NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.1288 8.3149 121.7615 55.7294 34.1621 177.0123 5 P 3.7961 0.0000 0.0000 60.9239 32.9517 175.4308 6 I 3.4807 7.6285 120.4602 64.2165 38.3439 178.0588 7 W 4.0992 7.6489 116.7269 59.3498 27.8973 177.6458 8 E 3.9440 6.9753 119.7931 58.8397 29.1891 178.4537 9 Q 3.8576 7.9685 118.3698 58.9934 28.7523 178.8837 10 I 3.6149 7.6929 120.9050 64.0871 37.0147 178.6895 11 G 3.3411 7.7668 106.5312 47.7880 0.0000 175.9537 12 S 4.3272 7.8064 118.9989 60.7406 62.7951 176.5553 13 S 4.0317 7.9354 115.7867 61.3703 62.0544 175.9505 14 F 3.8966 8.4271 123.4910 61.2801 39.1029 176.8717 15 I 3.2459 7.8298 119.3920 64.3874 36.9552 177.6708 16 N 4.3456 8.3573 117.8881 57.2036 38.7330 176.2605 17 H 4.0867 8.2775 119.6756 59.2737 29.8667 176.6032 18 Y 3.5355 7.9514 121.6229 60.8706 38.5057 177.6704 19 Y 4.2766 8.0024 117.6355 60.8752 37.4474 177.9289 20 Q 4.0304 8.2239 120.8502 59.0040 29.0362 178.2631 21 L 3.9127 7.7812 120.2356 57.5184 41.4294 179.1392 22 F 3.6370 7.8823 119.5932 61.2688 39.4960 176.4576 23 D 4.8321 8.5415 116.1082 55.7989 40.9283 176.7846 24 N 4.9410 7.8127 113.3753 53.4725 41.8109 174.8046 25 D 4.6846 8.8181 117.4954 51.5608 42.5420 175.3384 26 R 3.5139 7.9491 123.4986 60.0062 30.3299 178.5622 27 T 3.8167 7.7817 113.2623 66.6569 68.6932 175.5752 28 Q 4.1865 8.2627 118.7145 57.0860 28.9350 177.9319 29 L 4.0186 8.1247 121.6395 57.4811 41.5343 179.1608 30 G 4.0433 8.3077 105.2163 48.0735 0.0000 175.1924 31 A 4.1345 7.8098 121.5142 54.1442 18.5884 178.0833 32 I 4.2729 8.0185 110.0930 60.8098 37.9804 174.5769 33 Y 5.3421 7.8610 118.4289 56.4536 41.0057 174.0424 34 I 4.8333 8.6227 113.8091 58.7917 41.1551 176.0680 35 D 4.3148 8.8886 119.4928 57.5984 40.5399 178.4483 36 A 4.3988 7.8742 117.9963 52.3012 19.1216 177.3349 37 S 4.7784 8.0740 113.8395 59.2479 64.3063 173.2773 38 C 5.3234 9.3078 119.6350 58.0098 32.3919 172.9256 39 L 5.4352 9.0676 123.5792 53.7368 45.6018 175.1455 40 T 5.2681 9.1732 122.0142 61.7431 71.8601 172.6505 41 W 5.0760 9.7909 135.0000 55.6238 32.8889 175.6959 42 E 3.8517 9.9700 130.0025 57.4692 27.1492 175.9684 43 G 4.0925 8.4580 106.3328 45.5071 0.0000 173.8387 44 Q 4.2033 8.4375 120.2510 55.4349 29.4370 174.5965 45 Q 4.6685 8.2580 122.0786 54.8609 30.3294 175.5303 46 F 4.5724 9.5299 122.8432 55.7476 41.6172 173.2712 47 Q 4.5762 8.6440 122.5920 55.6182 30.0274 176.7420 48 G 4.4925 9.1266 110.7111 45.6658 0.0000 174.3525 49 K 3.8306 8.6968 121.7080 59.0848 32.2389 179.0952 50 A 3.9365 8.0119 120.3871 55.1846 18.3979 179.2944 51 A 4.0142 7.9476 118.6848 55.3361 18.5082 179.7431 52 I 3.4071 7.6905 118.5604 64.4476 37.1508 179.1367 53 V 3.4954 7.9833 120.2936 64.6171 30.8880 178.3880 54 E 3.8066 7.6407 118.1336 58.8897 29.5637 178.7651 55 K 3.5628 7.5442 119.5060 59.4540 32.0726 178.7067 56 L 3.2999 7.4037 119.0623 57.4981 41.2683 178.9757 57 S 4.1621 7.3095 111.5736 59.1247 63.1578 175.3212 58 S 4.5442 7.5096 117.4405 57.0423 63.4590 173.9444 59 L 4.0022 6.4472 122.9282 53.5833 41.8878 174.7041 60 P 4.2042 0.0000 0.0000 67.0303 31.1872 180.3081 61 F 3.9113 8.3190 115.2068 58.9718 36.0669 176.3309 62 Q 4.9738 8.2063 122.4908 55.7422 28.6884 175.9340 63 K 4.7816 7.7893 123.7542 56.5133 33.4405 174.2420 64 I 4.1927 7.1121 120.5622 61.8200 38.9209 174.9077 65 Q 5.0476 8.5690 122.3168 55.3647 32.0617 173.0239 66 H 4.9793 9.8254 120.2978 54.4304 30.8149 174.5803 67 S 4.5953 9.1558 117.2221 56.5139 64.9901 172.9731 68 I 4.2464 8.4100 129.1160 61.3189 36.9094 176.0583 69 T 4.2682 8.5347 124.5976 66.0060 69.8648 174.8285 70 A 4.7520 8.0522 120.8521 50.8442 23.0389 175.4781 71 Q 4.9970 8.4875 117.1722 54.6790 32.6729 173.3468 72 D 5.0514 9.2301 121.4597 52.8693 44.4453 174.5038 73 H 5.5388 8.9005 119.0200 54.3342 32.4671 172.9569 74 Q 4.3228 8.8080 119.7146 53.6497 33.4031 172.5140 75 P 5.0057 0.0000 0.0000 62.3560 33.1807 175.0042 76 T 4.4719 8.5403 111.5691 59.2660 71.4383 173.6264 77 P 4.2129 0.0000 0.0000 65.8720 31.3479 177.1678 78 D 4.7158 8.0047 115.5032 54.4100 40.6852 176.2489 79 S 3.8391 7.8789 112.8488 59.9837 60.9176 171.8501 80 C 4.9532 8.5987 118.0041 58.7442 30.9136 172.6826 81 I 4.8909 8.8512 120.8245 59.6789 39.8486 174.6337 82 I 4.9199 8.5323 127.7776 59.4291 40.1003 174.3849 83 S 5.3089 9.7382 125.3516 56.9071 66.9698 172.5594 84 M 5.1526 9.2795 123.7188 53.8025 34.8036 174.2817 85 V 4.9295 9.4934 126.7564 61.1687 34.9316 174.4030 86 V 3.9690 8.3811 126.2816 60.9843 34.7709 174.6243 87 G 4.2821 6.6446 112.6987 46.2978 0.0000 171.5838 88 Q 5.3013 8.5916 118.9263 54.4257 32.5926 174.2289 89 L 5.0451 8.6765 122.2475 54.2599 42.9842 176.0287 90 K 4.7532 9.2383 122.4013 54.6209 35.7559 174.7820 91 A 4.7336 7.8715 121.3844 50.8965 22.1115 176.4020 92 D 4.4060 8.7799 122.9835 55.7762 40.1084 176.0175 93 E 4.6298 7.5025 127.9527 56.5187 31.2960 175.1994 94 D 4.5966 7.8768 120.6750 52.5154 41.5663 174.1624 95 P 4.4056 0.0000 0.0000 63.5127 32.6184 176.0453 96 I 4.3662 7.5449 125.5908 61.3639 36.4450 175.3993 97 M 4.3474 8.5651 128.4330 56.5589 33.9517 175.4739 98 G 4.3687 8.5615 109.2734 45.1836 0.0000 172.2443 99 F 5.3168 8.8159 114.3345 56.2943 41.7742 172.5813 100 H 5.1296 8.7956 113.8337 54.2194 32.2520 172.1695 101 Q 5.0023 9.5157 120.5816 55.2222 33.0482 172.9637 102 M 5.2780 8.8457 125.4772 53.5913 35.3302 174.7905 103 F 5.3913 9.6133 120.9234 55.5766 43.6787 173.5938 104 L 5.0279 9.0020 124.5205 53.4216 44.4048 174.8588 105 L 5.2688 9.4253 127.6062 52.9816 44.3846 175.5966 106 K 4.9880 9.1843 123.4136 54.7092 36.2009 174.2378 107 N 4.4202 8.1642 124.8436 52.0892 39.8265 174.1681 108 I 4.3899 8.2444 126.9045 60.9139 40.5113 175.5192 109 N 3.8321 9.6288 121.2826 54.8747 36.4692 173.6321 110 D 4.3348 8.0103 110.7474 54.8059 38.7298 174.1508 111 A 4.6760 7.5837 118.8437 50.2333 23.4567 176.8409 112 W 4.6827 8.8301 121.8684 56.4426 30.0569 176.2716 113 V 4.7864 9.0107 117.2315 59.7336 35.9132 173.8917 114 C 4.9305 9.1823 123.8477 58.5813 31.9143 173.4304 115 T 4.5577 8.9675 116.7069 62.9702 70.7075 174.5267 116 N 5.5386 8.1334 118.9527 51.4708 43.1674 172.9658 117 D 5.1655 9.5745 123.1937 52.4443 44.7406 173.7076 118 E 5.2365 9.0558 126.3323 54.4080 33.0818 173.8936 119 F 5.2403 9.4972 128.7866 56.4955 42.9993 173.6532 120 R 4.6732 7.7803 123.3982 54.3033 34.2244 174.5417 121 L 4.5980 8.7985 123.1962 54.3445 43.2877 176.2453 122 A 4.3479 9.1733 122.9280 50.2480 22.8690 177.1723 123 L 4.4892 7.9118 124.0117 54.3721 40.7279 176.6604 124 H 4.7314 7.2557 114.7043 53.8953 31.8164 174.7785 125 N 4.3337 8.4677 120.8443 53.7338 39.0680 175.2589 126 F 4.2630 7.5096 120.5632 58.0101 39.2306 174.9386 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 4 K 8.31 4.13 0.00 1.63 1.78 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 1.42 7.81 5 P 0.00 3.80 0.00 0.60 0.49 0.00 3.48 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.86 0.00 6 I 7.63 3.48 1.81 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.26 0.96 0.00 0.00 7 W 7.65 4.10 0.00 3.53 3.48 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 8 E 6.98 3.94 0.00 1.72 1.79 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 2.33 2.48 0.00 9 Q 7.97 3.86 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 10 I 7.69 3.61 1.39 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.54 -0.40 0.00 0.00 11 G 7.77 3.34 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 0.00 0.00 0.00 12 S 7.81 4.33 0.00 3.87 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 13 S 7.94 4.03 0.00 3.95 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 14 F 8.43 3.90 0.00 3.08 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 15 I 7.83 3.25 2.13 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 1.49 0.15 1.14 0.00 0.00 16 N 8.36 4.35 0.00 2.81 3.08 0.00 0.00 6.93 8.47 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 17 H 8.28 4.09 0.00 3.21 3.24 0.00 5.84 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 7.95 3.54 0.00 2.18 2.38 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 19 Y 8.00 4.28 0.00 3.19 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 20 Q 8.22 4.03 0.00 2.43 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 21 L 7.78 3.91 0.00 1.70 1.42 0.78 0.78 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 22 F 7.88 3.64 0.00 2.83 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 23 D 8.54 4.83 0.00 2.85 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 24 N 7.81 4.94 0.00 2.83 2.80 0.00 0.00 6.67 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 25 D 8.82 4.68 0.00 2.57 2.41 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 0.00 26 R 7.95 3.51 0.00 1.61 1.55 0.00 2.21 0.00 0.00 2.74 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.49 0.00 27 T 7.78 3.82 4.16 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 0.00 0.00 1.15 0.00 0.00 28 Q 8.26 4.19 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.57 0.00 29 L 8.12 4.02 0.00 1.66 1.78 0.36 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 30 G 8.31 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 31 A 7.81 4.13 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 32 I 8.02 4.27 2.05 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.70 0.95 0.00 0.00 33 Y 7.86 5.34 0.00 3.14 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 34 I 8.62 4.83 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.11 0.97 0.00 0.00 35 D 8.89 4.31 0.00 2.83 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 36 A 7.87 4.40 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 37 S 8.07 4.78 0.00 4.00 3.99 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 38 C 9.31 5.32 0.00 2.86 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 39 L 9.07 5.44 0.00 1.73 1.51 1.38 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 40 T 9.17 5.27 4.35 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 1.35 0.00 0.00 41 W 9.79 5.08 0.00 3.60 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 42 E 9.97 3.85 0.00 2.35 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 2.22 2.53 0.00 43 G 8.46 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 8.44 4.20 0.00 2.71 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 45 Q 8.26 4.67 0.00 1.79 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.99 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 46 F 9.53 4.57 0.00 3.07 2.95 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 47 Q 8.64 4.58 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.43 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 48 G 9.13 4.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.70 3.83 0.00 2.03 1.84 0.00 1.83 0.00 0.00 1.87 0.00 0.00 3.06 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.53 1.57 7.81 50 A 8.01 3.94 1.32 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 0.00 0.00 0.00 51 A 7.95 4.01 1.56 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 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.69 3.41 1.68 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.68 0.16 0.00 0.00 53 V 7.98 3.50 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 0.84 0.00 0.00 0.85 0.00 0.00 54 E 7.64 3.81 0.00 2.15 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 2.28 2.25 0.00 55 K 7.54 3.56 0.00 0.79 1.02 0.00 0.97 0.00 0.00 0.98 0.00 0.00 2.72 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.56 7.81 56 L 7.40 3.30 0.00 1.38 1.19 0.94 0.46 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 57 S 7.31 4.16 0.00 3.71 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 58 S 7.51 4.54 0.00 3.70 3.77 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 59 L 6.45 4.00 0.00 1.15 0.60 0.17 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.20 0.00 2.35 2.21 0.00 3.90 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.21 0.00 61 F 8.32 3.91 0.00 3.07 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 62 Q 8.21 4.97 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.96 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 63 K 7.79 4.78 0.00 1.91 1.90 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.17 1.19 7.81 64 I 7.11 4.19 1.60 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.76 1.35 0.00 0.00 65 Q 8.57 5.05 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.59 0.00 0.00 0.00 0.00 0.00 2.24 2.50 0.00 66 H 9.83 4.98 0.00 2.73 2.82 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 9.16 4.60 0.00 3.87 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 68 I 8.41 4.25 1.90 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 1.33 1.05 0.94 0.00 0.00 69 T 8.53 4.27 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 1.22 0.00 0.00 70 A 8.05 4.75 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 71 Q 8.49 5.00 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 72 D 9.23 5.05 0.00 2.50 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 73 H 8.90 5.54 0.00 3.21 3.32 0.00 5.67 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.81 4.32 0.00 1.83 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.87 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 75 P 0.00 5.01 0.00 1.83 1.63 0.00 2.86 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.44 0.00 76 T 8.54 4.47 4.22 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 1.22 0.00 0.00 77 P 0.00 4.21 0.00 2.05 2.14 0.00 3.64 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 78 D 8.00 4.72 0.00 2.68 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 79 S 7.88 3.84 0.00 4.09 4.06 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 80 C 8.60 4.95 0.00 2.88 3.03 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 81 I 8.85 4.89 1.67 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 1.08 0.99 0.95 0.00 0.00 82 I 8.53 4.92 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.47 0.88 0.00 0.00 83 S 9.74 5.31 0.00 3.92 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 84 M 9.28 5.15 0.00 1.96 1.86 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 85 V 9.49 4.93 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 0.90 0.00 0.00 1.33 0.00 0.00 86 V 8.38 3.97 1.58 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 -0.55 0.00 0.00 0.21 0.00 0.00 87 G 6.64 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 0.00 0.00 0.00 0.00 88 Q 8.59 5.30 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 89 L 8.68 5.05 0.00 1.50 1.48 0.87 0.48 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 90 K 9.24 4.75 0.00 1.80 1.76 0.00 1.62 0.00 0.00 1.86 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.39 7.81 91 A 7.87 4.73 1.16 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 0.00 0.00 0.00 0.00 0.00 92 D 8.78 4.41 0.00 2.89 1.90 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 93 E 7.50 4.63 0.00 1.91 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 0.00 2.23 2.39 0.00 94 D 7.88 4.60 0.00 2.69 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.41 0.00 2.04 2.04 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 2.04 2.14 0.00 96 I 7.54 4.37 2.05 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.51 0.90 0.00 0.00 97 M 8.57 4.35 0.00 2.21 1.98 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.63 0.00 98 G 8.56 4.37 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 99 F 8.82 5.32 0.00 2.75 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 0.00 100 H 8.80 5.13 0.00 3.08 3.22 0.00 5.27 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 9.52 5.00 0.00 2.54 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 1.18 2.41 0.00 102 M 8.85 5.28 0.00 1.93 1.82 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 103 F 9.61 5.39 0.00 2.82 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 0.00 104 L 9.00 5.03 0.00 1.78 1.56 1.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 105 L 9.43 5.27 0.00 1.44 1.48 0.25 -0.64 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 0.00 106 K 9.18 4.99 0.00 1.81 1.60 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.25 1.34 7.81 107 N 8.16 4.42 0.00 1.44 2.02 0.00 0.00 6.83 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 0.00 108 I 8.24 4.39 1.81 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 1.23 0.49 0.87 0.00 0.00 109 N 9.63 3.83 0.00 2.74 2.79 0.00 0.00 7.11 8.06 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 0.00 110 D 8.01 4.33 0.00 2.74 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 0.00 111 A 7.58 4.68 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 0.00 112 W 8.83 4.68 0.00 3.30 3.15 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 0.00 113 V 9.01 4.79 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 0.76 0.00 0.00 1.02 0.00 0.00 114 C 9.18 4.93 0.00 3.04 2.88 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 0.00 115 T 8.97 4.56 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 1.27 0.00 0.00 116 N 8.13 5.54 0.00 2.74 2.75 0.00 0.00 6.55 8.08 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 0.00 117 D 9.57 5.17 0.00 3.00 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 0.00 118 E 9.06 5.24 0.00 2.02 1.69 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 2.24 2.38 0.00 119 F 9.50 5.24 0.00 2.93 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 0.00 0.00 0.00 0.00 120 R 7.78 4.67 0.00 1.42 1.44 0.00 3.24 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 121 L 8.80 4.60 0.00 1.66 1.55 1.15 0.76 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 0.00 122 A 9.17 4.35 0.94 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 0.00 0.00 123 L 7.91 4.49 0.00 1.57 1.59 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 124 H 7.26 4.73 0.00 1.99 1.77 0.00 5.71 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 N 8.47 4.33 0.00 2.59 2.82 0.00 0.00 7.16 7.45 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 0.00 126 F 7.51 4.26 0.00 3.15 2.87 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