NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3395 8.3349 115.2909 57.5721 64.3511 173.5104 2 S 4.4618 7.9686 116.5058 55.0965 63.5241 171.8486 3 I 4.4547 8.8057 120.5152 59.2214 40.6755 175.3717 4 I 3.9099 8.2246 124.6536 61.6720 38.2220 174.9530 5 R 5.0422 8.5154 126.2018 54.5305 32.7484 174.0344 6 K 4.6666 9.3608 127.2724 54.4839 36.1616 175.1369 7 V 4.1332 8.4616 127.0630 62.8518 31.7959 175.2131 8 I 4.3359 8.7903 129.6778 60.8339 38.7698 175.0168 9 S 4.9979 8.3634 119.6248 57.5777 65.4597 173.2496 10 T 4.6469 9.3668 121.1963 60.6605 70.3246 174.3178 11 S 4.4346 8.6365 121.8295 59.5203 63.5955 175.3283 12 K 4.0006 8.0892 120.6187 58.3373 31.9169 176.4357 13 A 4.7826 7.2062 120.7138 48.9357 21.5510 174.1971 14 P 4.4506 0.0000 0.0000 62.3863 31.8416 176.9521 15 A 4.0823 8.4637 124.4040 52.0356 18.9113 177.2254 16 A 4.0022 8.2312 122.9072 52.1763 18.8858 177.8187 17 I 4.4067 8.2831 114.5789 60.2263 38.0289 175.4943 18 G 4.0865 7.0336 108.2925 45.6812 0.0000 173.6838 19 A 4.3579 8.3847 120.8365 50.1136 17.0551 176.1309 20 Y 4.8803 6.9052 117.3372 55.3944 41.0827 175.6432 21 S 4.6660 8.4659 117.1558 57.5594 64.6749 174.4785 22 Q 4.4734 8.7742 122.0484 59.1799 29.4606 176.2674 23 A 5.1243 7.7621 117.9715 50.9522 23.6719 175.0387 24 V 4.7679 8.8450 118.6570 61.1190 34.9096 173.9404 25 L 5.1566 9.0480 130.7007 53.6504 44.0458 175.5067 26 V 4.5546 8.7748 126.0083 62.2236 34.3297 176.4840 27 D 4.4505 9.9760 128.7010 55.1482 41.1605 174.0331 28 R 4.6751 5.8400 111.6877 56.0087 33.0646 175.3247 29 T 4.8398 8.2236 117.2108 62.0585 70.8877 173.6062 30 I 4.8640 8.6900 126.7576 59.7939 39.9664 174.0229 31 Y 4.6671 9.1010 125.6366 56.4196 39.5650 174.7431 32 V 4.5813 8.4829 124.9248 61.0305 33.5123 175.6505 33 S 4.4716 8.8963 124.4002 58.3096 63.8619 174.3559 34 G 3.8970 8.3234 108.5310 46.4536 0.0000 173.0592 35 Q 4.6167 9.0384 127.0312 54.9443 30.1315 175.5600 36 I 4.7437 8.3001 116.6809 57.8896 41.1668 175.7144 37 G 4.0008 8.0119 109.1240 46.1914 0.0000 173.5522 38 M 4.8741 7.6896 118.0272 54.6644 33.8588 177.7055 39 D 4.4498 9.0608 123.4989 53.6622 42.0382 175.3698 40 P 4.3792 0.0000 0.0000 66.0060 31.7818 178.1500 41 S 4.2616 8.3088 112.8817 61.5388 62.7444 175.6154 42 S 4.3206 8.5960 114.1173 58.2044 63.4666 176.3900 43 G 4.0207 8.4621 108.4669 45.7165 0.0000 173.5776 44 Q 4.4765 7.3464 117.6973 54.5492 30.7638 175.3076 45 L 4.5563 8.3465 120.5233 55.0360 42.2263 177.9844 46 V 3.9440 8.7676 117.3491 60.7675 32.1876 174.6912 47 P 4.4711 0.0000 0.0000 62.4873 32.2340 176.2177 48 G 3.9286 9.1289 105.6944 44.9004 0.0000 174.8276 49 G 3.8300 8.1773 107.3038 44.5940 0.0000 173.7269 50 V 3.5844 8.4812 117.0449 64.9968 31.0820 178.0022 51 A 4.0073 7.9445 120.8522 54.9708 18.2929 179.3643 52 E 3.9792 8.1171 116.6345 59.4983 29.6584 179.2191 53 E 3.9525 8.5242 118.6904 59.2230 29.5383 179.2404 54 A 3.9762 8.5974 121.0475 55.1922 18.5290 179.6293 55 K 3.8960 8.0412 117.0143 59.8982 32.0888 179.3531 56 Q 3.9740 8.3965 119.5031 58.9664 28.8836 177.9764 57 A 4.1047 8.5138 122.2540 55.2684 18.3644 179.6266 58 L 3.8307 7.8549 117.4244 57.7565 41.5169 179.9351 59 K 4.1238 8.0817 118.4764 59.5368 31.9926 179.1435 60 N 4.3533 8.4721 117.2028 56.0958 38.4097 177.1423 61 L 3.9938 8.3237 122.2146 58.0259 42.1095 178.9648 62 G 3.2212 8.2097 105.9300 48.0168 0.0000 175.4353 63 E 3.9568 8.1652 121.3050 58.8560 29.4969 179.4966 64 I 3.6897 7.8267 119.8945 64.3682 37.1101 178.3918 65 L 4.0009 8.1340 120.1922 57.5518 41.5206 179.3482 66 K 4.1035 8.4776 120.9436 58.9627 31.9347 178.6215 67 A 4.1396 7.9479 118.7632 53.9148 18.1920 178.3035 68 A 4.6476 7.1293 116.7435 51.1645 19.6637 176.6954 69 G 3.8209 7.8998 106.0851 48.1475 0.0000 173.6217 70 C 5.0759 8.2452 117.5687 57.6436 32.3615 171.6236 71 D 4.5248 9.0675 117.8578 52.9399 41.2613 175.6469 72 F 4.2831 8.8064 115.8111 60.5200 39.1560 177.4754 73 T 4.1298 8.3195 110.5888 64.3058 68.8116 175.2368 74 N 4.7460 8.2844 118.9100 54.4434 38.9877 175.1918 75 V 4.2103 7.6902 119.0244 62.9282 32.3588 175.7489 76 V 4.4224 8.7696 118.4307 61.4364 35.0417 175.4974 77 K 5.1338 7.7826 121.0883 55.3190 35.6694 174.7160 78 T 5.1930 9.0536 116.7241 60.2137 72.8947 172.8169 79 T 4.8796 8.6695 118.7986 61.9294 71.9477 173.2160 80 V 4.2969 8.8924 127.9950 61.3365 33.2136 174.3189 81 L 4.6483 8.6582 129.3365 52.9875 43.5886 175.7473 82 L 5.1619 8.5652 123.7031 52.8404 44.4380 177.5752 83 A 4.0704 8.7222 124.1982 54.0072 19.4905 177.4498 84 D 4.6210 7.8263 114.7674 52.4143 43.8598 175.4035 85 I 3.7051 9.6264 128.6470 64.3001 38.0334 177.0760 86 N 4.6391 8.4731 115.5637 54.9002 38.5560 175.7774 87 D 4.6852 8.4864 118.7852 54.7474 41.0133 177.8064 88 F 4.6487 8.3860 123.2166 61.3104 39.3969 177.1216 89 G 3.4923 8.0801 104.8220 48.0920 0.0000 175.5116 90 T 3.9051 7.9040 118.0080 66.4624 68.5461 176.7566 91 V 3.7163 7.9871 120.0664 65.8231 31.5212 177.5785 92 N 4.2719 8.4694 117.2503 56.6463 38.5378 176.6703 93 E 3.9936 8.0258 118.8399 59.5106 29.9395 179.1456 94 I 3.9477 7.8582 119.7714 64.6809 37.2525 177.8565 95 Y 4.2637 8.7681 120.7220 60.7731 38.1120 178.3372 96 K 4.2332 8.4704 119.8578 59.4696 31.9595 178.7758 97 T 3.7672 7.7979 107.8129 63.4291 68.9786 175.3982 98 Y 3.7987 7.7233 118.8569 57.6150 39.1418 175.1985 99 F 4.7350 7.2807 118.6986 55.6290 38.9844 174.8165 100 Q 4.6792 8.1020 123.7416 51.9163 29.1093 176.0681 101 G 4.0692 7.2130 119.7367 46.6922 0.0000 173.6116 102 N 4.4058 9.0018 125.7600 53.2417 37.3941 174.2182 103 L 4.2664 8.1499 123.3971 53.4718 42.5590 175.7003 104 P 4.5866 0.0000 0.0000 62.5084 32.2686 175.8093 105 A 4.3020 8.9358 123.4149 52.5814 19.6620 176.5315 106 R 5.0964 8.2223 117.5558 55.1251 33.3454 173.9185 107 A 5.0280 8.7582 125.6550 50.4302 22.8418 174.9993 108 A 4.6950 8.3347 120.0570 51.0504 22.1096 175.3110 109 Y 4.5572 7.6666 118.9421 56.0316 41.8795 173.1068 110 Q 4.7586 8.6713 122.2033 55.6131 30.0728 175.5582 111 V 4.3982 8.4469 119.8384 59.7990 33.5064 176.0992 112 A 4.1126 8.6349 123.9867 54.9080 18.7272 177.7718 113 A 4.4081 7.3317 114.0500 51.7055 21.3415 175.2820 114 L 4.7585 7.8265 119.8277 51.7731 44.8284 174.5161 115 P 4.2409 0.0000 0.0000 64.4476 31.6062 177.1511 116 K 3.9236 9.1957 119.9358 56.9718 29.1843 175.8973 117 G 3.9759 7.7966 104.0613 46.5939 0.0000 175.1371 118 S 4.4398 7.7391 114.0993 58.5456 63.5437 174.6830 119 R 4.5197 9.2374 120.2833 56.7067 31.4575 176.0898 120 I 4.9582 7.3819 118.0302 59.7511 41.2941 173.0654 121 E 4.9113 9.3686 129.9866 54.4079 33.0581 174.1443 122 I 4.9637 8.6871 127.1234 59.7528 40.0567 174.7681 123 E 4.9603 9.1244 126.8277 55.3126 32.1080 175.0463 124 A 5.2440 8.2093 122.3162 50.8456 23.3405 175.2122 125 I 4.9391 9.1182 120.9214 59.4418 40.5181 174.7884 126 A 5.2175 8.8401 126.8316 50.1139 23.0376 174.8182 127 V 4.7990 8.4887 118.6930 60.9141 34.1489 175.6669 128 Q 4.0615 9.4408 127.6388 56.3337 29.4601 177.0829 129 G 2.7832 7.9439 107.2598 43.6522 0.0000 170.3741 130 P 4.0209 0.0000 0.0000 62.5335 31.6073 176.4887 131 F 4.9972 8.0919 121.8736 55.6086 41.0653 176.0469 132 T 4.1039 8.5657 118.4521 64.1407 68.2029 174.4682 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 S 8.33 4.34 0.00 3.85 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 2 S 7.97 4.46 0.00 3.98 3.79 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 3 I 8.81 4.45 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.60 0.93 0.00 0.00 4 I 8.22 3.91 1.88 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 1.23 0.62 0.92 0.00 0.00 5 R 8.52 5.04 0.00 1.78 1.77 0.00 3.37 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 6 K 9.36 4.67 0.00 1.77 1.57 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.37 7.81 7 V 8.46 4.13 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 0.84 0.00 0.00 0.94 0.00 0.00 8 I 8.79 4.34 2.00 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 1.14 1.00 0.91 0.00 0.00 9 S 8.36 5.00 0.00 3.83 3.67 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 0.00 0.00 0.00 0.00 10 T 9.37 4.65 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 1.33 0.00 0.00 11 S 8.64 4.43 0.00 4.02 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 12 K 8.09 4.00 0.00 1.79 1.92 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.62 7.81 13 A 7.21 4.78 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 14 P 0.00 4.45 0.00 2.10 2.03 0.00 3.73 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.29 0.00 15 A 8.46 4.08 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 16 A 8.23 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.28 4.41 1.91 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 1.41 0.95 0.94 0.00 0.00 18 G 7.03 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 19 A 8.38 4.36 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 20 Y 6.91 4.88 0.00 3.02 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 21 S 8.47 4.67 0.00 3.95 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 22 Q 8.77 4.47 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.67 0.00 0.00 0.00 0.00 0.00 2.53 2.43 0.00 23 A 7.76 5.12 1.20 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 24 V 8.85 4.77 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 1.07 0.00 0.00 0.99 0.00 0.00 25 L 9.05 5.16 0.00 1.79 1.53 1.01 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 26 V 8.77 4.55 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 0.95 0.00 0.00 0.99 0.00 0.00 27 D 9.98 4.45 0.00 2.80 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 28 R 5.84 4.68 0.00 1.84 1.86 0.00 3.14 0.00 0.00 3.17 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 29 T 8.22 4.84 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 0.65 0.00 0.00 30 I 8.69 4.86 1.81 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 1.21 0.66 0.90 0.00 0.00 31 Y 9.10 4.67 0.00 3.01 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.48 4.58 2.22 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 1.04 0.00 0.00 0.94 0.00 0.00 33 S 8.90 4.47 0.00 3.88 3.56 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 34 G 8.32 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 0.00 0.00 0.00 35 Q 9.04 4.62 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 36 I 8.30 4.74 1.87 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 1.28 0.68 0.89 0.00 0.00 37 G 8.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.69 4.87 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.63 0.00 39 D 9.06 4.45 0.00 2.80 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 40 P 0.00 4.38 0.00 2.09 2.27 0.00 3.75 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.29 0.00 41 S 8.31 4.26 0.00 4.01 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.60 4.32 0.00 4.02 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 43 G 8.46 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 0.00 0.00 0.00 0.00 44 Q 7.35 4.48 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.93 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 45 L 8.35 4.56 0.00 1.54 1.62 1.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 46 V 8.77 3.94 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 0.73 0.00 0.00 1.04 0.00 0.00 47 P 0.00 4.47 0.00 2.18 2.07 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 48 G 9.13 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 49 G 8.18 3.83 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 0.00 0.00 0.00 50 V 8.48 3.58 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 0.94 0.00 0.00 0.96 0.00 0.00 51 A 7.94 4.01 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 52 E 8.12 3.98 0.00 2.13 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 2.42 2.36 0.00 53 E 8.52 3.95 0.00 2.16 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 2.34 2.54 0.00 54 A 8.60 3.98 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 55 K 8.04 3.90 0.00 2.04 1.98 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.62 1.68 7.81 56 Q 8.40 3.97 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 57 A 8.51 4.10 1.37 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 58 L 7.85 3.83 0.00 0.85 0.41 0.73 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.08 4.12 0.00 2.01 1.93 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.65 1.82 7.81 60 N 8.47 4.35 0.00 2.92 3.01 0.00 0.00 6.66 6.41 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 61 L 8.32 3.99 0.00 1.75 1.88 0.92 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.21 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 0.00 0.00 0.00 63 E 8.17 3.96 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 64 I 7.83 3.69 1.97 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.26 0.91 0.00 0.00 65 L 8.13 4.00 0.00 1.51 1.56 0.63 0.64 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 66 K 8.48 4.10 0.00 1.87 1.91 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.30 7.81 67 A 7.95 4.14 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 68 A 7.13 4.65 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 69 G 7.90 3.82 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 0.00 0.00 0.00 70 C 8.25 5.08 0.00 3.01 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 71 D 9.07 4.52 0.00 2.81 2.73 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 72 F 8.81 4.28 0.00 3.06 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 73 T 8.32 4.13 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 1.34 0.00 0.00 74 N 8.28 4.75 0.00 3.12 3.12 0.00 0.00 6.48 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 75 V 7.69 4.21 2.56 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 0.89 0.00 0.00 1.20 0.00 0.00 76 V 8.77 4.42 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 0.58 0.00 0.00 0.93 0.00 0.00 77 K 7.78 5.13 0.00 1.83 1.59 0.00 1.74 0.00 0.00 1.88 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.52 7.81 78 T 9.05 5.19 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 1.20 0.00 0.00 79 T 8.67 4.88 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 1.11 0.00 0.00 80 V 8.89 4.30 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 0.91 0.00 0.00 0.86 0.00 0.00 81 L 8.66 4.65 0.00 1.56 1.40 0.85 0.01 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 82 L 8.57 5.16 0.00 1.41 1.46 0.66 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.72 4.07 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 84 D 7.83 4.62 0.00 2.62 2.71 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 85 I 9.63 3.71 1.95 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.11 0.94 0.00 0.00 86 N 8.47 4.64 0.00 2.90 2.88 0.00 0.00 7.04 7.67 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 87 D 8.49 4.69 0.00 2.80 2.73 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 88 F 8.39 4.65 0.00 3.14 3.01 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 89 G 8.08 3.49 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 90 T 7.90 3.91 4.45 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 0.00 0.00 0.00 1.24 0.00 0.00 91 V 7.99 3.72 2.37 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 1.05 0.00 0.00 1.05 0.00 0.00 92 N 8.47 4.27 0.00 2.38 2.74 0.00 0.00 7.18 8.48 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 93 E 8.03 3.99 0.00 2.22 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 2.53 2.50 0.00 94 I 7.86 3.95 2.15 0.00 0.00 0.92 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 1.10 1.10 0.00 0.00 95 Y 8.77 4.26 0.00 3.23 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 96 K 8.47 4.23 0.00 2.15 1.90 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.70 7.81 97 T 7.80 3.77 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 1.22 0.00 0.00 98 Y 7.72 3.80 0.00 2.22 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 7.28 4.74 0.00 2.66 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 0.00 100 Q 8.10 4.68 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 101 G 7.21 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 0.00 102 N 9.00 4.41 0.00 2.72 2.81 0.00 0.00 6.79 7.85 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 0.00 103 L 8.15 4.27 0.00 1.66 1.63 0.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 104 P 0.00 4.59 0.00 1.82 1.92 0.00 3.55 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 2.20 0.00 105 A 8.94 4.30 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 0.00 106 R 8.22 5.10 0.00 1.70 1.69 0.00 2.54 0.00 0.00 2.68 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.51 0.00 107 A 8.76 5.03 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 0.00 108 A 8.33 4.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 Y 7.67 4.56 0.00 2.94 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.67 4.76 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.52 0.00 111 V 8.45 4.40 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 0.76 0.00 0.00 0.91 0.00 0.00 112 A 8.63 4.11 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 0.00 113 A 7.33 4.41 1.19 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 0.00 0.00 114 L 7.83 4.76 0.00 1.86 1.54 0.99 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.24 0.00 2.16 1.99 0.00 3.68 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 116 K 9.20 3.92 0.00 1.92 1.94 0.00 1.93 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.39 7.81 117 G 7.80 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 0.00 0.00 0.00 118 S 7.74 4.44 0.00 3.90 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 0.00 119 R 9.24 4.52 0.00 1.68 1.95 0.00 3.32 0.00 0.00 3.10 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 120 I 7.38 4.96 1.88 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 1.23 0.68 0.92 0.00 0.00 121 E 9.37 4.91 0.00 1.98 1.67 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 0.00 2.14 2.20 0.00 122 I 8.69 4.96 1.92 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.73 1.05 0.00 0.00 123 E 9.12 4.96 0.00 1.92 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 0.00 2.25 2.23 0.00 124 A 8.21 5.24 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 0.00 125 I 9.12 4.94 1.82 0.00 0.00 0.92 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 0.88 0.68 0.00 0.00 126 A 8.84 5.22 1.20 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 0.00 127 V 8.49 4.80 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 0.98 0.00 0.00 0.93 0.00 0.00 128 Q 9.44 4.06 0.00 1.89 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 129 G 7.94 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 0.00 0.00 0.00 130 P 0.00 4.02 0.00 2.10 2.00 0.00 3.53 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.89 0.00 131 F 8.09 5.00 0.00 3.14 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 0.00 132 T 8.57 4.10 4.30 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 1.24 0.00 0.00