NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2640 8.3144 120.1354 55.7897 33.2396 175.0769 2 E 3.8700 8.4398 123.3859 54.4003 30.2421 175.1971 3 T 4.1437 8.7469 118.5202 61.2220 72.1208 174.8891 4 A 3.9957 8.5356 123.5069 55.3877 18.4359 179.9296 5 A 4.1492 8.0336 118.5459 55.3362 18.4743 179.6054 6 A 4.0042 8.2091 119.3321 55.0856 18.3668 179.7063 7 K 4.0951 8.4116 119.9187 59.0596 32.1813 178.7633 8 F 4.0765 8.4623 120.9163 61.3376 39.3139 176.9872 9 E 4.0253 8.4481 118.2957 59.4084 29.0528 179.3231 10 R 3.8772 7.9615 117.7566 59.5439 30.2525 178.2013 11 Q 3.9665 8.0192 116.7353 57.8589 29.1648 176.2117 12 H 4.7613 7.9533 113.7545 53.7900 31.5369 173.0779 13 M 4.7447 7.9006 118.8572 53.8712 33.3765 176.3624 14 D 4.6628 9.0479 123.3023 52.9471 42.4622 174.9739 15 S 4.7625 8.4047 115.8857 58.1996 63.4031 175.7109 16 S 4.2710 8.1310 117.3386 61.0891 62.8983 174.6674 17 T 4.7060 7.4628 115.6702 60.7654 71.3204 174.4186 18 S 4.2128 8.5736 117.7277 60.7767 63.5943 173.9856 19 A 4.1059 7.0669 120.0760 50.7355 21.3542 175.5261 20 A 3.5836 8.2345 123.7430 52.2504 18.7723 178.3907 21 S 4.7513 8.1189 118.3283 57.2243 63.8429 174.1047 22 S 4.6306 7.1059 114.5007 60.1701 66.1036 175.6356 23 S 4.6324 8.7943 112.3525 58.9786 64.4546 174.4242 24 N 4.7302 7.9855 118.0733 53.5176 38.9090 175.0545 25 Y 4.0261 7.9937 120.7612 62.0626 38.7308 178.7751 26 C 4.2140 8.4606 116.9958 60.0288 38.5736 175.6954 27 N 4.3882 8.2634 117.6109 56.5838 38.1677 177.0459 28 Q 3.9820 8.0770 120.6429 59.2670 29.3126 177.9765 29 M 3.7452 8.0020 121.3507 57.8830 31.7969 178.6212 30 M 4.0300 8.1431 119.2913 58.0141 31.9974 178.8262 31 K 4.0123 7.8620 119.9421 59.0950 32.3938 179.2105 32 S 4.1994 8.1001 114.1031 60.5761 62.6039 175.3950 33 R 4.4889 7.4871 119.4250 54.9913 30.3589 175.5430 34 N 4.2362 8.0496 114.9194 54.9116 36.3834 174.7995 35 L 4.6124 8.1533 115.9598 54.8867 42.1545 177.8985 36 T 4.8756 7.5182 107.0357 60.0869 69.5258 175.6809 37 K 4.0552 8.3049 123.3087 59.7744 32.4614 177.4032 38 D 4.6366 7.8903 116.7945 55.4564 41.9693 176.3745 39 R 3.6301 7.0848 113.1330 54.8163 31.9784 174.3927 40 C 4.7271 8.5047 116.3700 55.6770 40.1469 173.9255 41 K 4.1483 8.6025 127.6157 55.9921 32.2901 174.9169 42 P 4.6933 0.0000 0.0000 65.0494 32.5955 176.6888 43 V 4.9557 7.6021 117.8857 61.1406 34.4303 174.4594 44 N 4.7335 9.3162 125.6450 52.7148 42.8662 172.8154 45 T 4.7762 7.9493 122.0514 61.7371 71.3225 173.0626 46 F 4.9287 8.8956 124.7858 55.7197 41.9498 174.6776 47 V 4.3984 8.9728 123.4024 61.0520 33.2535 175.7539 48 H 5.7531 8.6556 128.0867 54.0251 26.3933 173.1020 49 E 4.8205 7.6992 117.6559 53.2855 34.4916 176.6891 50 S 4.3618 8.3454 114.8277 58.2438 65.0067 174.8991 51 L 3.9859 8.5605 124.4503 58.4072 41.8748 179.1022 52 A 4.0178 8.0473 120.1188 55.5017 18.1040 179.2397 53 D 4.3370 7.9782 116.1403 57.3817 41.1477 178.9331 54 V 3.7789 7.9460 118.8897 66.1080 31.5891 178.1368 55 Q 3.8972 8.6160 118.0378 58.8259 28.4691 178.6071 56 A 4.0376 8.1402 121.4555 54.5982 18.2571 179.6396 57 V 3.4111 7.6073 117.0582 65.9649 31.2941 176.8559 58 C 3.7168 7.7707 114.6569 57.8015 39.8693 174.0793 59 S 4.6879 7.5158 114.5391 57.9661 63.8901 174.2850 60 Q 4.0910 7.2463 120.1376 56.2402 30.5531 178.5662 61 K 4.3350 8.5307 135.0000 56.4930 32.7227 174.5516 62 N 4.2692 8.7527 127.5857 53.6593 39.1992 174.3501 63 V 4.5883 8.3859 118.3831 59.1788 36.6966 174.9376 64 A 4.2141 8.4056 124.9669 52.3373 19.0653 178.5184 65 C 4.7334 8.8932 119.1196 55.9253 41.2801 175.1982 66 K 3.6858 8.8268 121.6310 59.7760 31.6356 178.0745 67 N 4.5177 8.0543 112.9603 53.0312 37.5480 175.8561 68 G 3.9346 8.1852 108.4818 45.6274 0.0000 174.1388 69 Q 4.2959 8.5180 119.4962 56.1599 29.2720 176.0756 70 T 4.7233 8.2007 107.7625 61.7000 69.2466 173.7356 71 N 5.0136 8.1043 117.1795 54.1561 38.7466 174.6592 72 C 5.2669 7.5836 115.2051 56.8827 43.8807 172.4841 73 Y 5.0844 8.8459 118.4214 56.4513 42.2604 173.9018 74 Q 5.0093 9.1386 125.8958 54.1326 31.1208 174.8971 75 S 4.5000 8.8469 122.2939 58.8416 63.0407 174.2938 76 Y 4.5200 9.1935 122.1262 60.8689 37.9077 176.9051 77 S 4.8060 7.8569 113.9021 56.9856 64.7303 173.8630 78 T 4.1444 8.0397 112.4919 62.1502 69.6624 173.4800 79 M 5.0429 9.0280 121.8797 53.2956 36.8270 174.7864 80 S 4.8424 9.4682 117.6842 58.4945 63.5695 173.1240 81 I 5.0964 9.1006 120.2367 59.4847 41.7408 174.1427 82 T 4.9954 8.8414 119.4617 61.9531 71.7245 172.8916 83 D 4.8850 9.2089 127.5299 53.6488 42.6527 174.7706 84 C 5.4994 9.2193 121.8652 55.2955 43.4555 172.8957 85 R 5.2432 8.7741 123.9180 54.0419 32.9136 174.1165 86 E 4.0149 9.3270 128.3144 56.5357 30.2482 176.8817 87 T 4.1927 8.6071 116.3538 60.9545 69.7414 175.9420 88 G 3.6167 8.5832 111.5293 48.1162 0.0000 174.6028 89 S 4.4843 7.2937 112.0636 58.0603 63.7655 174.5058 90 S 4.1132 7.3697 117.2021 58.3063 62.7763 173.3041 91 K 4.4799 8.3107 127.5047 54.6132 34.7526 174.5544 92 Y 4.4310 8.8021 127.5640 57.7054 39.0216 174.1150 93 P 3.1748 0.0000 0.0000 63.1134 32.2178 176.7328 94 N 4.6666 7.4908 119.1089 52.1347 36.9925 173.9063 95 C 4.3564 7.9178 116.1485 56.7912 42.1079 173.4615 96 A 5.1131 8.6187 125.7914 50.3306 21.8439 174.4105 97 Y 5.0460 9.2909 118.9375 56.0823 42.2088 175.1996 98 K 4.5323 9.0212 122.2639 55.7804 34.0944 175.7305 99 T 4.9880 8.5676 121.6078 62.6524 70.0389 174.3256 100 T 4.5976 8.7595 122.7808 61.8150 71.9969 173.4232 101 Q 4.7873 8.8221 125.5902 55.7873 29.9648 175.1503 102 A 4.6069 8.8607 122.9420 51.0365 23.6013 174.8321 103 N 5.3381 8.7125 117.5433 52.0478 40.8355 173.4784 104 K 4.8068 8.8306 124.7850 54.7616 37.5334 175.6973 105 H 4.7771 9.0942 119.4432 55.9643 29.9069 174.8536 106 I 4.8078 8.6285 115.6617 59.4112 40.5944 174.4006 107 I 4.9233 8.2695 124.6058 59.7111 39.9361 175.0790 108 V 4.8303 8.6454 119.5535 59.2778 35.9416 174.6170 109 A 4.8758 8.7212 125.2821 51.4997 20.1883 175.7850 110 C 5.1051 8.5931 119.1692 55.2344 40.1218 173.1453 111 E 4.6876 8.7371 121.3019 56.4703 33.6689 175.3419 112 G 3.8404 9.4794 110.4017 44.7467 0.0000 171.5419 113 N 4.9597 8.1552 116.0433 50.6132 40.5630 172.2229 114 P 4.3225 0.0000 0.0000 62.8770 31.9517 175.9014 115 Y 5.0480 8.2547 121.5872 56.7269 38.6025 174.4404 116 V 4.4274 7.9093 119.1292 58.3283 36.8176 173.3477 117 P 4.4979 0.0000 0.0000 62.8668 31.2515 177.0176 118 V 4.4831 8.6571 115.0869 61.0911 33.7020 175.0519 119 H 4.9320 7.8524 119.0970 55.1140 33.3502 171.8294 120 F 4.7174 8.6872 127.6457 57.2890 39.5016 174.5399 121 D 4.6176 8.6129 127.1875 56.2999 41.9376 175.8155 122 A 4.5806 6.5255 117.3231 51.5544 22.3437 174.8348 123 S 5.2118 8.9278 113.3869 56.7018 66.0862 174.7285 124 V 4.1487 8.7650 114.5238 61.7010 32.4288 175.4703 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 8.31 4.26 0.00 1.77 1.82 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.44 7.81 2 E 8.44 3.87 0.00 2.09 1.84 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 2.40 2.38 0.00 3 T 8.75 4.14 4.26 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 1.23 0.00 0.00 4 A 8.54 4.00 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 5 A 8.03 4.15 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 6 A 8.21 4.00 1.40 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 7 K 8.41 4.10 0.00 1.96 2.04 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.31 7.81 8 F 8.46 4.08 0.00 3.28 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 9 E 8.45 4.03 0.00 2.29 2.05 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 2.51 2.68 0.00 10 R 7.96 3.88 0.00 1.80 2.08 0.00 3.36 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 11 Q 8.02 3.97 0.00 1.46 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.48 0.00 0.00 0.00 0.00 0.00 2.22 2.44 0.00 12 H 7.95 4.76 0.00 1.82 2.59 0.00 5.60 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.90 4.74 0.00 1.99 2.19 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.73 0.00 14 D 9.05 4.66 0.00 2.76 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 4.76 0.00 3.94 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 16 S 8.13 4.27 0.00 3.97 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 17 T 7.46 4.71 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 1.23 0.00 0.00 18 S 8.57 4.21 0.00 3.96 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 19 A 7.07 4.11 1.12 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 0.00 0.00 20 A 8.23 3.58 0.72 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 0.00 0.00 21 S 8.12 4.75 0.00 3.92 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 22 S 7.11 4.63 0.00 4.01 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 23 S 8.79 4.63 0.00 4.00 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 24 N 7.99 4.73 0.00 2.87 2.83 0.00 0.00 6.82 7.56 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 25 Y 7.99 4.03 0.00 3.08 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 26 C 8.46 4.21 0.00 3.16 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 27 N 8.26 4.39 0.00 3.05 2.93 0.00 0.00 6.76 7.74 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 28 Q 8.08 3.98 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 29 M 8.00 3.75 0.00 0.81 1.28 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.36 0.00 30 M 8.14 4.03 0.00 1.68 1.82 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.35 0.00 31 K 7.86 4.01 0.00 1.87 1.91 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.31 7.81 32 S 8.10 4.20 0.00 4.03 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 33 R 7.49 4.49 0.00 1.89 2.12 0.00 3.60 0.00 0.00 3.20 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.04 0.00 34 N 8.05 4.24 0.00 2.89 2.93 0.00 0.00 6.79 7.29 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 35 L 8.15 4.61 0.00 1.77 1.62 0.77 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.52 4.88 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 1.46 0.00 0.00 37 K 8.30 4.06 0.00 1.77 1.91 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.43 7.81 38 D 7.89 4.64 0.00 2.62 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 39 R 7.08 3.63 0.00 1.81 1.62 0.00 2.95 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.55 0.00 40 C 8.50 4.73 0.00 3.09 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 41 K 8.60 4.15 0.00 1.80 1.77 0.00 1.75 0.00 0.00 1.60 0.00 0.00 3.16 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.42 7.81 42 P 0.00 4.69 0.00 2.15 2.10 0.00 3.62 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 2.13 2.10 0.00 43 V 7.60 4.96 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 0.79 0.00 0.00 0.97 0.00 0.00 44 N 9.32 4.73 0.00 2.62 2.28 0.00 0.00 6.66 7.30 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 45 T 7.95 4.78 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 0.92 0.00 0.00 46 F 8.90 4.93 0.00 2.99 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 47 V 8.97 4.40 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 1.06 0.00 0.00 1.04 0.00 0.00 48 H 8.66 5.75 0.00 3.10 3.45 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.70 4.82 0.00 1.95 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 2.25 2.26 0.00 50 S 8.35 4.36 0.00 4.07 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 51 L 8.56 3.99 0.00 1.83 1.75 1.01 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.05 4.02 1.34 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 53 D 7.98 4.34 0.00 2.85 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 54 V 7.95 3.78 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 1.22 0.00 0.00 1.06 0.00 0.00 55 Q 8.62 3.90 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 56 A 8.14 4.04 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 57 V 7.61 3.41 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 1.06 0.00 0.00 0.95 0.00 0.00 58 C 7.77 3.72 0.00 2.84 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.52 4.69 0.00 3.90 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 60 Q 7.25 4.09 0.00 1.61 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.98 0.00 0.00 0.00 0.00 0.00 1.76 2.14 0.00 61 K 8.53 4.34 0.00 2.11 1.88 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.48 7.81 62 N 8.75 4.27 0.00 2.67 2.62 0.00 0.00 7.00 7.71 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 63 V 8.39 4.59 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 0.80 0.00 0.00 0.81 0.00 0.00 64 A 8.41 4.21 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 65 C 8.89 4.73 0.00 3.12 2.98 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 66 K 8.83 3.69 0.00 1.89 1.90 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.18 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.53 7.81 67 N 8.05 4.52 0.00 2.79 2.91 0.00 0.00 6.19 7.00 0.00 0.00 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 8.19 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 69 Q 8.52 4.30 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 70 T 8.20 4.72 4.17 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 0.00 0.00 0.00 1.17 0.00 0.00 71 N 8.10 5.01 0.00 3.07 3.14 0.00 0.00 6.06 7.68 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 72 C 7.58 5.27 0.00 2.99 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 73 Y 8.85 5.08 0.00 2.80 2.86 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 74 Q 9.14 5.01 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 75 S 8.85 4.50 0.00 3.91 3.87 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 76 Y 9.19 4.52 0.00 3.00 2.96 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 77 S 7.86 4.81 0.00 3.91 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 78 T 8.04 4.14 4.27 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 1.02 0.00 0.00 79 M 9.03 5.04 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 80 S 9.47 4.84 0.00 3.90 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 81 I 9.10 5.10 1.94 0.00 0.00 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 1.39 0.66 1.05 0.00 0.00 82 T 8.84 5.00 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 1.23 0.00 0.00 83 D 9.21 4.88 0.00 2.61 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.22 5.50 0.00 2.92 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 85 R 8.77 5.24 0.00 1.95 1.79 0.00 3.14 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 86 E 9.33 4.01 0.00 1.91 1.76 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 2.12 1.89 0.00 87 T 8.61 4.19 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 88 G 8.58 3.62 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 0.00 0.00 0.00 89 S 7.29 4.48 0.00 3.98 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 90 S 7.37 4.11 0.00 3.76 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 91 K 8.31 4.48 0.00 1.76 1.58 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.45 7.81 92 Y 8.80 4.43 0.00 2.93 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 93 P 0.00 3.17 0.00 1.80 1.30 0.00 3.65 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.74 0.00 94 N 7.49 4.67 0.00 2.80 2.78 0.00 0.00 6.95 7.73 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 95 C 7.92 4.36 0.00 3.14 3.09 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 96 A 8.62 5.11 1.13 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 0.00 0.00 97 Y 9.29 5.05 0.00 2.98 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 98 K 9.02 4.53 0.00 1.73 1.77 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.58 7.81 99 T 8.57 4.99 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 1.30 0.00 0.00 100 T 8.76 4.60 4.27 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 1.23 0.00 0.00 101 Q 8.82 4.79 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 102 A 8.86 4.61 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 0.00 103 N 8.71 5.34 0.00 2.70 2.72 0.00 0.00 6.76 6.68 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 0.00 104 K 8.83 4.81 0.00 1.77 1.85 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.44 7.81 105 H 9.09 4.78 0.00 3.18 3.35 0.00 5.59 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.63 4.81 1.81 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 1.28 1.28 1.14 0.00 0.00 107 I 8.27 4.92 1.67 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 1.15 0.70 0.85 0.00 0.00 108 V 8.65 4.83 1.92 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 0.75 0.00 0.00 0.80 0.00 0.00 109 A 8.72 4.88 1.23 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 0.00 110 C 8.59 5.11 0.00 2.16 1.65 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 0.00 111 E 8.74 4.69 0.00 1.97 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 2.23 2.31 0.00 112 G 9.48 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 0.00 113 N 8.16 4.96 0.00 2.66 2.71 0.00 0.00 6.91 7.69 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 0.00 114 P 0.00 4.32 0.00 2.22 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.25 5.05 0.00 2.84 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 0.00 116 V 7.91 4.43 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 0.71 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.50 0.00 0.49 1.00 0.00 3.30 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 118 V 8.66 4.48 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 0.64 0.00 0.00 0.93 0.00 0.00 119 H 7.85 4.93 0.00 3.28 3.14 0.00 5.85 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 0.00 120 F 8.69 4.72 0.00 2.66 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 D 8.61 4.62 0.00 2.60 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 A 6.53 4.58 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.93 5.21 0.00 4.06 4.10 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 0.00 124 V 8.77 4.15 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 0.73 0.00 0.00 0.93 0.00 0.00