NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -9 E 4.3886 8.6698 120.8651 56.2951 31.2923 175.9301 -8 N 5.1732 8.1550 122.6353 50.1148 37.6272 174.3906 -7 L 3.8198 8.6041 122.5406 59.2440 43.5145 178.2297 -6 Y 3.9037 8.0107 119.0383 60.5516 38.7689 177.7608 -5 F 4.1595 8.2032 122.3179 60.7957 39.6342 176.6714 -4 Q 3.6927 8.2975 119.2784 58.1970 28.6305 179.2236 -3 S 4.8061 7.9551 115.5106 59.5726 63.0522 175.3262 -2 N 4.4017 7.2367 118.3382 53.2994 40.0706 175.3905 -1 A 3.8655 7.0750 122.8825 52.5539 18.9347 177.8431 -8 M 4.9132 8.0350 123.5353 52.4148 31.6272 175.4906 -7 V 3.5998 8.4741 119.9406 66.3440 34.0145 176.9297 -6 Q 3.6937 8.2107 118.5383 58.3516 30.3689 177.8608 -5 I 3.7095 7.9032 121.9179 64.1957 38.8342 177.2714 -4 I 3.5227 7.9775 119.3784 63.5970 38.0305 179.6236 -3 F 4.9561 7.9451 120.1106 58.9726 38.8522 176.5262 -2 D 4.3017 7.1767 120.0382 54.3994 42.2706 176.4905 -1 S 4.0155 7.1450 114.7825 58.3539 63.6347 174.6431 9 K 4.1309 7.9171 126.4472 57.9449 33.5565 176.9579 10 T 4.2620 7.5561 104.9028 61.1142 68.9784 175.4143 11 G 4.2426 8.0221 110.4218 46.4145 0.0000 175.6391 12 N 4.4060 7.9107 118.8887 55.8269 38.5652 177.2126 13 V 3.7107 7.7191 119.1922 65.8590 31.8070 177.5469 14 Q 3.1846 7.9561 118.8146 59.1973 28.7056 178.4733 15 R 3.8906 7.8658 117.6363 59.0259 30.3197 178.5709 16 F 4.2779 8.3113 120.5053 61.5788 39.4758 177.7748 17 V 3.4485 7.8545 111.7574 63.9768 31.0510 177.5252 18 N 4.5552 7.5979 113.3528 54.0604 38.5173 176.1602 19 K 4.2610 7.6217 119.7615 55.7980 32.8280 176.1510 20 T 4.3108 7.1226 109.9219 60.2544 70.7556 174.5810 21 G 3.8468 7.8195 107.7272 45.0053 0.0000 173.9800 22 F 4.4619 7.2649 118.6355 57.8544 39.3451 175.3730 23 Q 4.2921 8.7564 122.7942 56.8523 29.5389 175.8032 24 Q 4.4958 7.8848 116.0666 54.4319 28.3423 173.8393 25 I 4.8865 8.0892 125.5677 60.1875 39.8761 174.7391 26 R 4.8810 8.5285 124.8123 54.1100 34.4253 174.9762 27 K 3.8114 8.2388 121.7584 55.3150 33.2516 178.1503 28 V 2.9281 7.8498 118.4884 63.6765 31.4628 176.7968 29 D 4.7410 7.7299 116.8711 53.1861 39.8033 176.3052 30 E 4.6826 7.8935 118.1616 55.7197 30.0110 175.4884 31 M 4.7286 7.7539 114.6451 55.1170 33.8664 173.8179 32 D 4.8938 8.2513 119.3306 52.9328 40.1924 175.4907 33 H 4.4428 6.9825 112.0249 55.2570 30.4070 173.4558 34 V 4.0805 7.9678 120.2768 61.2379 33.5658 174.6875 35 D 4.9373 8.8001 124.7013 52.9551 40.6944 175.4259 36 T 4.6808 7.5240 113.6388 59.2503 70.1785 171.3868 37 P 4.8236 0.0000 0.0000 63.4054 32.2885 175.1635 38 F 5.1299 8.5550 116.0532 55.9803 41.9494 172.7755 39 V 4.6498 8.5363 118.9529 61.0603 33.4750 174.1708 40 L 5.9571 8.6951 129.4944 53.6329 44.4633 175.0142 41 V 4.9122 8.5483 125.0218 61.6618 34.1986 173.9938 42 T 5.0647 8.8838 122.2154 60.9618 71.5623 170.2677 43 Y 5.2202 7.9080 119.6639 54.5856 41.1697 174.5544 44 T 4.4818 8.3366 113.7308 62.5287 72.7994 173.4735 45 T 4.7203 7.9574 120.1460 60.1175 71.1219 171.9979 46 N 3.6431 8.2472 117.0769 53.8853 38.6246 174.8012 47 F 4.0315 9.1170 121.9131 58.8347 36.5728 175.5152 48 G 3.8850 8.1952 103.0002 46.7137 0.0000 174.3853 49 Q 4.3363 7.5596 117.7157 54.2400 29.9993 175.4940 50 V 3.8737 7.9562 120.1950 61.5284 32.4995 174.8793 51 P 4.1148 0.0000 0.0000 62.6682 32.9561 177.1654 52 A 4.0047 8.5522 123.2733 55.4997 18.5284 180.4230 53 S 4.1029 8.0543 112.0872 61.8579 62.9242 176.7316 54 T 4.0208 7.6636 118.9403 66.3552 68.3281 176.7584 55 Q 4.0615 8.0824 120.1143 58.9714 27.2877 178.8886 56 S 4.0914 8.2975 116.2837 61.5133 62.9160 176.4078 57 F 4.0177 8.0936 122.7289 61.4795 39.1901 177.1615 58 L 3.9243 8.3517 118.9173 57.5402 41.2228 178.8997 59 E 4.2410 8.0853 115.3274 57.9693 29.5483 177.9953 60 K 4.1387 6.8161 118.4119 56.8658 33.8698 176.3049 61 Y 4.8466 7.0718 113.7597 57.3798 39.4088 177.1346 62 A 3.9957 8.1030 125.6901 54.6869 18.4681 180.2812 63 H 4.3019 8.3403 110.6379 57.8501 28.9506 176.1345 64 L 4.3924 7.6016 118.5446 54.0033 42.0130 175.6648 65 L 3.3688 7.1834 122.3183 54.7008 42.2780 176.4155 66 L 4.2131 8.2578 126.9015 56.5955 42.8559 176.7966 67 G 4.1709 7.1376 103.9938 45.8869 0.0000 172.5560 68 V 5.2788 8.4234 118.6925 59.7476 35.0551 174.5585 69 A 5.4150 9.3082 123.6930 50.3155 22.7615 174.8496 70 A 4.9140 8.5969 121.2177 50.1763 22.9578 175.0743 71 S 3.5885 8.6762 116.5571 56.8671 64.2861 173.3618 72 G 3.8392 8.4297 113.6573 45.7795 0.0000 171.1761 73 N 5.3177 8.9235 119.9820 52.5347 41.6477 176.2965 74 K 3.9639 9.3676 126.4390 58.3912 32.2822 179.2184 75 V 3.5365 8.2439 118.5956 65.3703 31.6551 176.5102 76 W 4.4262 9.1160 118.8305 55.9527 30.2868 177.6645 77 G 3.8622 8.1413 110.7992 46.5226 0.0000 177.7686 78 D 4.4432 9.1067 124.9044 56.4450 40.7743 176.3200 79 N 4.7500 8.3990 116.0117 52.6558 38.8711 174.3412 80 F 4.3516 8.5000 122.0337 59.7615 39.8037 174.4632 81 A 3.9263 8.1999 130.1090 51.0833 16.1758 178.0783 82 K 4.2658 7.7637 122.5323 59.7874 32.0928 177.8282 83 S 4.0522 7.8580 114.0411 61.5158 62.6819 176.1946 84 A 3.9265 7.7114 123.9988 55.0447 17.6908 179.3447 85 D 4.2729 7.9173 116.9194 57.7440 40.9225 178.9792 86 T 3.8969 7.9455 116.1363 66.7067 68.4766 176.8225 87 I 3.8389 7.9559 121.7986 64.3603 37.1471 178.1590 88 S 4.3209 8.2234 115.4928 60.8563 61.9675 176.3308 89 R 3.8189 7.7591 119.6116 59.3426 29.9532 177.7589 90 Q 3.9099 7.9086 118.0735 59.1125 29.1030 177.3271 91 Y 4.4984 8.0045 113.8509 56.4685 39.2207 175.5462 92 Q 3.5349 8.0331 117.8732 57.4652 26.6516 173.5980 93 V 4.5884 7.1572 109.4184 58.5535 36.1149 174.0681 94 P 4.4840 0.0000 0.0000 62.8661 32.9763 175.1454 95 I 4.5331 8.1653 122.2855 60.8235 37.2110 175.9112 96 L 4.3046 9.4593 129.0988 57.7040 42.3393 177.0271 97 H 4.7396 7.6971 115.1307 55.6921 33.2336 173.0821 98 K 5.0652 8.5657 121.9605 54.5471 35.1371 175.4532 99 F 5.1882 8.1293 118.7342 55.3971 42.3471 172.9437 100 E 5.0297 9.0946 118.3844 55.3468 31.0982 176.3727 101 L 3.4757 8.8765 124.9261 56.4698 41.7344 176.9522 102 S 4.6224 8.8753 124.7007 59.6902 62.9254 174.4550 103 G 4.2193 8.4903 106.8474 46.2894 0.0000 173.6108 104 T 4.5772 8.6514 111.0525 59.8328 72.3902 175.8363 105 S 4.1740 8.4277 115.1129 61.3189 62.8681 176.2977 106 K 4.0052 8.0404 123.0212 59.4668 31.9475 178.3927 107 D 4.4673 8.0495 118.8462 57.2699 40.6589 178.8924 108 V 3.5954 7.9035 118.7789 65.9509 31.6447 177.8676 109 E 3.9630 8.2756 118.2139 59.5193 29.3695 179.3839 110 L 4.0990 8.0456 118.8470 57.6747 41.6989 179.3091 111 F 4.3061 8.5461 120.9852 61.7527 39.3898 177.2978 112 T 3.8799 8.3206 109.5069 64.9431 68.5049 176.3769 113 Q 3.9410 8.1770 120.8764 58.7763 28.7251 178.4631 114 E 3.9942 8.2229 119.6990 59.0930 29.3916 179.5501 115 V 3.4933 7.6283 118.6111 65.8567 31.5693 177.7296 116 E 3.2426 7.8760 118.7987 58.8888 29.3049 179.0601 117 R 3.8029 7.7318 117.9955 59.3352 30.2018 179.2808 118 V 3.6003 7.8463 118.0366 65.8202 31.3975 178.2728 119 V 3.6291 8.0293 118.2596 66.2252 31.1876 178.1397 120 T 3.8461 7.7501 114.4777 66.5836 68.3690 176.2025 121 K 4.1510 8.0450 120.2940 58.4754 32.6217 178.0337 122 S 4.6879 8.5053 112.8959 58.3609 63.6124 175.7118 123 S 4.0834 8.3209 116.5224 61.0083 62.1930 175.0506 124 A 4.1516 7.9543 123.4293 55.3440 18.2298 179.1503 125 K 3.9798 7.9325 115.8398 59.8233 32.5739 176.1832 126 M 4.0954 8.3144 122.2141 56.1042 32.1105 175.7017 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 -9 E 8.67 4.39 0.00 2.18 1.91 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 2.25 2.19 0.00 -8 N 8.15 5.17 0.00 3.13 2.95 0.00 0.00 6.36 5.79 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 -7 L 8.60 3.82 0.00 1.82 1.79 0.79 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 -6 Y 8.01 3.90 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.20 4.16 0.00 3.18 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 -4 Q 8.30 3.69 0.00 1.86 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.61 0.00 0.00 0.00 0.00 0.00 1.59 2.31 0.00 -3 S 7.96 4.81 0.00 3.88 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 -2 N 7.24 4.40 0.00 2.27 2.55 0.00 0.00 6.93 6.73 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 -1 A 7.08 3.87 0.68 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 0.00 0.00 0.00 0.00 0.00 0.00 -8 M 8.03 4.91 0.00 2.41 2.21 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 2.54 2.55 0.00 -7 V 8.47 3.60 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 1.02 0.00 0.00 0.93 0.00 0.00 -6 Q 8.21 3.69 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.36 0.00 -5 I 7.90 3.71 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 1.65 2.02 0.91 0.00 0.00 -4 I 7.98 3.52 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 1.20 0.08 0.91 0.00 0.00 -3 F 7.95 4.96 0.00 3.13 3.11 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 -2 D 7.18 4.30 0.00 2.16 2.45 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 -1 S 7.15 4.02 0.00 2.96 3.43 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 9 K 7.92 4.13 0.00 1.29 1.16 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.18 1.29 7.81 10 T 7.56 4.26 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 1.11 0.00 0.00 11 G 8.02 4.24 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 0.00 12 N 7.91 4.41 0.00 2.72 3.05 0.00 0.00 7.25 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 13 V 7.72 3.71 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 1.22 0.00 0.00 1.02 0.00 0.00 14 Q 7.96 3.18 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.67 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 15 R 7.87 3.89 0.00 2.01 2.00 0.00 3.24 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 16 F 8.31 4.28 0.00 3.27 3.21 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 17 V 7.85 3.45 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 0.75 0.00 0.00 0.46 0.00 0.00 18 N 7.60 4.56 0.00 2.80 2.79 0.00 0.00 6.97 7.08 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 19 K 7.62 4.26 0.00 1.55 1.66 0.00 1.58 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.51 7.81 20 T 7.12 4.31 4.15 0.00 0.00 0.00 0.00 0.00 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 21 G 7.82 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 22 F 7.26 4.46 0.00 3.11 2.95 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 23 Q 8.76 4.29 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.12 0.00 0.00 0.00 0.00 0.00 2.34 2.28 0.00 24 Q 7.88 4.50 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 25 I 8.09 4.89 1.96 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.79 1.10 0.00 0.00 26 R 8.53 4.88 0.00 1.52 1.64 0.00 3.13 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 27 K 8.24 3.81 0.00 1.22 1.40 0.00 1.58 0.00 0.00 1.79 0.00 0.00 2.76 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.16 0.63 7.81 28 V 7.85 2.93 1.47 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 0.10 0.00 0.00 0.75 0.00 0.00 29 D 7.73 4.74 0.00 2.75 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 30 E 7.89 4.68 0.00 2.03 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 2.20 2.10 0.00 31 M 7.75 4.73 0.00 1.95 1.82 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 32 D 8.25 4.89 0.00 2.85 2.83 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 33 H 6.98 4.44 0.00 3.18 3.28 0.00 5.66 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 34 V 7.97 4.08 1.53 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 0.80 0.00 0.00 -0.04 0.00 0.00 35 D 8.80 4.94 0.00 2.78 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.52 4.68 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 1.25 0.00 0.00 37 P 0.00 4.82 0.00 1.98 1.95 0.00 3.76 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 2.04 2.11 0.00 38 F 8.56 5.13 0.00 3.27 3.11 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 39 V 8.54 4.65 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 1.02 0.00 0.00 0.88 0.00 0.00 40 L 8.70 5.96 0.00 2.20 1.64 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.55 4.91 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 0.92 0.00 0.00 1.01 0.00 0.00 42 T 8.88 5.06 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 1.12 0.00 0.00 43 Y 7.91 5.22 0.00 2.81 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 44 T 8.34 4.48 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 1.05 0.00 0.00 45 T 7.96 4.72 4.13 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 1.12 0.00 0.00 46 N 8.25 3.64 0.00 2.31 1.42 0.00 0.00 6.89 7.45 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 47 F 9.12 4.03 0.00 3.24 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 48 G 8.20 3.88 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 0.00 0.00 0.00 49 Q 7.56 4.34 0.00 2.20 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.96 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 50 V 7.96 3.87 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 0.74 0.00 0.00 0.90 0.00 0.00 51 P 0.00 4.11 0.00 1.76 1.45 0.00 3.29 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.09 0.00 52 A 8.55 4.00 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 53 S 8.05 4.10 0.00 4.07 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 0.00 54 T 7.66 4.02 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 1.22 0.00 0.00 55 Q 8.08 4.06 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.65 0.00 56 S 8.30 4.09 0.00 4.06 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 57 F 8.09 4.02 0.00 3.32 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 58 L 8.35 3.92 0.00 1.74 1.19 0.98 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.09 4.24 0.00 2.13 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 0.00 2.54 2.29 0.00 60 K 6.82 4.14 0.00 0.88 0.74 0.00 1.29 0.00 0.00 1.52 0.00 0.00 3.01 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.06 1.14 7.81 61 Y 7.07 4.85 0.00 2.46 2.65 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 62 A 8.10 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.34 4.30 0.00 3.31 3.46 0.00 5.51 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 7.60 4.39 0.00 1.92 1.81 0.94 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.18 3.37 0.00 1.26 1.51 0.76 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.26 4.21 0.00 1.53 1.64 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 67 G 7.14 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 0.00 0.00 0.00 0.00 68 V 8.42 5.28 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 0.86 0.00 0.00 0.98 0.00 0.00 69 A 9.31 5.42 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 70 A 8.60 4.91 0.95 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 71 S 8.68 3.59 0.00 3.11 3.43 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 72 G 8.43 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 73 N 8.92 5.32 0.00 2.81 3.04 0.00 0.00 6.94 6.75 0.00 0.00 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 K 9.37 3.96 0.00 1.79 1.66 0.00 1.57 0.00 0.00 1.28 0.00 0.00 2.39 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.37 0.39 7.81 75 V 8.24 3.54 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 0.33 0.00 0.00 0.97 0.00 0.00 76 W 9.12 4.43 0.00 3.78 3.18 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 0.00 77 G 8.14 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 0.00 0.00 0.00 78 D 9.11 4.44 0.00 2.75 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 79 N 8.40 4.75 0.00 3.22 2.96 0.00 0.00 6.44 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 80 F 8.50 4.35 0.00 3.03 3.13 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 81 A 8.20 3.93 0.27 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 82 K 7.76 4.27 0.00 1.90 1.95 0.00 1.82 0.00 0.00 1.80 0.00 0.00 3.18 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.40 1.29 7.81 83 S 7.86 4.05 0.00 3.94 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 84 A 7.71 3.93 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 85 D 7.92 4.27 0.00 2.82 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 86 T 7.95 3.90 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 1.20 0.00 0.00 87 I 7.96 3.84 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 1.54 0.78 1.07 0.00 0.00 88 S 8.22 4.32 0.00 3.99 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 89 R 7.76 3.82 0.00 1.85 1.91 0.00 3.31 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 90 Q 7.91 3.91 0.00 1.95 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.71 0.00 0.00 0.00 0.00 0.00 1.60 1.16 0.00 91 Y 8.00 4.50 0.00 3.11 2.97 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 92 Q 8.03 3.53 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.69 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 93 V 7.16 4.59 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 0.99 0.00 0.00 0.99 0.00 0.00 94 P 0.00 4.48 0.00 2.14 2.19 0.00 3.85 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 2.08 2.00 0.00 95 I 8.17 4.53 1.91 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 1.47 0.59 0.96 0.00 0.00 96 L 9.46 4.30 0.00 1.83 1.90 1.02 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.70 4.74 0.00 3.49 3.44 0.00 5.80 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 98 K 8.57 5.07 0.00 1.61 1.26 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.22 1.38 7.81 99 F 8.13 5.19 0.00 3.28 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 0.00 100 E 9.09 5.03 0.00 2.05 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 0.00 2.42 2.26 0.00 101 L 8.88 3.48 0.00 1.79 0.92 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.88 4.62 0.00 3.97 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 0.00 103 G 8.49 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 0.00 0.00 0.00 0.00 104 T 8.65 4.58 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 1.28 0.00 0.00 105 S 8.43 4.17 0.00 4.07 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 0.00 106 K 8.04 4.01 0.00 1.93 1.90 0.00 1.64 0.00 0.00 1.85 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.56 1.66 7.81 107 D 8.05 4.47 0.00 3.11 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.90 3.60 2.20 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 0.98 0.00 0.00 0.78 0.00 0.00 109 E 8.28 3.96 0.00 2.24 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 2.57 2.51 0.00 110 L 8.05 4.10 0.00 1.54 1.68 0.99 0.90 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 0.00 111 F 8.55 4.31 0.00 3.39 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 T 8.32 3.88 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 1.33 0.00 0.00 113 Q 8.18 3.94 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 114 E 8.22 3.99 0.00 2.21 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 2.49 2.70 0.00 115 V 7.63 3.49 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 1.04 0.00 0.00 0.23 0.00 0.00 116 E 7.88 3.24 0.00 1.16 1.68 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 0.00 1.85 1.47 0.00 117 R 7.73 3.80 0.00 2.03 1.92 0.00 3.21 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.82 0.00 118 V 7.85 3.60 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.98 0.00 0.00 119 V 8.03 3.63 2.29 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 1.22 0.00 0.00 1.09 0.00 0.00 120 T 7.75 3.85 4.34 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 1.19 0.00 0.00 121 K 8.05 4.15 0.00 1.81 1.82 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.47 7.81 122 S 8.51 4.69 0.00 3.88 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 0.00 123 S 8.32 4.08 0.00 3.96 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 0.00 124 A 7.95 4.15 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 0.00 125 K 7.93 3.98 0.00 1.77 1.97 0.00 1.82 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.50 7.81 126 M 8.31 4.10 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00