NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2724 8.3149 120.1296 55.8484 34.3301 175.6400 4 I 3.9196 7.5591 120.5263 60.6082 37.8425 173.9645 5 I 4.0999 9.2400 129.2428 60.8145 39.1885 174.2206 6 H 5.0515 8.6586 124.0315 54.4265 29.7044 174.8743 7 L 4.6928 8.5991 124.3628 53.9778 43.1955 175.9713 8 T 5.0339 8.3473 108.2221 58.0989 72.1296 174.7765 9 D 4.5123 9.0677 123.0586 57.2520 40.8714 178.8433 10 D 4.5725 8.1533 116.9356 56.1901 41.2291 177.6550 11 S 4.6032 7.9489 113.1691 58.3073 63.5109 175.7097 12 F 3.8362 7.8939 125.4483 61.5859 39.0612 175.8600 13 D 4.4800 8.4645 117.3210 58.0415 40.6855 178.6078 14 T 3.9469 7.7452 107.8041 64.7372 69.1967 176.0125 15 D 4.3761 8.1613 120.9912 55.9173 40.8293 176.9404 16 V 3.8317 7.2090 115.3683 64.3627 32.9182 176.9121 17 L 4.1461 7.4105 117.7257 56.8683 41.8523 177.9137 18 K 4.3161 7.5192 117.9576 56.1137 32.7727 176.4972 19 A 4.2650 8.0120 120.1259 52.1827 19.7524 178.5916 20 D 4.1612 8.0065 108.0337 54.5524 37.3833 173.2006 21 G 4.2865 7.7062 113.5104 43.7253 0.0000 169.5443 22 A 4.5049 7.9032 122.5627 51.7040 19.8090 176.6321 23 I 4.8670 9.1946 123.2790 59.3732 41.1407 174.2904 24 L 4.8532 9.1610 130.1880 53.7593 43.2887 175.0709 25 V 4.6678 9.0490 127.8041 61.5502 33.8320 174.1989 26 D 5.2988 8.9329 126.9687 52.5650 43.7605 174.4425 27 F 5.1018 9.3987 126.7837 56.6133 40.3764 175.3285 28 W 5.5831 8.9076 120.0421 55.0560 32.6964 173.6012 29 A 4.0350 8.1571 119.3775 50.0535 21.1572 177.1986 30 E 4.0588 8.5354 122.6510 58.5689 29.8468 177.5301 31 W 4.8159 7.0533 113.6734 56.2235 28.5702 175.2668 32 C 4.9549 7.6651 119.6760 57.8505 32.8412 174.0664 33 G 3.7013 8.8008 115.4445 47.6971 0.0000 173.2471 34 P 4.4079 0.0000 0.0000 65.1965 31.3973 178.4034 35 C 4.0785 8.0579 114.8444 62.8724 27.9925 176.0135 36 K 4.0143 7.5952 119.0877 59.0198 31.7233 178.5336 37 M 4.1672 7.6195 118.7082 58.5139 32.3301 177.9437 38 I 3.9052 7.6533 116.8425 62.3176 38.1796 177.0512 39 A 3.7944 7.5754 121.6987 55.2745 17.9168 177.7031 40 P 4.4800 0.0000 0.0000 65.0987 31.6875 178.4463 41 I 3.7919 7.7040 118.0125 64.6447 37.0108 177.9343 42 L 3.9199 7.9495 119.3965 58.1677 41.3332 179.3541 43 D 4.3250 7.8015 118.4244 57.5964 40.7915 178.9528 44 E 3.9935 8.1779 118.7963 59.4079 29.4123 179.4822 45 I 3.7793 7.7153 119.1343 64.4341 37.0373 178.2037 46 A 4.0401 8.0005 120.5382 55.1835 18.2215 178.8789 47 D 4.4166 7.6933 115.9884 57.0402 41.3332 177.8544 48 E 4.2836 8.0821 118.4307 58.8214 30.0485 177.3745 49 Y 4.3746 8.4491 115.7270 56.7794 38.0803 174.8980 50 Q 4.1294 7.6963 121.5521 58.0843 29.5598 174.7079 51 G 4.2731 9.4160 117.0751 46.4077 0.0000 175.1644 52 K 4.2795 7.6588 118.9265 55.7785 32.4381 177.7673 53 L 4.7872 8.2177 117.4903 54.5563 45.8351 174.9679 54 T 4.6361 8.3511 118.7155 61.7423 72.0146 173.1004 55 V 4.7734 8.3836 125.7748 61.3842 33.8641 174.2586 56 A 5.1987 9.0680 128.3738 50.2366 22.8915 174.8755 57 K 5.0510 9.0395 120.5264 54.5419 35.8764 175.4535 58 L 4.8893 8.9118 124.8707 53.1097 45.2478 175.0296 59 N 3.7121 8.6402 126.7866 52.9574 39.3325 175.2643 60 I 3.9831 8.2416 120.6874 62.6583 37.5078 176.8208 61 D 4.5876 8.3825 123.0217 56.3545 41.2702 177.5867 62 Q 4.2777 7.9526 116.1772 57.1329 29.7170 175.7063 63 N 5.1336 7.7309 114.8567 50.8074 38.8151 173.1296 64 P 4.4519 0.0000 0.0000 64.4093 32.2581 178.4681 65 G 3.8193 8.0094 106.6431 46.7451 0.0000 174.7616 66 T 4.0837 7.8998 116.3773 65.5289 69.7643 176.5966 67 A 3.8727 8.2569 123.8259 54.8461 18.7122 177.5635 68 P 4.2117 0.0000 0.0000 65.7017 31.4688 178.7886 69 K 3.8346 7.6446 115.9876 58.6472 31.8972 177.1640 70 Y 4.4337 7.6971 114.4439 56.7242 38.8553 175.5697 71 G 3.8475 7.8740 107.4278 46.5224 0.0000 175.0459 72 I 3.7576 7.4905 118.2233 61.2599 37.9477 176.6937 73 R 4.5612 8.4555 122.9979 55.8832 31.8090 174.9651 74 G 4.2993 7.6001 103.9486 44.9000 0.0000 172.1780 75 I 4.8166 7.9181 113.0592 57.7575 40.9555 173.1978 76 P 4.7734 0.0000 0.0000 63.2602 32.7843 174.8607 77 T 4.9733 8.6395 119.6628 61.7933 71.4505 173.1794 78 L 5.3041 9.0187 126.1985 53.0326 44.5159 175.2825 79 L 5.1359 9.1312 124.3807 52.7715 44.8916 175.2605 80 L 4.9840 8.9257 126.9183 53.9213 43.4881 175.0370 81 F 5.1150 9.6645 126.4074 56.1730 41.2541 175.7760 82 K 4.6639 9.2129 124.5627 56.1545 34.7242 175.0710 83 N 4.8263 9.1270 127.7213 54.8686 36.5697 175.0263 84 G 4.1389 8.9116 101.7665 45.4822 0.0000 173.7445 85 E 4.8102 7.6574 116.9801 53.8690 32.2524 175.5374 86 V 3.4943 8.3038 120.6167 62.4958 31.0109 175.3233 87 A 4.2726 8.4429 131.3862 53.3202 18.0231 176.8728 88 A 4.9390 7.6842 113.5161 50.1808 23.3149 173.9941 89 T 5.1342 8.3259 112.1352 60.8178 70.9916 173.0662 90 K 4.3768 8.8022 126.8823 55.3439 36.1173 174.2523 91 V 4.6768 8.2922 127.1257 61.8244 33.5639 174.4536 92 G 4.1389 8.4458 113.8667 43.9075 0.0000 174.9103 93 A 4.2561 8.1880 124.6623 50.8696 16.2497 177.3148 94 L 4.2696 7.7447 122.1304 54.4482 42.8915 177.3452 95 S 4.7461 8.2349 114.5893 56.6686 65.7882 174.8697 96 K 3.8601 8.6668 123.0601 59.8212 31.7132 179.0849 97 G 3.5885 7.9533 105.1662 47.9380 0.0000 175.5493 98 Q 4.0588 8.1519 121.2971 58.5855 28.7270 179.0723 99 L 4.0344 8.2885 121.5490 57.9276 42.0159 178.7508 100 K 3.9744 7.7992 118.6720 59.7028 32.0717 178.6474 101 E 4.0326 8.2616 118.6627 59.2015 28.8851 178.8660 102 F 4.2828 8.2349 120.6864 61.6559 39.4264 176.9441 103 L 3.6926 8.1111 118.5569 57.4377 41.2388 178.7868 104 D 4.5061 7.9315 118.4125 57.9838 41.0270 179.2258 105 A 4.1352 7.9078 119.7445 54.0899 18.4960 178.3182 106 N 4.6697 7.1898 111.2375 53.2295 39.6696 175.5217 107 L 4.2792 8.2007 126.0797 54.9213 41.9899 176.2931 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 3 K 8.31 4.27 0.00 1.75 1.92 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.46 7.81 4 I 7.56 3.92 1.76 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.52 0.75 0.00 0.00 5 I 9.24 4.10 1.79 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 1.18 0.69 0.85 0.00 0.00 6 H 8.66 5.05 0.00 3.07 3.30 0.00 5.69 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.60 4.69 0.00 1.60 1.70 0.79 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.35 5.03 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 1.24 0.00 0.00 9 D 9.07 4.51 0.00 2.68 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 10 D 8.15 4.57 0.00 2.67 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 11 S 7.95 4.60 0.00 4.21 4.11 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 12 F 7.89 3.84 0.00 3.32 3.17 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 13 D 8.46 4.48 0.00 2.85 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 14 T 7.75 3.95 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 1.21 0.00 0.00 15 D 8.16 4.38 0.00 2.77 2.58 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 0.00 0.00 0.00 0.00 16 V 7.21 3.83 0.88 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 -0.35 0.00 0.00 0.05 0.00 0.00 17 L 7.41 4.15 0.00 1.98 1.76 1.16 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.52 4.32 0.00 1.62 1.75 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.39 0.00 0.00 0.00 0.00 1.36 1.49 7.81 19 A 8.01 4.26 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 20 D 8.01 4.16 0.00 2.73 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 21 G 7.71 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.90 4.50 1.25 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 0.00 0.00 23 I 9.19 4.87 1.88 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.17 0.84 0.00 0.00 24 L 9.16 4.85 0.00 1.71 1.54 1.11 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 25 V 9.05 4.67 2.34 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 0.52 0.00 0.00 0.84 0.00 0.00 26 D 8.93 5.30 0.00 2.78 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 0.00 0.00 0.00 0.00 27 F 9.40 5.10 0.00 3.13 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 28 W 8.91 5.58 0.00 3.41 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 29 A 8.16 4.04 -0.11 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 30 E 8.54 4.06 0.00 1.92 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 2.39 2.48 0.00 31 W 7.05 4.82 0.00 3.56 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 32 C 7.67 4.95 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 33 G 8.80 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 34 P 0.00 4.41 0.00 2.19 2.14 0.00 3.66 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 2.15 2.22 0.00 35 C 8.06 4.08 0.00 3.20 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 36 K 7.60 4.01 0.00 1.73 1.95 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 37 M 7.62 4.17 0.00 2.04 2.22 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 2.64 2.54 0.00 38 I 7.65 3.91 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.32 0.88 0.00 0.00 39 A 7.58 3.79 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 40 P 0.00 4.48 0.00 1.99 2.09 0.00 3.79 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 1.99 1.98 0.00 41 I 7.70 3.79 1.97 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 1.82 0.84 0.92 0.00 0.00 42 L 7.95 3.92 0.00 1.74 1.65 0.84 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 43 D 7.80 4.32 0.00 2.77 2.69 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 44 E 8.18 3.99 0.00 2.14 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 2.32 2.54 0.00 45 I 7.72 3.78 1.92 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 1.70 0.87 0.62 0.00 0.00 46 A 8.00 4.04 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 47 D 7.69 4.42 0.00 2.75 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 48 E 8.08 4.28 0.00 2.25 1.98 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 2.35 2.67 0.00 49 Y 8.45 4.37 0.00 3.10 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 50 Q 7.70 4.13 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.51 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 51 G 9.42 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 0.00 0.00 0.00 0.00 52 K 7.66 4.28 0.00 1.79 1.73 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.71 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.32 0.98 7.81 53 L 8.22 4.79 0.00 1.64 1.65 nan 0.64 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 54 T 8.35 4.64 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 1.16 0.00 0.00 55 V 8.38 4.77 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 0.91 0.00 0.00 0.88 0.00 0.00 56 A 9.07 5.20 1.08 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 0.00 0.00 0.00 0.00 0.00 0.00 57 K 9.04 5.05 0.00 1.82 1.98 0.00 0.86 0.00 0.00 1.23 0.00 0.00 2.69 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.24 7.81 58 L 8.91 4.89 0.00 1.57 1.09 0.97 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.64 3.71 0.00 2.23 2.39 0.00 0.00 6.90 7.40 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 60 I 8.24 3.98 1.89 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 1.26 0.65 1.10 0.00 0.00 61 D 8.38 4.59 0.00 2.74 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 62 Q 7.95 4.28 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.31 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 63 N 7.73 5.13 0.00 2.77 3.00 0.00 0.00 6.58 8.74 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 64 P 0.00 4.45 0.00 2.18 2.18 0.00 3.86 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 65 G 8.01 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 66 T 7.90 4.08 4.19 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 0.39 0.00 0.00 67 A 8.26 3.87 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 68 P 0.00 4.21 0.00 2.14 2.09 0.00 3.47 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.10 0.00 69 K 7.64 3.83 0.00 1.42 1.38 0.00 1.52 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.33 1.29 7.81 70 Y 7.70 4.43 0.00 2.82 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 71 G 7.87 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 0.00 0.00 0.00 72 I 7.49 3.76 1.77 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.41 0.89 0.00 0.00 73 R 8.46 4.56 0.00 1.70 1.87 0.00 3.44 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 74 G 7.60 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 0.00 0.00 0.00 0.00 75 I 7.92 4.82 1.89 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 1.51 0.76 0.94 0.00 0.00 76 P 0.00 4.77 0.00 2.18 2.27 0.00 3.67 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 77 T 8.64 4.97 4.33 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 1.22 0.00 0.00 78 L 9.02 5.30 0.00 1.58 1.60 0.86 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 79 L 9.13 5.14 0.00 1.90 1.30 0.97 0.41 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 80 L 8.93 4.98 0.00 1.77 1.49 0.63 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.66 5.11 0.00 3.09 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 82 K 9.21 4.66 0.00 1.83 1.65 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.45 7.81 83 N 9.13 4.83 0.00 2.92 2.99 0.00 0.00 7.25 7.98 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 84 G 8.91 4.14 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 0.00 0.00 0.00 85 E 7.66 4.81 0.00 2.09 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 2.42 2.21 0.00 86 V 8.30 3.49 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 0.56 0.00 0.00 0.49 0.00 0.00 87 A 8.44 4.27 1.21 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 0.00 0.00 0.00 88 A 7.68 4.94 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 89 T 8.33 5.13 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 90 K 8.80 4.38 0.00 1.16 1.08 0.00 1.37 0.00 0.00 1.41 0.00 0.00 2.56 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.85 1.17 7.81 91 V 8.29 4.68 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 0.89 0.00 0.00 0.91 0.00 0.00 92 G 8.45 4.14 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 0.00 0.00 0.00 93 A 8.19 4.26 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 94 L 7.74 4.27 0.00 1.60 1.60 0.70 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.23 4.75 0.00 4.05 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 96 K 8.67 3.86 0.00 1.88 1.88 0.00 1.62 0.00 0.00 1.96 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.62 7.81 97 G 7.95 3.59 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 0.00 0.00 0.00 98 Q 8.15 4.06 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 99 L 8.29 4.03 0.00 1.89 1.65 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 100 K 7.80 3.97 0.00 2.18 2.01 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.71 7.81 101 E 8.26 4.03 0.00 2.32 2.04 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 2.37 2.49 0.00 102 F 8.23 4.28 0.00 3.08 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 0.00 103 L 8.11 3.69 0.00 1.62 1.48 0.22 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 104 D 7.93 4.51 0.00 2.69 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 0.00 105 A 7.91 4.14 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 0.00 106 N 7.19 4.67 0.00 2.35 2.59 0.00 0.00 7.04 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 0.00 107 L 8.20 4.28 0.00 1.75 1.59 0.87 0.99 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