NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.5116 8.1693 120.6429 55.0176 43.1253 175.6512 8 H 4.9315 8.5024 116.3600 53.3190 31.7115 171.3512 9 K 4.5345 9.4679 121.2865 56.3281 33.5308 177.3498 10 E 4.9816 9.1600 123.3837 53.6962 33.3851 173.7663 11 P 4.9735 0.0000 0.0000 63.2109 32.3946 174.9965 12 A 4.9235 8.4446 122.0442 51.4092 22.9882 175.4742 13 T 4.6444 8.6966 115.1091 61.2053 72.2369 173.8973 14 L 4.2336 8.7330 127.9022 56.1891 42.2221 175.5211 15 I 4.3843 8.6615 126.3062 62.2890 39.0642 176.0148 16 K 4.5563 7.5760 120.6582 55.1880 35.5444 174.2249 17 A 4.4984 8.7317 130.6042 52.1882 19.2633 176.7694 18 I 4.2552 8.3091 122.2020 62.5453 39.0705 174.7939 19 D 4.6215 8.3161 117.9328 52.7964 44.4389 175.6235 20 G 3.7259 8.8153 109.4098 47.9304 0.0000 174.0249 21 D 4.9292 8.0737 116.3567 52.7914 40.1633 174.8523 22 T 5.1415 7.7095 116.5131 62.4160 72.5865 173.3461 23 V 4.7278 8.6974 118.7009 59.4301 36.4711 174.2797 24 K 4.9431 9.2145 126.0882 55.2516 33.6192 175.2900 25 L 5.2984 9.1792 126.8743 53.0968 46.3880 175.2448 26 M 4.8286 9.5701 122.8652 54.8651 33.6399 174.3041 27 Y 4.9606 9.1218 128.1049 55.8972 42.0470 175.5545 28 K 3.5131 9.2260 127.2496 57.5603 29.5478 176.5483 29 G 3.9236 8.3553 104.3165 45.7052 0.0000 173.4925 30 Q 4.6899 7.7054 121.1442 53.2892 31.2983 172.6232 31 P 5.0420 0.0000 0.0000 62.8768 32.2849 175.4097 32 M 4.8387 9.2531 122.9992 54.5425 36.5213 173.3792 33 T 4.8581 8.5125 121.8460 62.7250 70.5896 173.4950 34 F 5.0249 9.7217 125.5802 55.7493 41.7453 174.5350 35 R 4.9452 8.9297 123.5999 54.5299 32.0574 175.1287 36 L 4.4201 8.7125 127.5083 54.2166 42.3120 177.2627 37 L 3.8364 8.4539 124.8243 56.1470 42.1388 178.0478 38 L 3.8999 8.8020 120.2981 55.1736 39.4846 173.9834 39 V 4.8653 7.3233 109.9507 59.5653 34.6798 175.2804 40 D 4.7432 8.9340 124.3959 52.7207 42.6418 174.9761 41 S 4.5956 8.3812 118.3918 56.0381 63.8335 172.2236 42 P 4.4084 0.0000 0.0000 62.7376 32.0667 175.0591 43 E 4.5574 10.1618 123.5765 55.0237 31.0588 176.7421 44 T 4.2349 8.2572 112.9357 62.0610 69.7535 174.5695 45 K 4.3596 7.6648 120.6854 55.4425 34.9879 171.1666 46 H 4.2667 8.6652 123.3783 55.0828 27.8014 174.7478 47 P 4.3578 0.0000 0.0000 65.2034 31.8897 176.8851 48 K 4.4261 7.9151 119.7916 54.0825 32.7417 177.6112 49 K 4.8931 8.8308 122.4863 56.0927 30.9312 173.5744 50 G 4.0683 4.0000 106.9040 44.1045 0.0000 177.4961 51 V 4.3265 8.1770 120.0103 60.4256 30.7493 173.6956 52 E 4.1527 8.4861 124.4864 55.1327 30.4906 176.5460 53 K 4.0598 8.1640 121.6975 57.9740 32.6165 176.6985 54 Y 4.3291 7.8903 122.1662 59.3438 36.3639 171.0453 55 G 3.9786 7.9296 107.0082 47.6753 0.0000 174.0968 56 P 4.2955 0.0000 0.0000 64.7374 31.4676 178.7585 57 E 4.0259 8.0902 117.1354 59.3552 29.5609 178.9642 58 A 4.0235 8.8589 121.5315 55.0794 18.4459 179.6160 59 S 4.1205 8.3765 111.6334 61.6299 62.4480 176.3645 60 A 4.0747 8.1948 123.4442 54.7702 18.0824 179.4909 61 F 3.9578 8.3742 119.4298 61.8226 39.4535 177.4710 62 T 3.9524 8.1848 115.3999 66.5412 68.1630 176.5219 63 K 3.9194 8.0341 121.3760 59.4913 32.2358 179.0614 64 K 3.9066 8.1973 118.9306 59.5008 31.7051 179.0011 65 M 3.8404 7.6247 117.4464 58.7941 32.0666 178.3977 66 V 3.8199 8.0890 112.5853 63.9441 31.5773 178.4921 67 E 3.9656 8.3390 118.1378 59.0096 29.4102 177.4160 68 N 4.6294 8.1260 113.4055 53.0021 38.9460 175.0723 69 A 4.5472 7.2894 121.5757 51.5251 19.4918 178.3105 70 K 4.1811 8.8673 121.0349 58.6192 32.6650 178.2503 71 K 4.6818 8.6242 117.6879 54.5575 36.1765 175.6018 72 I 5.0442 8.4095 124.8327 59.6448 40.1325 174.4086 73 E 5.1240 9.0901 124.6938 54.7093 33.8072 174.9848 74 V 4.6179 9.0204 116.2970 59.5622 34.8710 174.7626 75 E 4.9834 8.7588 124.4935 54.3825 32.0130 175.0511 76 F 4.6146 8.8675 125.6976 57.6746 40.0829 175.7579 77 D 5.0315 8.4523 120.6812 53.5217 43.2353 175.6973 78 K 4.3241 8.9744 116.5764 58.0629 33.0205 177.8589 79 G 4.0860 8.5193 110.8632 44.5943 0.0000 173.4314 80 Q 4.1300 8.5855 118.9892 56.7099 29.2731 176.2829 81 R 4.7027 8.4276 116.7095 56.4690 31.8617 175.4982 82 T 5.1988 7.7381 115.1261 61.7895 72.6003 173.3746 83 D 4.9209 8.5976 124.9361 51.6310 42.1195 177.0901 84 K 3.9297 8.6200 116.5709 59.4318 32.5466 177.0312 85 Y 4.2772 8.1383 115.8754 57.8264 38.0181 176.1720 86 G 3.9400 8.3693 108.6725 45.0292 0.0000 173.8092 87 R 4.3629 8.2449 119.6828 54.8490 31.7693 176.4952 88 G 3.4847 8.0925 110.7451 46.4833 0.0000 172.5009 89 L 5.3116 8.8479 123.8014 53.0332 43.1618 175.5375 90 A 4.5597 8.3778 124.8375 50.5720 23.7899 173.9086 91 Y 4.8964 8.8501 117.4152 57.1812 39.6680 175.1431 92 I 4.8680 8.9868 125.5113 59.6477 40.2626 174.1427 93 Y 5.1191 8.8953 123.6209 56.0499 41.0396 174.4041 94 A 4.9376 9.4120 126.5973 50.2360 21.3885 176.3306 95 D 4.2788 10.0050 125.7435 55.7908 39.0569 175.3517 96 G 3.9933 8.4457 105.5023 45.1430 0.0000 173.2752 97 K 4.5471 8.0523 120.4209 54.5811 34.0544 175.2402 98 M 3.9491 8.5047 123.2655 54.9900 32.9609 176.9631 99 V 3.6366 8.7349 127.6206 66.1479 31.7006 177.6496 100 N 4.3063 7.9613 115.7871 56.2570 38.4528 176.8550 101 E 3.9262 8.0169 119.9113 59.0775 29.8769 178.2017 102 A 4.0460 8.0504 120.8663 55.4595 18.4017 179.5227 103 L 3.5082 7.8820 117.2105 57.9034 41.6811 180.0764 104 V 3.7610 7.3819 116.6898 65.8902 31.2796 178.0502 105 R 3.9360 8.2354 117.9592 59.2120 29.9362 177.5389 106 Q 4.3285 7.7748 115.2732 54.9422 28.9936 175.9012 107 G 3.9363 8.0806 108.5022 46.9406 0.0000 174.8736 108 L 4.3798 7.9220 116.6866 53.7296 42.4663 176.1908 109 A 4.6046 7.4887 118.7527 50.9691 22.0920 176.4177 110 K 4.7377 8.7329 119.5497 54.8761 34.9964 176.1000 111 V 4.2793 8.5553 122.5239 62.3452 31.7803 176.0203 112 A 4.2209 8.9254 130.4864 51.2471 19.2271 176.7950 113 Y 4.1362 7.5423 117.3852 58.2001 38.4470 176.1512 114 V 4.0811 8.1243 124.0901 61.2690 33.1653 174.4063 115 Y 4.6004 8.2758 124.8611 55.9261 38.4330 175.5298 116 K 4.4641 8.5728 124.8357 56.1363 32.7451 175.0521 117 P 4.8067 0.0000 0.0000 63.1425 31.8017 177.0063 118 N 4.8337 8.1064 118.7850 52.1442 36.9443 175.4893 119 N 5.0669 7.8891 112.6248 53.7866 39.2341 177.3334 120 T 3.8390 8.4335 117.7771 67.7935 68.6731 174.8740 121 H 4.8228 7.8403 116.5505 55.8027 29.0792 176.7259 122 E 3.9871 8.3702 123.6155 59.7437 29.2925 179.1031 123 Q 4.0173 8.0432 117.4614 59.0547 28.8685 177.8050 124 H 4.2070 8.2396 118.8122 59.5205 29.9341 177.1908 125 L 3.9540 7.9695 120.6515 57.7614 41.3806 179.7026 126 R 4.0802 8.1547 118.1190 58.9067 29.7863 179.2323 127 K 3.9288 8.0667 118.5039 59.7402 32.0730 179.6105 128 S 4.1473 7.9288 115.3194 61.3864 62.6678 176.3774 129 E 3.9575 8.7625 122.3722 59.0275 29.3552 178.6880 130 A 3.7530 8.1370 121.1453 54.7341 18.3234 179.5148 131 Q 3.7327 7.8371 117.8275 59.3378 29.2335 177.9360 132 A 4.0032 8.0083 121.8567 55.3786 18.2742 179.8294 133 K 3.3834 7.6973 116.7043 59.1839 31.7421 179.4647 134 K 3.8040 8.0404 119.2446 59.2373 32.1588 177.7261 135 E 4.2602 8.5125 116.0842 55.1934 30.1709 176.1756 136 K 4.1061 8.1335 118.7045 57.2726 30.6290 174.9264 137 L 4.4223 8.0741 117.8029 55.5250 44.6875 178.4268 138 N 3.5535 9.4523 118.1535 54.1110 38.5495 176.3067 139 I 3.0187 5.4200 124.7763 64.8201 37.5437 176.5640 140 W 4.8211 7.8998 116.9269 56.6899 29.1215 176.4146 141 S 4.7232 8.1902 119.2495 57.9678 61.7585 173.6041 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 7 L 8.17 4.51 0.00 1.74 1.80 1.07 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 8 H 8.50 4.93 0.00 3.22 3.23 0.00 5.52 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.47 4.53 0.00 1.58 1.69 0.00 1.44 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.08 1.26 7.81 10 E 9.16 4.98 0.00 2.13 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 2.36 2.22 0.00 11 P 0.00 4.97 0.00 2.09 2.06 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 12 A 8.44 4.92 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 13 T 8.70 4.64 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 1.22 0.00 0.00 14 L 8.73 4.23 0.00 1.63 1.58 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.66 4.38 2.02 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 1.15 0.86 0.94 0.00 0.00 16 K 7.58 4.56 0.00 1.81 1.61 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.44 7.81 17 A 8.73 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 18 I 8.31 4.26 2.01 0.00 0.00 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 1.30 0.70 0.90 0.00 0.00 19 D 8.32 4.62 0.00 2.68 2.48 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 20 G 8.82 3.73 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 0.00 0.00 0.00 21 D 8.07 4.93 0.00 2.81 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 22 T 7.71 5.14 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 1.27 0.00 0.00 23 V 8.70 4.73 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 0.77 0.00 0.00 0.93 0.00 0.00 24 K 9.21 4.94 0.00 1.83 1.81 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.46 7.81 25 L 9.18 5.30 0.00 1.70 1.51 0.38 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.57 4.83 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 27 Y 9.12 4.96 0.00 3.23 3.05 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 0.00 0.00 0.00 0.00 28 K 9.23 3.51 0.00 1.66 1.69 0.00 1.66 0.00 0.00 1.44 0.00 0.00 2.13 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.30 1.04 7.81 29 G 8.36 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 30 Q 7.71 4.69 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.96 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 31 P 0.00 5.04 0.00 2.02 2.01 0.00 3.77 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 32 M 9.25 4.84 0.00 2.23 1.96 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.09 0.00 33 T 8.51 4.86 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 1.23 0.00 0.00 34 F 9.72 5.02 0.00 2.98 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 35 R 8.93 4.95 0.00 1.88 1.78 0.00 3.32 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 36 L 8.71 4.42 0.00 1.54 1.59 0.97 1.01 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 37 L 8.45 3.84 0.00 1.20 1.17 0.35 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.80 3.90 0.00 2.01 1.86 1.16 1.02 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 39 V 7.32 4.87 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 0.80 0.00 0.00 0.91 0.00 0.00 40 D 8.93 4.74 0.00 2.50 2.48 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 41 S 8.38 4.60 0.00 3.84 3.72 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 42 P 0.00 4.41 0.00 2.34 2.04 0.00 3.62 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.01 0.00 43 E 10.16 4.56 0.00 1.87 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 2.46 2.45 0.00 44 T 8.26 4.23 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 1.19 0.00 0.00 45 K 7.66 4.36 0.00 1.72 1.74 0.00 1.77 0.00 0.00 1.67 0.00 0.00 3.12 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.40 7.81 46 H 8.67 4.27 0.00 3.61 3.36 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.36 0.00 2.19 2.19 0.00 3.83 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 48 K 7.92 4.43 0.00 1.69 1.82 0.00 1.90 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.36 7.81 49 K 8.83 4.89 0.00 1.96 1.73 0.00 1.51 0.00 0.00 1.68 0.00 0.00 3.12 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.16 7.81 50 G 4.00 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 0.00 0.00 0.00 51 V 8.18 4.33 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 0.85 0.00 0.00 0.98 0.00 0.00 52 E 8.49 4.15 0.00 2.08 1.85 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 2.31 2.45 0.00 53 K 8.16 4.06 0.00 1.61 1.68 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.35 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.12 0.81 7.81 54 Y 7.89 4.33 0.00 3.20 3.06 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 0.00 0.00 0.00 0.00 55 G 7.93 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 0.00 0.00 0.00 56 P 0.00 4.30 0.00 2.16 2.10 0.00 3.52 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 57 E 8.09 4.03 0.00 2.41 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 2.55 2.51 0.00 58 A 8.86 4.02 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 59 S 8.38 4.12 0.00 4.05 4.03 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 60 A 8.19 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 61 F 8.37 3.96 0.00 3.29 3.15 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 0.00 62 T 8.18 3.95 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 1.28 0.00 0.00 63 K 8.03 3.92 0.00 1.85 1.94 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.63 7.81 64 K 8.20 3.91 0.00 1.66 1.74 0.00 1.79 0.00 0.00 1.49 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.58 7.81 65 M 7.62 3.84 0.00 2.03 1.79 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 66 V 8.09 3.82 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 0.79 0.00 0.00 1.02 0.00 0.00 67 E 8.34 3.97 0.00 1.97 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 2.33 2.44 0.00 68 N 8.13 4.63 0.00 2.72 2.80 0.00 0.00 7.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 7.29 4.55 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 70 K 8.87 4.18 0.00 1.84 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.53 7.81 71 K 8.62 4.68 0.00 1.66 1.65 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.39 7.81 72 I 8.41 5.04 1.85 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 1.14 0.85 0.00 0.00 73 E 9.09 5.12 0.00 1.91 1.83 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 2.21 2.26 0.00 74 V 9.02 4.62 1.36 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 -0.09 0.00 0.00 0.71 0.00 0.00 75 E 8.76 4.98 0.00 2.26 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 0.00 2.47 2.40 0.00 76 F 8.87 4.61 0.00 3.03 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 77 D 8.45 5.03 0.00 2.69 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 78 K 8.97 4.32 0.00 1.80 1.90 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.22 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.46 7.81 79 G 8.52 4.09 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 0.00 0.00 0.00 80 Q 8.59 4.13 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.78 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 81 R 8.43 4.70 0.00 1.53 1.58 0.00 2.61 0.00 0.00 2.25 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 82 T 7.74 5.20 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 1.21 0.00 0.00 83 D 8.60 4.92 0.00 2.80 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 84 K 8.62 3.93 0.00 1.60 1.79 0.00 1.23 0.00 0.00 1.50 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.95 0.33 7.81 85 Y 8.14 4.28 0.00 3.07 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 86 G 8.37 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 0.00 0.00 0.00 87 R 8.24 4.36 0.00 1.84 1.92 0.00 3.13 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 88 G 8.09 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 89 L 8.85 5.31 0.00 1.54 1.61 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.38 4.56 0.94 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 0.00 0.00 91 Y 8.85 4.90 0.00 2.99 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 92 I 8.99 4.87 1.77 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.82 0.80 0.00 0.00 93 Y 8.90 5.12 0.00 2.94 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 94 A 9.41 4.94 1.19 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 0.00 0.00 95 D 10.00 4.28 0.00 2.72 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 96 G 8.45 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 0.00 0.00 0.00 97 K 8.05 4.55 0.00 1.98 1.75 0.00 1.68 0.00 0.00 1.59 0.00 0.00 3.15 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.38 7.81 98 M 8.50 3.95 0.00 1.89 1.59 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.49 0.00 99 V 8.73 3.64 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 1.02 0.00 0.00 0.93 0.00 0.00 100 N 7.96 4.31 0.00 2.88 2.90 0.00 0.00 6.78 7.66 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 0.00 101 E 8.02 3.93 0.00 1.88 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 2.20 2.03 0.00 102 A 8.05 4.05 1.59 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 0.00 103 L 7.88 3.51 0.00 1.83 1.62 1.00 0.77 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 0.00 104 V 7.38 3.76 2.18 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 1.07 0.00 0.00 0.96 0.00 0.00 105 R 8.24 3.94 0.00 1.98 2.07 0.00 3.34 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 106 Q 7.77 4.33 0.00 1.59 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.48 0.00 0.00 0.00 0.00 0.00 2.37 1.97 0.00 107 G 8.08 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 0.00 0.00 0.00 108 L 7.92 4.38 0.00 1.25 1.46 0.53 0.43 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 0.00 109 A 7.49 4.60 1.11 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 0.00 110 K 8.73 4.74 0.00 1.65 1.75 0.00 1.66 0.00 0.00 1.31 0.00 0.00 2.72 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.68 1.33 7.81 111 V 8.56 4.28 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 0.78 0.00 0.00 0.96 0.00 0.00 112 A 8.93 4.22 1.20 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 0.00 0.00 113 Y 7.54 4.14 0.00 2.73 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 0.00 114 V 8.12 4.08 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 0.85 0.00 0.00 1.04 0.00 0.00 115 Y 8.28 4.60 0.00 3.15 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 0.00 116 K 8.57 4.46 0.00 1.80 1.80 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.47 7.81 117 P 0.00 4.81 0.00 2.22 2.16 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 118 N 8.11 4.83 0.00 2.99 2.89 0.00 0.00 6.64 7.64 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 0.00 119 N 7.89 5.07 0.00 2.95 3.01 0.00 0.00 6.09 7.22 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 0.00 120 T 8.43 3.84 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 1.14 0.00 0.00 121 H 7.84 4.82 0.00 2.82 3.10 0.00 5.63 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.37 3.99 0.00 2.18 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 2.34 2.40 0.00 123 Q 8.04 4.02 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.66 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 124 H 8.24 4.21 0.00 3.21 3.44 0.00 5.87 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 0.00 125 L 7.97 3.95 0.00 1.76 1.69 1.00 0.91 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 0.00 126 R 8.15 4.08 0.00 2.10 1.97 0.00 3.14 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 127 K 8.07 3.93 0.00 2.14 1.87 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.49 7.81 128 S 7.93 4.15 0.00 3.93 3.87 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 0.00 129 E 8.76 3.96 0.00 2.07 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 0.00 2.18 2.58 0.00 130 A 8.14 3.75 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 0.00 131 Q 7.84 3.73 0.00 2.24 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 132 A 8.01 4.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 7.70 3.38 0.00 1.27 1.09 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.41 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.30 0.77 7.81 134 K 8.04 3.80 0.00 1.65 1.99 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.58 7.81 135 E 8.51 4.26 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 2.31 2.45 0.00 136 K 8.13 4.11 0.00 1.96 1.89 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.39 7.81 137 L 8.07 4.42 0.00 1.81 1.71 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 138 N 9.45 3.55 0.00 2.52 1.45 0.00 0.00 7.10 7.58 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 0.00 139 I 5.42 3.02 1.01 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 0.84 -0.23 -0.93 0.00 0.00 140 W 7.90 4.82 0.00 3.39 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 0.00 141 S 8.19 4.72 0.00 3.92 4.04 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 0.00 0.00 0.00