NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.6087 8.2227 120.3153 52.9443 41.1703 175.9036 3 L 3.7951 8.3682 119.5037 57.9370 41.9376 175.2908 4 E 4.0123 8.9925 119.3203 59.6734 29.8314 178.5722 5 D 4.3558 8.7110 119.0425 57.2663 40.7625 178.4203 6 N 4.3118 8.0420 116.5893 56.8668 38.5474 177.3548 7 M 4.1338 8.5400 120.2708 58.1637 31.9962 178.3796 8 E 3.9099 8.4839 119.6471 59.6715 29.7928 178.5668 9 T 3.8518 8.1713 116.0273 66.9578 68.6168 175.9016 10 L 3.9826 8.2059 120.5637 58.1043 41.8890 179.3157 11 N 4.3125 8.5091 116.8132 56.7807 38.9537 176.4694 12 D 4.3759 8.5860 120.5178 57.7556 41.0108 178.7976 13 N 4.4218 8.4747 116.9687 55.9818 38.5151 177.2285 14 L 3.9814 8.0459 122.0573 57.9582 42.1891 179.0685 15 K 3.9485 7.9071 119.2258 59.3048 31.9513 178.7226 16 V 3.5937 7.5823 117.5273 66.4877 31.5409 177.8597 17 I 3.8905 7.8680 119.1629 64.2493 36.6612 178.1938 18 E 3.9865 7.8742 118.4086 59.1534 29.4027 178.8948 19 K 4.2154 7.7120 115.7406 56.4643 32.8457 177.3758 20 A 4.2951 6.9584 122.0701 52.5118 18.9242 176.8483 21 D 4.6823 9.7484 121.0365 55.2585 42.3669 176.8359 22 N 5.1093 7.7512 114.7001 50.1605 42.0366 174.9864 23 A 4.0083 8.4232 121.1416 55.0183 18.4181 179.4304 24 A 3.9645 8.0673 118.9121 55.5481 18.4239 179.5246 25 Q 3.9339 8.7491 116.8136 59.1431 28.7791 179.6038 26 V 3.5450 7.3027 118.2962 65.7409 31.6705 177.6335 27 K 3.7846 8.4538 119.8806 59.8716 31.8340 177.7914 28 D 4.2302 8.2919 117.5581 57.2451 41.1435 177.6346 29 A 4.7875 7.8178 122.4896 54.8617 18.3226 179.4642 30 L 3.9236 8.3503 117.4637 58.3063 41.7611 179.7474 31 T 3.8375 8.3146 115.8529 66.7314 68.5807 176.2932 32 K 3.8463 8.1770 120.1734 60.1578 32.1246 179.1558 33 M 4.0618 8.2542 118.7449 58.2263 31.8912 178.4387 34 R 3.8426 8.1717 118.8497 59.5953 30.0837 177.8514 35 A 3.9557 7.8564 119.7548 55.5322 18.3640 179.5594 36 A 3.9618 7.9586 118.2331 54.9765 18.5557 179.3112 37 A 3.8919 8.3165 119.9026 55.7558 18.1835 180.0154 38 L 3.8722 7.6893 115.5776 57.5766 41.9632 178.9190 39 D 4.3490 8.2740 118.0857 57.4544 41.1318 178.2474 40 A 3.8671 8.2081 121.3498 54.9598 17.9736 179.1505 41 Q 3.4835 7.1392 117.0624 57.7999 29.0760 176.8679 42 K 4.4890 7.5633 115.6647 56.0722 33.7617 176.2911 43 A 4.1658 7.5744 122.9081 52.5582 18.8807 176.9902 44 T 4.3904 8.1182 117.3049 60.7562 70.1565 173.2041 45 P 4.3073 0.0000 0.0000 61.7719 32.4715 175.2783 46 P 4.1624 0.0000 0.0000 65.9443 31.2912 178.6562 47 K 4.1336 7.9932 114.5563 58.3282 32.2322 177.6237 48 L 4.5818 7.8787 118.1981 54.1378 42.2216 177.8490 49 E 3.8318 8.1224 121.7956 58.7269 29.5550 177.2439 50 D 4.6243 7.9212 115.5317 53.3450 40.2494 176.1913 51 K 4.4701 7.6842 120.3808 54.9071 33.7586 176.6131 52 S 4.3499 8.2678 116.6222 57.3977 63.7502 173.5723 53 P 4.4608 0.0000 0.0000 65.1630 31.2114 177.0439 54 D 4.5717 7.7823 117.0440 55.5548 41.4574 177.6850 55 S 4.3537 8.1987 115.4582 57.2468 64.9562 173.1169 56 P 4.2388 0.0000 0.0000 66.1660 31.0019 178.7804 57 E 4.0252 8.0870 116.3204 59.7148 29.5567 179.1344 58 M 3.9631 7.8266 118.3688 58.7289 31.9809 178.7211 59 C 4.2347 8.1472 116.8131 62.6241 28.1251 175.7345 60 D 4.3320 8.2296 119.8365 57.2781 40.9757 177.7328 61 F 4.0493 8.3871 121.3555 61.6300 39.3225 176.9931 62 A 4.2082 8.2466 119.5967 54.6913 18.3140 179.4172 63 A 4.0741 8.5559 120.1643 54.9279 18.2868 179.7842 64 G 3.4830 8.1122 104.8162 48.3581 0.0000 175.9488 65 F 4.1037 7.4212 119.4590 59.4246 38.8724 177.7072 66 A 3.9947 7.8938 120.6625 55.3515 18.2123 179.6840 67 I 3.6209 7.8412 118.1317 64.4123 37.1970 178.0573 68 L 3.8313 8.0237 121.2383 58.3351 41.8626 178.8100 69 V 3.6768 8.3506 118.3634 66.3400 31.3731 177.9212 70 G 3.8939 8.1073 104.9596 48.3615 0.0000 175.4900 71 Q 4.0001 7.9976 120.2380 58.4065 28.7066 178.3062 72 I 3.6947 7.7768 120.9774 64.7846 37.2160 177.8070 73 D 4.4115 8.5961 119.4870 57.7859 40.5722 178.7787 74 D 4.4381 8.3108 118.9046 57.2744 40.7032 178.9545 75 A 3.9734 8.0811 121.1914 54.9749 18.5285 179.2761 76 L 3.8818 8.5781 118.7432 58.0975 41.8124 179.5816 77 K 3.8481 8.4219 119.4683 59.8651 32.0702 178.7330 78 L 4.0183 7.7101 118.6964 57.6653 41.5550 179.3592 79 A 4.0599 8.4881 121.2269 55.0605 18.0192 179.4614 80 N 4.4079 7.9724 114.5999 56.2059 38.6860 176.6892 81 E 4.3437 7.8820 116.9058 56.2907 29.4789 177.8752 82 G 3.9086 7.7822 106.9472 46.2825 0.0000 175.7757 83 K 4.3038 7.7510 121.6218 54.4417 28.5884 177.2297 84 V 3.5687 7.6313 122.9822 66.3382 31.8948 177.2242 85 K 3.9677 7.9346 117.1964 59.6318 32.0857 179.1899 86 E 4.0371 8.1231 117.9238 58.8407 29.2810 179.0314 87 A 4.1663 7.7589 120.4491 54.5737 19.0798 179.2607 88 Q 3.9448 8.1190 116.4895 58.8973 28.5171 178.7210 89 A 3.9616 7.8033 120.6557 55.3276 18.7975 179.0557 90 A 4.0622 7.9544 118.7512 55.3330 18.2920 179.6812 91 A 3.9109 7.9971 119.0414 55.4189 18.4806 179.3495 92 E 3.8957 8.2625 117.0994 60.1781 29.4963 179.9587 93 Q 4.0111 8.0852 117.4972 58.5715 28.6893 178.5100 94 L 3.8809 7.6403 120.2015 58.1516 41.7329 179.5605 95 K 3.8224 7.9963 117.9595 59.9961 31.9239 179.1800 96 T 3.8309 7.7002 115.3481 67.1153 68.3112 176.6925 97 T 3.8073 7.8973 117.3851 66.6353 68.3993 176.3312 98 C 3.8959 8.0083 118.1292 62.9910 28.1092 175.6364 99 N 4.2594 8.0988 117.3128 56.5255 38.0944 176.9819 100 A 3.8317 7.9623 121.8641 55.7189 18.3667 179.2030 101 C 4.0706 7.7666 116.7114 62.4983 31.6724 175.4640 102 H 4.3203 8.2356 117.9799 58.9258 28.0714 177.2968 103 Q 3.9239 8.4963 119.2354 59.4529 28.6968 179.6537 104 K 3.8427 7.3554 117.6739 58.7013 32.1189 177.5892 105 Y 4.9533 7.8000 112.0359 57.1680 40.1172 175.4247 106 R 4.2248 8.1326 125.3831 56.4177 30.1155 175.6397 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 2 D 8.22 4.61 0.00 2.85 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 3 L 8.37 3.80 0.00 1.91 1.74 1.13 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.99 4.01 0.00 2.07 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 2.43 2.43 0.00 5 D 8.71 4.36 0.00 2.76 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 6 N 8.04 4.31 0.00 3.04 2.87 0.00 0.00 7.03 6.99 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 7 M 8.54 4.13 0.00 2.07 2.30 0.00 0.00 0.00 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.97 0.00 8 E 8.48 3.91 0.00 2.22 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 2.32 2.37 0.00 9 T 8.17 3.85 4.43 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 1.22 0.00 0.00 10 L 8.21 3.98 0.00 1.92 1.79 1.05 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.51 4.31 0.00 2.92 2.95 0.00 0.00 7.31 8.12 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 12 D 8.59 4.38 0.00 2.88 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 13 N 8.47 4.42 0.00 2.85 2.87 0.00 0.00 6.73 7.60 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 14 L 8.05 3.98 0.00 1.92 1.84 0.93 0.12 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 15 K 7.91 3.95 0.00 2.16 1.79 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.45 7.81 16 V 7.58 3.59 2.27 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 0.89 0.00 0.00 0.98 0.00 0.00 17 I 7.87 3.89 2.01 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 1.52 1.34 0.91 0.00 0.00 18 E 7.87 3.99 0.00 2.11 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 2.35 2.36 0.00 19 K 7.71 4.22 0.00 1.76 1.86 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.64 1.59 7.81 20 A 6.96 4.30 1.29 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 21 D 9.75 4.68 0.00 2.61 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 22 N 7.75 5.11 0.00 2.92 2.88 0.00 0.00 6.17 7.46 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 23 A 8.42 4.01 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 24 A 8.07 3.96 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 25 Q 8.75 3.93 0.00 2.38 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 26 V 7.30 3.54 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 0.94 0.00 0.00 0.98 0.00 0.00 27 K 8.45 3.78 0.00 1.93 1.94 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.48 7.81 28 D 8.29 4.23 0.00 2.89 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 29 A 7.82 4.79 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 30 L 8.35 3.92 0.00 1.89 1.74 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.31 3.84 4.43 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 1.21 0.00 0.00 32 K 8.18 3.85 0.00 2.01 1.89 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.65 7.81 33 M 8.25 4.06 0.00 2.06 2.32 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 2.75 2.56 0.00 34 R 8.17 3.84 0.00 1.98 2.14 0.00 3.12 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 35 A 7.86 3.96 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 36 A 7.96 3.96 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 37 A 8.32 3.89 1.46 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 0.00 0.00 38 L 7.69 3.87 0.00 1.76 1.68 0.90 0.87 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 39 D 8.27 4.35 0.00 2.85 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 40 A 8.21 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 7.14 3.48 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.66 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 42 K 7.56 4.49 0.00 1.87 1.82 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.55 1.31 7.81 43 A 7.57 4.17 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 44 T 8.12 4.39 4.18 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 1.09 0.00 0.00 45 P 0.00 4.31 0.00 1.92 1.62 0.00 3.23 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 1.47 0.44 0.00 46 P 0.00 4.16 0.00 2.19 2.16 0.00 3.58 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 2.13 2.15 0.00 47 K 7.99 4.13 0.00 1.91 1.93 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.58 7.81 48 L 7.88 4.58 0.00 1.45 1.42 0.43 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.12 3.83 0.00 2.15 1.95 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 2.29 2.20 0.00 50 D 7.92 4.62 0.00 2.81 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 51 K 7.68 4.47 0.00 1.81 1.74 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.39 1.47 7.81 52 S 8.27 4.35 0.00 3.99 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 53 P 0.00 4.46 0.00 2.06 2.17 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 54 D 7.78 4.57 0.00 2.68 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 55 S 8.20 4.35 0.00 4.13 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 56 P 0.00 4.24 0.00 2.21 2.20 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 57 E 8.09 4.03 0.00 2.02 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 2.54 2.62 0.00 58 M 7.83 3.96 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.63 0.00 59 C 8.15 4.23 0.00 3.01 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 60 D 8.23 4.33 0.00 3.07 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 61 F 8.39 4.05 0.00 2.76 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 62 A 8.25 4.21 1.45 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 0.00 0.00 0.00 63 A 8.56 4.07 1.41 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 0.00 0.00 64 G 8.11 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 0.00 0.00 0.00 65 F 7.42 4.10 0.00 3.19 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 66 A 7.89 3.99 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 67 I 7.84 3.62 1.96 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 1.39 0.64 0.88 0.00 0.00 68 L 8.02 3.83 0.00 1.76 1.89 0.90 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.35 3.68 2.25 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 0.81 0.00 0.00 0.98 0.00 0.00 70 G 8.11 3.89 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 0.00 0.00 0.00 71 Q 8.00 4.00 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.65 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 72 I 7.78 3.69 2.05 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 1.14 0.94 0.00 0.00 73 D 8.60 4.41 0.00 2.88 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 74 D 8.31 4.44 0.00 2.87 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 75 A 8.08 3.97 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 76 L 8.58 3.88 0.00 1.90 1.76 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.42 3.85 0.00 1.77 2.01 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.50 7.81 78 L 7.71 4.02 0.00 1.85 1.70 0.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.49 4.06 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 80 N 7.97 4.41 0.00 2.99 2.89 0.00 0.00 7.06 6.97 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 81 E 7.88 4.34 0.00 1.97 1.97 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 2.34 2.57 0.00 82 G 7.78 3.91 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 0.00 0.00 0.00 83 K 7.75 4.30 0.00 1.93 1.78 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.52 7.81 84 V 7.63 3.57 2.08 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 1.07 0.00 0.00 0.91 0.00 0.00 85 K 7.93 3.97 0.00 1.84 1.84 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.53 7.81 86 E 8.12 4.04 0.00 2.12 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 2.33 2.32 0.00 87 A 7.76 4.17 1.41 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 0.00 0.00 88 Q 8.12 3.94 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.48 2.66 0.00 89 A 7.80 3.96 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 90 A 7.95 4.06 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 91 A 8.00 3.91 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 92 E 8.26 3.90 0.00 2.22 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 2.34 2.53 0.00 93 Q 8.09 4.01 0.00 2.33 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.64 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 94 L 7.64 3.88 0.00 1.78 1.75 0.93 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 95 K 8.00 3.82 0.00 2.02 1.89 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.51 7.81 96 T 7.70 3.83 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 1.18 0.00 0.00 97 T 7.90 3.81 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 1.09 0.00 0.00 98 C 8.01 3.90 0.00 3.02 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 99 N 8.10 4.26 0.00 2.90 2.86 0.00 0.00 6.97 7.27 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 0.00 100 A 7.96 3.83 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 0.00 101 C 7.77 4.07 0.00 2.84 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 0.00 102 H 8.24 4.32 0.00 3.36 3.31 0.00 5.72 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 0.00 103 Q 8.50 3.92 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.98 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 104 K 7.36 3.84 0.00 0.79 0.74 0.00 1.35 0.00 0.00 1.52 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.18 1.39 7.81 105 Y 7.80 4.95 0.00 3.13 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 0.00 106 R 8.13 4.22 0.00 1.90 2.02 0.00 3.24 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00