NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3513 8.3001 120.3512 55.3951 33.4075 174.3546 2 A 4.7011 8.3759 126.5166 49.7479 21.6302 174.3033 3 D 4.8449 9.5806 120.0284 54.3691 44.6792 174.6170 4 I 4.9941 7.6216 118.3586 58.2816 39.0486 173.3382 5 T 4.2939 8.7011 122.7879 63.0637 69.5889 174.0658 6 L 4.3394 9.0001 127.5805 54.8010 43.5590 176.3828 7 I 4.4040 8.6315 122.5661 59.2101 38.0971 174.8508 8 S 4.4624 8.9283 122.4955 58.7620 64.5801 173.9460 9 G 5.0793 8.2629 108.6152 45.8447 0.0000 171.8680 10 S 5.0922 7.9549 118.6660 57.5618 66.0523 174.6225 11 T 4.2202 8.5083 110.9105 63.8779 69.6286 176.3364 12 L 4.0082 7.8569 121.2039 57.2360 41.9266 177.8305 13 G 4.0018 8.5105 104.4182 45.2517 0.0000 175.6259 14 G 3.6923 8.4620 106.8309 47.9763 0.0000 175.6488 15 A 4.1164 7.9794 122.8094 54.6666 18.2405 179.6579 16 E 3.8797 7.9885 116.9425 59.6176 29.5227 178.7936 17 Y 4.3238 8.1458 116.8664 61.3430 37.9393 179.0001 18 V 3.6532 8.0619 118.7810 65.8595 31.5551 177.8828 19 A 4.0319 8.4696 120.9712 55.1989 18.3041 179.1959 20 E 3.9245 8.5077 118.0864 59.6145 29.8398 178.4958 21 H 4.2691 8.5820 118.3620 59.3785 29.9429 177.1987 22 L 4.0292 8.3815 120.8970 57.8384 41.4230 179.3837 23 A 4.0326 8.4807 121.1015 55.0407 18.3015 179.2566 24 E 3.8801 8.3448 117.7643 59.5015 29.7251 179.2345 25 K 3.9734 7.9220 118.0204 59.4719 32.0053 179.3566 26 L 3.9291 8.2095 119.3806 57.8193 41.6309 179.4287 27 E 4.2359 8.3603 120.0265 58.9918 29.1599 179.2988 28 E 3.9868 8.1615 117.5851 59.1732 29.5830 178.9589 29 A 3.9743 7.8589 120.0463 53.1149 18.3748 178.1272 30 G 4.0797 7.2159 103.7464 45.1416 0.0000 173.3061 31 F 5.3183 8.4185 119.7906 55.8472 41.2277 175.5706 32 T 4.4461 8.6000 113.5261 61.9329 70.3233 173.4494 33 T 5.4368 8.2221 112.1463 59.9176 72.4672 171.9311 34 E 4.7730 8.5018 121.2899 54.6643 33.3684 173.9385 35 T 4.7218 8.1951 111.7683 59.8576 67.6827 174.3942 36 L 3.9173 8.0166 122.3438 56.0793 43.3424 178.3882 37 H 4.4494 9.0147 122.2723 56.2819 29.1852 175.9464 38 G 4.3163 8.7909 116.1425 44.5137 0.0000 170.6944 39 P 4.2800 0.0000 0.0000 62.4616 32.5599 175.5468 40 L 4.7191 7.7370 118.0899 52.4367 44.4792 177.5248 41 L 4.1891 8.7882 122.0011 58.4952 41.9985 178.5340 42 E 4.1994 8.2178 112.6605 57.6082 29.3851 176.2074 43 D 4.8359 8.1593 117.7574 53.6473 42.0185 174.7115 44 L 4.5878 7.9618 117.2164 51.6906 44.6513 174.9848 45 P 4.5302 0.0000 0.0000 62.5528 31.0627 176.5460 46 A 4.5712 8.5796 120.3261 52.7823 18.2500 177.1986 47 S 4.8322 7.7914 112.4386 55.6906 67.0462 174.5212 48 G 2.7539 6.9397 111.0696 44.6574 0.0000 170.9310 49 I 4.3720 6.3122 119.3730 59.2178 39.4134 175.6931 50 W 5.4787 8.6577 128.0327 54.8786 32.2501 175.6099 51 L 4.8142 8.2569 122.3277 54.3121 43.6790 174.0284 52 V 4.4689 9.0320 127.6337 62.3753 32.6905 174.7651 53 I 5.2094 8.7547 127.7529 59.7838 41.1984 174.5627 54 S 5.0486 8.8844 122.0322 56.6236 66.9487 174.2128 55 S 4.7687 8.7888 120.4948 59.1304 63.8355 173.9317 56 T 4.4722 8.5424 117.7967 61.9229 71.1643 174.4119 57 H 4.3567 8.6901 124.8439 56.5942 29.7373 175.3159 58 G 3.2442 7.9260 107.8109 45.4018 0.0000 175.2419 59 A 4.6419 7.8603 118.9200 51.5176 19.7988 176.7261 60 G 3.9081 8.3113 105.1588 45.4134 0.0000 173.6523 61 D 4.3674 7.7293 120.4641 53.8688 41.7013 175.4169 62 I 4.1062 8.1249 127.9370 60.0048 38.0509 174.1319 63 P 4.2472 0.0000 0.0000 62.8291 31.4964 176.9850 64 D 4.3987 8.5479 119.7714 56.3854 41.6350 176.6821 65 N 4.3834 8.4283 117.7462 56.0098 38.9846 175.5207 66 L 4.6651 8.1887 117.6167 54.5113 44.3125 177.9927 67 S 4.1873 8.2935 113.7442 61.4300 62.4347 174.5173 68 P 4.2982 0.0000 0.0000 65.2513 30.9220 178.1140 69 F 4.4743 8.5756 119.9426 61.3993 39.2509 176.4251 70 Y 4.0760 8.1237 119.1257 60.7093 38.5304 178.0795 71 E 3.6936 8.1615 118.7414 59.3095 29.8440 178.9341 72 A 3.9849 8.3622 121.2035 55.0764 18.3123 179.5824 73 L 3.8745 7.9550 117.8338 58.0446 41.5350 179.8131 74 Q 3.8938 7.5607 116.5783 59.0962 28.5763 177.7364 75 E 3.9866 8.1537 120.8332 58.4697 29.7105 177.7834 76 Q 4.2196 7.2378 115.4899 55.3309 31.4583 176.4142 77 K 3.9659 8.1041 120.0209 56.8205 30.4109 171.3028 78 P 4.4599 0.0000 0.0000 62.0412 32.6404 176.2127 79 D 4.6009 8.4815 118.8313 54.5261 41.3728 175.6124 80 L 4.8659 8.8485 126.7810 54.7847 42.6950 178.3389 81 S 4.7644 9.0225 110.4206 59.3477 62.0812 174.5173 82 A 4.6866 7.5975 120.6774 51.1206 20.9421 176.4275 83 V 3.7452 8.2242 118.0179 62.9162 32.7192 175.3217 84 R 4.9947 8.7131 127.1284 54.7261 32.9498 175.1133 85 F 5.4305 8.2349 115.2656 55.6308 41.9884 173.3843 86 G 4.4250 8.9332 106.3565 44.5851 0.0000 172.0858 87 A 5.4877 9.1629 120.7251 50.4363 22.8919 175.2409 88 I 4.8136 9.0159 122.6918 59.4908 41.4382 174.6860 89 G 4.4528 8.8510 113.5167 44.5684 0.0000 172.3727 90 I 4.8443 8.6407 122.7516 58.8005 41.6249 175.0474 91 G 4.1660 8.1408 112.2355 46.1288 0.0000 172.2829 92 S 4.7740 7.8877 115.5188 58.5506 62.0305 175.4574 93 R 4.1724 8.9988 126.6242 57.8833 30.0295 177.2799 94 E 4.2628 8.1780 115.5600 58.6560 29.8725 176.5408 95 Y 4.2325 7.7306 116.2137 57.5016 38.5291 175.7345 96 D 4.4822 8.9255 120.9432 56.8781 41.5514 176.5991 97 T 4.7766 7.5009 114.2628 62.1311 71.1406 174.8347 98 F 4.9418 8.4524 124.5824 58.4916 39.9221 173.3738 99 C 4.0345 7.8236 114.2764 60.8647 26.1387 174.8346 100 G 3.9108 7.9604 107.1112 46.2319 0.0000 176.5432 101 A 4.0138 7.8323 122.9431 55.2380 18.3383 179.3567 102 I 3.5794 7.7853 116.6288 64.2457 37.9004 177.1705 103 D 4.3959 7.8875 118.9668 57.3931 41.0446 178.6326 104 K 3.8222 7.6042 118.6355 59.1712 32.0411 179.4312 105 L 3.9446 7.6131 118.9695 57.7639 41.6647 179.2053 106 E 3.4793 8.2010 117.3695 59.2088 29.4342 178.9752 107 A 4.0521 8.2211 121.8057 55.0935 18.4050 179.4963 108 E 4.0845 8.1887 116.5301 59.0427 29.4782 179.5174 109 L 3.8748 7.5754 118.9472 57.5864 41.6553 179.3055 110 K 4.6033 8.3677 121.2213 59.2094 31.9549 178.2711 111 N 4.3534 8.4005 116.3941 56.8057 39.1311 176.5895 112 S 4.3493 8.3574 115.7563 59.1251 62.8512 174.9189 113 G 3.7070 8.0633 109.5473 45.2162 0.0000 173.8595 114 A 4.7932 8.2030 122.7452 52.1631 20.1491 176.3982 115 K 4.7638 8.4966 117.1689 54.4353 36.6002 176.6454 116 Q 3.2195 8.1472 124.2877 56.2671 29.9413 175.0309 117 T 4.5709 7.9493 117.8034 62.0468 72.1377 176.5520 118 G 3.5820 9.0986 111.2673 46.8344 0.0000 172.7291 119 E 4.8644 8.1566 122.6709 54.5327 33.6700 174.7175 120 T 4.6493 8.6031 117.0314 63.3116 69.2600 174.7110 121 L 3.0139 8.1596 129.0705 53.9454 43.4954 175.4130 122 K 4.8500 7.7729 123.3941 54.7563 35.0545 176.2951 123 I 4.3114 7.9027 123.6408 59.4989 40.3366 173.9126 124 N 5.0438 8.6189 127.0914 53.3030 39.9601 174.8391 125 I 4.9280 8.2848 117.0193 59.5602 38.6593 176.3479 126 L 4.0862 8.6731 125.0413 58.2752 42.3587 176.5576 127 D 4.6890 8.2122 114.3812 55.5583 42.7251 175.0856 128 H 4.8763 7.8608 114.5005 54.1266 31.7985 173.0824 129 D 4.9669 8.0866 116.5878 54.4129 41.1826 173.7802 130 I 3.0665 7.4208 114.2563 60.5483 39.4109 172.1124 131 P 4.4924 0.0000 0.0000 64.9891 31.7698 176.7238 132 E 4.6414 7.8760 114.0525 55.0666 32.9234 174.2712 133 D 4.8267 7.7209 117.3374 50.8737 41.3755 172.3170 134 P 4.2571 0.0000 0.0000 62.3773 32.3449 177.4658 135 A 4.0822 8.7231 123.1184 55.1265 18.1713 179.6077 136 E 3.9491 8.3000 117.7179 59.5920 29.6626 178.8417 137 E 3.9580 8.1368 118.3537 59.1974 29.6430 179.0776 138 W 3.8067 8.2257 127.9361 60.2869 30.7027 177.5089 139 L 4.4879 8.7065 120.9644 58.0513 41.5985 179.0450 140 G 3.7073 8.1855 105.7442 48.2370 0.0000 175.8534 141 S 4.1173 7.8029 117.4668 60.6165 62.5772 177.1038 142 W 4.3658 8.0033 121.7149 60.0860 29.0299 179.1205 143 V 3.8494 8.4350 112.6799 64.4405 30.7421 178.1110 144 N 4.4047 8.1473 115.8225 55.8283 38.7149 175.9505 145 L 4.4887 7.0919 119.5984 56.4950 42.9385 178.4474 146 L 3.8720 8.5249 118.5694 57.9423 40.5292 177.1213 147 K 4.6673 8.0036 123.1878 56.6047 32.3162 174.0069 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 M 8.30 4.35 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.58 0.00 2 A 8.38 4.70 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 3 D 9.58 4.84 0.00 2.64 2.66 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 4 I 7.62 4.99 1.98 0.00 0.00 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 1.31 2.32 0.99 0.00 0.00 5 T 8.70 4.29 3.76 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 0.90 0.00 0.00 6 L 9.00 4.34 0.00 1.81 1.59 1.06 0.72 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 7 I 8.63 4.40 1.93 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.88 0.69 0.00 0.00 8 S 8.93 4.46 0.00 3.79 3.71 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 9 G 8.26 5.08 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 10 S 7.95 5.09 0.00 3.81 3.77 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 11 T 8.51 4.22 4.23 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 1.18 0.00 0.00 12 L 7.86 4.01 0.00 1.67 1.78 0.92 0.98 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 13 G 8.51 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.46 3.69 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 0.00 0.00 0.00 15 A 7.98 4.12 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 16 E 7.99 3.88 0.00 2.04 1.90 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 2.15 2.27 0.00 17 Y 8.15 4.32 0.00 3.17 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 0.00 18 V 8.06 3.65 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 1.24 0.00 0.00 1.01 0.00 0.00 19 A 8.47 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.51 3.92 0.00 2.17 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 0.00 2.39 2.37 0.00 21 H 8.58 4.27 0.00 3.36 3.51 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 22 L 8.38 4.03 0.00 2.03 1.83 1.13 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 23 A 8.48 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.34 3.88 0.00 2.11 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 0.00 2.33 2.38 0.00 25 K 7.92 3.97 0.00 2.00 1.84 0.00 1.82 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.59 1.57 7.81 26 L 8.21 3.93 0.00 1.92 1.82 1.02 1.03 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 27 E 8.36 4.24 0.00 2.17 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 2.37 2.41 0.00 28 E 8.16 3.99 0.00 2.05 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 2.34 2.49 0.00 29 A 7.86 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 G 7.22 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 31 F 8.42 5.32 0.00 2.91 2.85 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 32 T 8.60 4.45 4.46 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 1.26 0.00 0.00 33 T 8.22 5.44 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 1.42 0.00 0.00 34 E 8.50 4.77 0.00 2.05 1.73 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 2.21 2.30 0.00 35 T 8.20 4.72 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 36 L 8.02 3.92 0.00 1.61 1.51 0.61 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 37 H 9.01 4.45 0.00 3.02 3.21 0.00 6.04 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.79 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 0.00 0.00 0.00 0.00 39 P 0.00 4.28 0.00 1.85 1.83 0.00 3.49 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 1.46 1.65 0.00 40 L 7.74 4.72 0.00 1.68 1.62 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.79 4.19 0.00 1.93 1.81 0.98 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.22 4.20 0.00 2.12 2.07 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 2.29 2.29 0.00 43 D 8.16 4.84 0.00 2.52 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 44 L 7.96 4.59 0.00 1.67 1.55 0.51 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.53 0.00 2.36 2.28 0.00 3.82 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 2.66 2.14 0.00 46 A 8.58 4.57 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 47 S 7.79 4.83 0.00 3.75 3.63 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 48 G 6.94 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 0.00 0.00 0.00 49 I 6.31 4.37 1.66 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.76 0.73 0.00 0.00 50 W 8.66 5.48 0.00 3.28 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 51 L 8.26 4.81 0.00 1.51 1.49 0.85 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 52 V 9.03 4.47 2.19 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 1.06 0.00 0.00 1.05 0.00 0.00 53 I 8.75 5.21 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.92 0.95 0.00 0.00 54 S 8.88 5.05 0.00 3.73 3.68 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 55 S 8.79 4.77 0.00 3.76 3.79 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 56 T 8.54 4.47 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 1.18 0.00 0.00 57 H 8.69 4.36 0.00 3.19 3.23 0.00 5.91 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 G 7.93 3.24 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 59 A 7.86 4.64 1.26 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 0.00 0.00 0.00 60 G 8.31 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 61 D 7.73 4.37 0.00 2.75 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.12 4.11 1.84 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.54 0.92 0.00 0.00 63 P 0.00 4.25 0.00 2.18 2.15 0.00 3.69 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 2.06 2.03 0.00 64 D 8.55 4.40 0.00 2.63 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 65 N 8.43 4.38 0.00 2.73 2.79 0.00 0.00 6.59 6.61 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 66 L 8.19 4.67 0.00 1.68 1.58 0.83 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.29 4.19 0.00 4.13 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 0.00 68 P 0.00 4.30 0.00 2.23 2.19 0.00 3.65 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 69 F 8.58 4.47 0.00 3.01 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 70 Y 8.12 4.08 0.00 3.01 3.12 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 71 E 8.16 3.69 0.00 2.18 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 0.00 2.36 2.43 0.00 72 A 8.36 3.98 1.44 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 0.00 0.00 73 L 7.95 3.87 0.00 1.63 1.51 0.05 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 7.56 3.89 0.00 2.02 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.06 5.11 0.00 0.00 0.00 0.00 0.00 2.31 2.13 0.00 75 E 8.15 3.99 0.00 2.01 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 2.29 2.31 0.00 76 Q 7.24 4.22 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.41 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 77 K 8.10 3.97 0.00 1.72 1.99 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.34 7.81 78 P 0.00 4.46 0.00 2.24 2.07 0.00 3.80 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 79 D 8.48 4.60 0.00 2.65 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 80 L 8.85 4.87 0.00 1.74 1.67 0.98 1.13 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 81 S 9.02 4.76 0.00 3.87 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 82 A 7.60 4.69 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 83 V 8.22 3.75 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 1.08 0.00 0.00 1.09 0.00 0.00 84 R 8.71 4.99 0.00 1.52 1.63 0.00 3.21 0.00 0.00 3.13 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.56 0.00 85 F 8.23 5.43 0.00 3.19 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 86 G 8.93 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 A 9.16 5.49 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 88 I 9.02 4.81 1.97 0.00 0.00 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 1.33 1.08 0.86 0.00 0.00 89 G 8.85 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 0.00 0.00 0.00 0.00 90 I 8.64 4.84 1.85 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 1.12 0.69 0.89 0.00 0.00 91 G 8.14 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 92 S 7.89 4.77 0.00 4.09 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 0.00 93 R 9.00 4.17 0.00 1.79 1.94 0.00 2.82 0.00 0.00 3.06 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.19 0.00 94 E 8.18 4.26 0.00 2.01 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 2.35 2.37 0.00 95 Y 7.73 4.23 0.00 3.17 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 96 D 8.93 4.48 0.00 2.66 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 97 T 7.50 4.78 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 1.26 0.00 0.00 98 F 8.45 4.94 0.00 2.86 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 99 C 7.82 4.03 0.00 2.94 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 0.00 100 G 7.96 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 0.00 101 A 7.83 4.01 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 0.00 102 I 7.79 3.58 1.89 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.27 0.98 0.00 0.00 103 D 7.89 4.40 0.00 2.80 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 7.60 3.82 0.00 1.37 0.74 0.00 1.33 0.00 0.00 1.06 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.18 1.24 7.81 105 L 7.61 3.94 0.00 1.80 1.72 0.98 1.03 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 0.00 106 E 8.20 3.48 0.00 2.37 2.23 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 2.56 2.52 0.00 107 A 8.22 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 108 E 8.19 4.08 0.00 1.99 1.89 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 2.52 2.35 0.00 109 L 7.58 3.87 0.00 1.37 1.53 0.53 0.40 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 0.00 110 K 8.37 4.60 0.00 2.21 2.01 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.22 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.55 1.52 7.81 111 N 8.40 4.35 0.00 2.84 3.02 0.00 0.00 7.85 7.33 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 0.00 112 S 8.36 4.35 0.00 4.08 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 0.00 113 G 8.06 3.71 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 0.00 0.00 0.00 114 A 8.20 4.79 1.61 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 0.00 0.00 115 K 8.50 4.76 0.00 1.53 1.53 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.74 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.37 7.81 116 Q 8.15 3.22 0.00 1.74 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 7.05 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 117 T 7.95 4.57 4.25 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 1.29 0.00 0.00 118 G 9.10 3.58 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 0.00 0.00 0.00 119 E 8.16 4.86 0.00 1.79 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 2.20 2.17 0.00 120 T 8.60 4.65 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 1.33 0.00 0.00 121 L 8.16 3.01 0.00 0.27 0.94 -0.17 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 122 K 7.77 4.85 0.00 1.35 1.39 0.00 1.48 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.98 1.16 7.81 123 I 7.90 4.31 1.88 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 0.95 0.73 0.86 0.00 0.00 124 N 8.62 5.04 0.00 2.78 2.64 0.00 0.00 6.61 7.83 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 0.00 125 I 8.28 4.93 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 1.09 1.72 0.89 0.00 0.00 126 L 8.67 4.09 0.00 1.68 1.86 0.99 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 127 D 8.21 4.69 0.00 2.68 2.68 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 0.00 128 H 7.86 4.88 0.00 3.24 3.21 0.00 5.80 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.09 4.97 0.00 2.50 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 0.00 130 I 7.42 3.07 1.84 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 1.32 0.59 0.86 0.00 0.00 131 P 0.00 4.49 0.00 2.15 2.10 0.00 3.72 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 132 E 7.88 4.64 0.00 1.88 1.90 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 2.19 2.29 0.00 133 D 7.72 4.83 0.00 2.63 2.52 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 0.00 134 P 0.00 4.26 0.00 2.25 2.02 0.00 3.69 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 2.14 2.14 0.00 135 A 8.72 4.08 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 0.00 136 E 8.30 3.95 0.00 2.04 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 2.39 2.41 0.00 137 E 8.14 3.96 0.00 2.32 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 2.36 2.49 0.00 138 W 8.23 3.81 0.00 3.31 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 0.00 139 L 8.71 4.49 0.00 2.11 1.96 1.30 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.19 3.71 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 0.00 0.00 0.00 141 S 7.80 4.12 0.00 3.56 3.61 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 0.00 142 W 8.00 4.37 0.00 3.71 3.20 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 0.00 0.00 0.00 0.00 143 V 8.44 3.85 2.32 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 1.18 0.00 0.00 1.08 0.00 0.00 144 N 8.15 4.40 0.00 2.85 3.06 0.00 0.00 7.16 7.61 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 0.00 145 L 7.09 4.49 0.00 2.04 1.72 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.52 3.87 0.00 1.68 1.77 0.77 1.06 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 0.00 147 K 8.00 4.67 0.00 1.87 2.15 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.58 1.61 7.81