NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.3326 8.0249 118.5571 60.0492 37.2504 174.1294 2 Q 4.3325 9.0057 122.5615 55.5426 31.9762 173.9846 3 R 4.7553 8.4402 116.4791 54.4637 34.7969 174.3387 4 T 4.8177 8.9175 118.6932 59.9646 68.3946 172.4008 5 P 4.6788 0.0000 0.0000 63.0686 32.2002 175.1445 6 K 4.6126 9.5558 124.8905 54.9012 34.1661 174.7568 7 I 5.0464 8.4394 127.5019 59.6744 40.0888 174.9613 8 Q 4.7179 9.1142 124.5648 54.2384 32.8211 174.1056 9 V 5.0772 8.7536 123.8687 61.3442 33.9718 173.9134 10 Y 5.3572 8.6454 124.7144 56.3889 41.7279 173.3218 11 S 5.1605 8.8424 114.3239 56.6077 65.2248 174.2227 12 R 4.1100 8.7514 122.8971 59.6218 30.0616 176.2803 13 H 5.2843 8.4673 113.8857 52.6408 31.8108 172.6430 14 P 4.2860 0.0000 0.0000 63.1098 31.3605 175.9660 15 A 4.2786 8.7403 125.3255 52.0891 19.0611 176.5218 16 E 4.6327 8.5801 121.8460 54.0977 32.6737 175.0891 17 N 4.7024 8.8601 121.7689 55.1460 38.9689 175.4302 18 G 3.9241 9.1173 112.1791 44.7812 0.0000 172.9979 19 K 4.3606 7.5782 121.0531 54.1084 33.4117 175.7402 20 S 4.1542 8.3687 121.1670 59.3417 63.1959 172.5084 21 N 4.9385 8.6090 123.4454 53.0312 43.0612 172.1329 22 F 5.3329 8.9002 116.6896 55.6396 42.8363 174.1105 23 L 4.1713 8.9190 125.9706 53.5068 43.4741 174.6117 24 N 5.3479 8.6610 124.3542 51.4707 41.3623 172.8813 25 C 5.4340 9.5659 123.3918 54.8675 41.6541 171.7821 26 Y 5.4490 9.3844 127.5073 56.1922 41.0262 173.9973 27 V 4.9555 8.8025 128.4439 61.3283 33.7819 174.8276 28 S 5.3473 8.7234 121.3451 58.3932 66.9113 174.8878 29 G 4.0785 8.8997 105.9465 46.8338 0.0000 173.2377 30 F 5.2991 7.5716 114.3835 55.9127 41.0246 174.1794 31 H 5.2428 8.9065 117.8710 55.0868 33.7580 172.0849 32 P 5.1284 0.0000 0.0000 62.1384 33.1255 175.7091 33 S 3.6454 8.5214 112.7167 60.2310 63.2855 173.5774 34 D 4.3480 7.8775 120.9023 54.3887 40.8604 174.5318 35 I 4.6753 7.8245 125.4866 59.7269 41.6044 173.1136 36 E 4.5930 8.9192 126.7866 54.2717 32.5238 174.4948 37 V 4.6390 8.1113 125.9162 61.0412 34.3447 174.1576 38 D 4.7512 8.8883 127.0455 52.4134 45.0125 174.4698 39 L 4.8164 8.4295 122.6900 53.7620 43.5657 175.3951 40 L 5.1103 9.0685 124.3865 52.9468 44.5191 175.4760 41 K 4.3565 8.9921 124.1506 54.8045 34.7863 175.6361 42 N 3.8250 10.1100 125.4015 54.2426 36.5941 175.6930 43 G 3.9496 8.5482 105.3913 45.2137 0.0000 173.7808 44 E 4.6187 7.6352 119.6248 53.7888 31.6343 175.5321 45 R 4.2604 8.4559 122.9351 56.6654 30.5625 176.0088 46 I 4.1147 8.9824 127.9894 61.0849 37.8826 175.8904 47 E 4.2446 8.7398 124.5598 58.2969 30.6229 177.6129 48 K 4.3596 7.7960 118.6221 56.3936 31.3706 176.7496 49 V 4.5386 7.3174 111.6166 60.2864 34.6644 176.9647 50 E 4.5237 8.3637 124.6525 55.1115 31.9385 174.6694 51 H 5.0556 7.6904 115.9094 53.5921 31.6298 173.1662 52 S 4.5135 8.7097 115.2578 57.9996 64.1158 173.6358 53 D 4.4287 8.6079 120.9481 53.8253 41.0594 176.0806 54 L 3.8827 8.5356 124.9637 55.9197 42.5609 175.8762 55 S 4.7611 8.6244 119.6741 56.7321 66.5965 171.7825 56 F 5.3492 7.6090 114.4507 55.4219 41.1233 174.3872 57 S 4.8154 8.9930 115.4353 56.4907 65.1582 174.7334 58 K 3.6034 8.5170 120.5383 59.1936 31.8180 176.9598 59 D 4.5351 7.8923 115.9140 52.6037 39.4842 177.1286 60 W 3.6060 7.8260 118.5916 56.9450 27.9038 174.5691 61 S 4.3402 7.9836 114.2025 58.1477 64.1915 173.7072 62 F 5.0869 8.7233 121.0531 57.0356 40.7979 174.3672 63 Y 5.5691 8.5336 118.5752 55.8162 41.7996 173.8869 64 L 5.2610 9.6468 120.7194 53.2171 46.8241 174.8525 65 L 5.4496 9.0863 125.2886 53.8890 44.2533 174.4445 66 Y 5.1636 9.6292 124.8917 56.6582 40.5414 174.4638 67 Y 5.9482 8.5536 120.3098 56.1119 42.1221 173.6303 68 T 5.0740 8.3843 114.0942 60.3872 71.4076 172.2976 69 E 3.9045 8.7851 128.1053 56.2309 30.4262 175.6510 70 F 4.8012 9.0450 119.8375 56.2550 41.7985 173.0942 71 T 4.4144 8.2294 117.4196 60.9752 69.9248 172.4107 72 P 4.7562 0.0000 0.0000 62.8408 33.0170 175.8345 73 T 5.1596 8.3987 111.8033 59.7010 71.8951 173.0139 74 E 4.0997 8.9661 120.9373 59.0714 29.6308 177.8172 75 K 4.3948 7.8637 114.4057 56.2701 33.2214 175.9022 76 D 4.5799 7.9464 122.5150 54.5455 41.1046 176.0772 77 E 4.7280 8.9393 123.1276 55.5984 31.7925 171.2458 78 Y 5.3259 8.8178 120.4322 55.7123 42.0771 174.4661 79 A 5.1266 8.9394 123.5878 51.0923 24.0901 173.8329 80 C 5.2578 9.0662 118.2780 54.9628 45.9206 172.5426 81 R 5.1635 9.3210 126.9509 54.4867 32.4377 174.3537 82 V 4.7731 8.6730 126.1164 61.0739 34.5383 173.5227 83 N 5.2479 8.4812 126.3785 52.4049 41.7144 172.6705 84 H 4.8334 8.4482 121.3559 55.2357 32.6952 174.7234 85 V 3.6834 8.4800 123.8531 65.1029 31.0840 177.6486 86 T 4.1052 8.1753 109.4381 63.1125 69.2137 173.7655 87 L 4.6941 7.8477 123.1267 53.2786 42.9842 177.0431 88 S 4.3082 8.6561 119.2088 61.2929 63.1379 174.3172 89 Q 4.6069 7.5381 115.8973 53.1988 32.6940 172.3869 90 P 4.4942 0.0000 0.0000 63.2285 32.2361 175.6309 91 K 4.5247 9.1255 125.1113 54.8843 34.1532 174.7740 92 I 4.9313 8.3760 127.8709 59.5120 39.6095 174.9949 93 V 4.4040 8.4487 126.6174 60.9081 33.7655 175.1587 94 K 4.7138 8.7851 127.3104 55.9772 33.2675 176.3335 95 W 4.7344 9.3759 133.7422 56.8043 31.2334 175.1180 96 D 4.5547 8.4019 126.8469 52.5031 42.2329 176.1172 97 R 3.6284 7.9943 123.4010 56.4048 30.0706 176.4205 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 I 8.02 4.33 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 1.41 1.21 0.91 0.00 0.00 2 Q 9.01 4.33 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.64 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 3 R 8.44 4.76 0.00 1.94 2.01 0.00 3.16 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 4 T 8.92 4.82 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 1.25 0.00 0.00 5 P 0.00 4.68 0.00 2.00 1.74 0.00 3.74 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.75 0.00 6 K 9.56 4.61 0.00 1.88 1.84 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.59 7.81 7 I 8.44 5.05 1.91 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 1.32 0.80 0.96 0.00 0.00 8 Q 9.11 4.72 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 9 V 8.75 5.08 2.31 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 0.95 0.00 0.00 1.10 0.00 0.00 10 Y 8.65 5.36 0.00 3.25 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 11 S 8.84 5.16 0.00 4.03 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 12 R 8.75 4.11 0.00 1.87 2.25 0.00 3.16 0.00 0.00 3.02 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.24 0.00 13 H 8.47 5.28 0.00 3.24 3.20 0.00 5.73 0.00 0.00 0.00 0.00 6.67 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 4.29 0.00 2.23 2.15 0.00 3.89 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 2.05 2.04 0.00 15 A 8.74 4.28 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.58 4.63 0.00 1.98 1.82 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 2.30 2.48 0.00 17 N 8.86 4.70 0.00 2.73 2.81 0.00 0.00 7.35 7.65 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 18 G 9.12 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 0.00 0.00 0.00 19 K 7.58 4.36 0.00 1.67 1.79 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.72 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.30 7.81 20 S 8.37 4.15 0.00 3.81 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 21 N 8.61 4.94 0.00 2.49 2.22 0.00 0.00 6.85 7.87 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 22 F 8.90 5.33 0.00 2.94 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 23 L 8.92 4.17 0.00 0.27 0.65 -0.07 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.66 5.35 0.00 1.44 2.10 0.00 0.00 5.96 7.39 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 25 C 9.57 5.43 0.00 2.91 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 26 Y 9.38 5.45 0.00 3.40 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 27 V 8.80 4.96 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 0.59 0.00 0.00 0.91 0.00 0.00 28 S 8.72 5.35 0.00 3.89 3.35 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 29 G 8.90 4.08 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 0.00 30 F 7.57 5.30 0.00 3.00 3.16 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 31 H 8.91 5.24 0.00 3.28 3.22 0.00 5.58 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 5.13 0.00 2.16 2.19 0.00 3.94 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 33 S 8.52 3.65 0.00 3.22 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 34 D 7.88 4.35 0.00 2.62 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 35 I 7.82 4.68 1.60 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.75 0.82 0.00 0.00 36 E 8.92 4.59 0.00 1.97 1.63 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 2.11 2.16 0.00 37 V 8.11 4.64 0.73 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 0.40 0.00 0.00 0.70 0.00 0.00 38 D 8.89 4.75 0.00 2.45 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 39 L 8.43 4.82 0.00 1.59 1.55 0.90 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.07 5.11 0.00 1.54 1.54 0.91 0.43 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 41 K 8.99 4.36 0.00 1.78 1.61 0.00 1.95 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.13 0.82 7.81 42 N 10.11 3.82 0.00 2.78 2.82 0.00 0.00 7.24 7.80 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 43 G 8.55 3.95 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 0.00 0.00 0.00 44 E 7.64 4.62 0.00 1.98 1.82 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 2.21 2.34 0.00 45 R 8.46 4.26 0.00 1.74 1.84 0.00 3.21 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 46 I 8.98 4.11 1.92 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.86 0.96 0.00 0.00 47 E 8.74 4.24 0.00 1.96 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 2.28 2.23 0.00 48 K 7.80 4.36 0.00 1.86 1.86 0.00 1.52 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.47 7.81 49 V 7.32 4.54 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 0.84 0.00 0.00 1.07 0.00 0.00 50 E 8.36 4.52 0.00 1.16 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 2.10 2.09 0.00 51 H 7.69 5.06 0.00 2.32 1.53 0.00 5.72 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.71 4.51 0.00 4.02 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 53 D 8.61 4.43 0.00 2.70 2.67 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 54 L 8.54 3.88 0.00 1.67 1.65 0.67 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.62 4.76 0.00 3.68 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 56 F 7.61 5.35 0.00 2.89 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 57 S 8.99 4.82 0.00 4.05 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 58 K 8.52 3.60 0.00 1.64 1.79 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.24 1.29 7.81 59 D 7.89 4.54 0.00 2.84 2.72 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 60 W 7.83 3.61 0.00 3.27 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 61 S 7.98 4.34 0.00 3.87 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 62 F 8.72 5.09 0.00 1.51 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 0.00 0.00 0.00 0.00 63 Y 8.53 5.57 0.00 2.87 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 64 L 9.65 5.26 0.00 1.81 1.86 1.18 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 65 L 9.09 5.45 0.00 2.17 1.79 1.16 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.63 5.16 0.00 2.96 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 67 Y 8.55 5.95 0.00 3.05 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 68 T 8.38 5.07 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 1.06 0.00 0.00 69 E 8.79 3.90 0.00 1.75 1.66 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 1.98 1.48 0.00 70 F 9.04 4.80 0.00 2.82 2.70 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 71 T 8.23 4.41 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 1.16 0.00 0.00 72 P 0.00 4.76 0.00 2.33 2.19 0.00 3.43 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.68 0.00 73 T 8.40 5.16 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 1.26 0.00 0.00 74 E 8.97 4.10 0.00 1.96 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 2.31 2.41 0.00 75 K 7.86 4.39 0.00 1.79 1.83 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.39 7.81 76 D 7.95 4.58 0.00 2.86 2.49 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 77 E 8.94 4.73 0.00 1.67 1.81 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 2.19 2.15 0.00 78 Y 8.82 5.33 0.00 3.23 2.74 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 0.00 0.00 0.00 0.00 79 A 8.94 5.13 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 80 C 9.07 5.26 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 81 R 9.32 5.16 0.00 1.81 1.67 0.00 3.04 0.00 0.00 3.06 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.49 0.00 82 V 8.67 4.77 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 0.71 0.00 0.00 0.79 0.00 0.00 83 N 8.48 5.25 0.00 2.82 2.56 0.00 0.00 6.24 7.51 0.00 0.00 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 H 8.45 4.83 0.00 3.05 2.98 0.00 5.75 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.48 3.68 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 0.74 0.00 0.00 0.92 0.00 0.00 86 T 8.18 4.11 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 1.38 0.00 0.00 87 L 7.85 4.69 0.00 1.73 1.83 0.91 0.79 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 88 S 8.66 4.31 0.00 3.86 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 89 Q 7.54 4.61 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.90 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 90 P 0.00 4.49 0.00 1.90 1.96 0.00 3.63 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 91 K 9.13 4.52 0.00 1.81 1.63 0.00 1.48 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.44 7.81 92 I 8.38 4.93 1.88 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 1.22 0.75 0.93 0.00 0.00 93 V 8.45 4.40 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 1.07 0.00 0.00 0.97 0.00 0.00 94 K 8.79 4.71 0.00 1.74 1.80 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.50 1.48 7.81 95 W 9.38 4.73 0.00 3.26 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 96 D 8.40 4.55 0.00 2.59 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 97 R 7.99 3.63 0.00 1.67 1.64 0.00 2.55 0.00 0.00 3.05 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.40 0.00