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.56 0.95 0.00 0.00 90 A 8.31 3.94 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 91 D 8.09 4.26 0.00 2.75 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 92 A 8.00 4.07 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.13 3.24 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 0.82 0.00 0.00 94 A 8.07 3.83 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 95 C 8.39 4.28 0.00 3.11 3.26 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 96 S 8.24 4.08 0.00 3.41 3.46 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 97 K 7.66 3.90 0.00 1.62 1.36 0.00 1.28 0.00 0.00 0.78 0.00 0.00 2.33 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.30 1.04 7.81 98 R 7.71 4.08 0.00 2.01 2.16 0.00 3.31 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.02 0.00 99 V 7.65 2.44 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 -0.29 0.00 0.00 -0.57 0.00 0.00 100 V 7.58 3.93 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 1.13 0.00 0.00 1.42 0.00 0.00 101 R 7.72 4.21 0.00 2.06 2.05 0.00 3.25 0.00 0.00 3.40 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.13 0.00 102 D 7.46 4.70 0.00 3.10 2.63 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 0.00 0.00 0.00 0.00 103 P 0.00 4.22 0.00 2.15 2.21 0.00 3.79 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 1.99 2.01 0.00 104 Q 8.21 4.01 0.00 2.07 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.85 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 105 G 7.96 3.66 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 0.00 0.00 0.00 106 I 7.73 3.55 0.98 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.27 -0.36 -0.77 0.00 0.00 107 R 7.28 4.21 0.00 2.05 2.04 0.00 3.24 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.69 0.00 108 A 7.70 4.07 0.81 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 0.00 109 W 8.18 4.67 0.00 3.48 3.27 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 0.00 110 V 8.78 3.74 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.30 4.04 1.53 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 0.00 0.00 112 W 8.30 3.99 0.00 3.52 3.53 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 0.00 113 R 8.22 3.66 0.00 2.05 1.99 0.00 3.73 0.00 0.00 3.52 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.17 0.00 114 N 8.09 4.36 0.00 2.65 2.70 0.00 0.00 6.94 7.19 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 0.00 115 R 7.52 4.12 0.00 0.75 0.71 0.00 2.81 0.00 0.00 2.85 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.81 0.00 116 C 7.10 4.55 0.00 1.74 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 6.56 3.28 0.00 0.93 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.69 0.00 0.00 0.00 0.00 0.00 2.18 2.18 0.00 118 N 8.59 4.19 0.00 2.77 2.80 0.00 0.00 6.87 7.66 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 0.00 119 R 7.29 4.50 0.00 1.85 1.79 0.00 3.17 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 120 D 8.45 4.53 0.00 2.64 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 0.00 121 V 8.21 4.57 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 0.86 0.00 0.00 1.07 0.00 0.00 122 R 8.12 4.02 0.00 1.93 2.02 0.00 3.28 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 123 Q 8.16 4.00 0.00 2.04 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.90 0.00 0.00 0.00 0.00 0.00 2.12 1.52 0.00 124 Y 7.83 3.98 0.00 3.25 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 0.00 125 V 7.88 4.34 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 0.83 0.00 0.00 1.05 0.00 0.00 126 Q 7.44 4.17 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 127 G 8.97 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 0.00 128 C 8.12 4.44 0.00 3.08 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 0.00 129 G 8.15 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 0.00 0.00 0.00 130 V 7.87 4.01 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 0.81 0.00 0.00 0.96 0.00 0.00