NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4056 8.1885 115.4166 57.7116 64.7342 174.0956 2 A 3.7902 8.7010 123.6010 55.5942 18.0077 178.8688 3 T 3.8300 8.0345 113.9890 66.7848 68.9871 175.1308 4 S 4.1760 8.3244 115.1572 61.4676 62.4398 176.0953 5 L 3.9929 8.2103 121.9068 58.0381 41.2402 179.5633 6 T 3.6915 7.9187 115.5590 66.8019 68.4662 176.4807 7 F 4.3935 7.9551 118.6484 59.7276 38.9469 178.2536 8 Q 4.1120 8.4941 118.6358 58.8426 28.4255 178.4037 9 L 3.9744 8.2027 121.2313 58.0155 42.1726 178.7639 10 A 4.0052 8.2997 121.0482 55.4779 18.1229 179.0252 11 Y 4.2340 7.9440 116.8502 60.5226 38.8883 177.7965 12 L 3.9417 7.6944 120.5390 57.8322 42.5048 178.5204 13 V 4.0729 7.8765 109.1483 60.2570 32.5346 176.8041 14 K 4.4990 8.2508 122.5127 56.1104 31.0543 176.3438 15 K 4.5810 7.5621 116.4494 54.4919 34.9450 174.8128 16 I 4.4505 7.9961 124.0028 60.1611 40.7552 173.8372 17 D 4.2688 8.3435 125.5944 53.1779 42.0908 174.0529 18 F 5.0358 7.5651 120.2285 55.3961 41.3064 174.4387 19 D 4.5866 9.1539 121.3585 54.0661 41.9498 174.6693 20 Y 4.4434 8.3898 125.6404 57.4551 38.5290 176.5374 21 T 3.9012 8.3566 117.9856 63.4529 68.7444 172.3360 22 P 4.2826 0.0000 0.0000 62.1840 32.2236 175.4494 23 N 4.6983 8.4182 123.9833 51.5280 40.0109 174.4664 24 W 4.9687 8.8664 124.9630 55.3985 30.3720 176.1655 25 G 4.1224 8.9293 112.9665 44.8802 0.0000 172.9249 26 R 5.0100 8.5963 122.1537 54.6204 32.3969 176.6398 27 G 4.3993 8.7844 108.7513 45.3907 0.0000 173.6456 28 T 4.7773 8.4165 121.2216 60.8958 71.2681 172.0043 29 P 4.6318 0.0000 0.0000 62.0905 32.1928 177.2543 30 S 4.6626 8.7306 111.9717 59.4258 63.2701 175.3160 31 S 4.1876 7.9895 115.9280 60.2377 63.4984 173.0303 32 Y 4.7175 7.9294 120.3733 57.1724 39.5914 174.5966 33 I 4.5773 8.7893 125.1863 60.4713 37.7746 176.0095 34 D 4.8576 9.2128 128.0575 55.5175 42.6089 175.8538 35 N 3.8137 7.6576 114.1587 51.8168 40.8228 173.0620 36 L 4.4842 7.7165 120.4533 53.3957 45.4723 174.8628 37 T 4.6727 8.5092 122.9013 61.5799 71.7978 172.8816 38 F 5.3816 8.3490 124.8853 55.2983 40.5218 175.2932 39 P 4.2413 0.0000 0.0000 65.2650 32.2572 176.7164 40 K 4.4494 8.2513 121.0805 55.5453 33.8699 175.8791 41 V 3.6335 8.4738 119.9021 59.7138 32.9246 176.0923 42 L 4.3822 8.5622 122.8619 55.3125 42.0164 177.4157 43 T 4.8451 8.3882 109.8547 61.2857 69.6326 174.6891 44 D 4.5174 8.4217 122.5517 55.7544 39.7629 175.9497 45 K 4.4716 7.3567 117.1037 54.4088 36.0100 176.7399 46 K 4.2097 7.8885 120.6750 55.6695 30.5738 176.0354 47 Y 4.5019 7.8051 120.1247 57.5539 39.2431 174.3459 48 S 4.9435 8.5021 116.3988 56.7289 67.3308 172.0780 49 Y 5.5135 9.1830 116.3805 56.4071 41.9228 174.6545 50 R 5.3779 9.5015 124.5306 54.7756 32.7217 174.7497 51 V 4.9413 8.6131 125.6654 61.0603 34.6001 174.2260 52 V 4.9029 8.9353 127.0701 61.0954 34.8152 174.0215 53 V 4.6208 8.7907 128.1057 61.3009 33.7458 175.2635 54 N 4.2244 10.1373 127.8421 54.3992 36.6199 175.7470 55 G 3.8704 8.4039 104.5234 45.4665 0.0000 173.8603 56 S 4.3584 7.9178 115.8159 56.6312 62.3204 172.6840 57 D 4.6496 8.6452 128.5334 54.5743 40.9610 175.5584 58 L 4.4298 9.0985 126.9248 54.4960 42.5877 178.5024 59 G 3.9475 8.8968 108.7959 44.4601 0.0000 172.8550 60 V 5.2321 8.1432 117.5146 60.2388 34.1775 174.2894 61 E 4.6942 9.0011 120.8753 55.4797 32.5697 175.5937 62 S 4.8053 8.6695 114.8701 57.8176 65.2098 174.6387 63 N 4.3877 7.3027 121.2760 52.1359 37.0080 172.8533 64 F 4.8925 7.4226 116.1533 54.8923 42.6028 175.1055 65 A 4.1308 8.7973 128.9855 52.1780 18.8755 176.3569 66 V 4.4080 8.1897 121.4098 61.4074 32.8100 176.1635 67 T 4.3269 8.6223 117.9805 60.2650 69.7073 173.8293 68 P 4.2320 0.0000 0.0000 65.6141 31.3723 178.2855 69 S 4.1433 7.9372 111.3598 59.6718 63.3432 174.9967 70 G 4.0015 8.5322 110.2558 44.8106 0.0000 173.4909 71 G 4.1277 7.7606 107.4654 46.1295 0.0000 173.0829 72 Q 5.0246 8.8209 121.6523 54.9186 33.0241 173.2450 73 T 4.5900 8.4552 122.9922 61.7553 70.7479 173.8936 74 I 2.4536 7.9946 129.0164 59.8220 38.4357 174.8239 75 N 4.6666 7.8708 127.3126 52.0597 39.4116 175.7977 76 F 4.9143 8.8591 127.0111 60.2066 39.5431 177.9584 77 L 4.2965 8.2755 120.6772 57.6219 41.0417 178.9233 78 Q 4.2287 8.2518 116.6177 57.7917 28.7728 176.7658 79 Y 4.6828 8.3869 116.6902 57.7886 39.7253 175.5344 80 N 5.0712 8.2578 118.3455 53.2912 39.6940 174.0192 81 K 3.9247 9.3544 111.4912 57.3397 29.6714 176.7149 82 G 3.8119 8.5802 104.6094 45.5256 0.0000 173.5380 83 Y 4.6859 7.4821 115.9978 55.5510 41.0770 176.3648 84 G 4.3837 8.4148 109.4647 45.4206 0.0000 171.9946 85 V 4.6871 8.6290 119.4025 60.4749 34.0703 175.5526 86 A 3.9333 8.8491 129.5062 52.2712 18.8623 177.8056 87 D 4.2919 8.5956 121.5451 55.0096 39.5486 177.2818 88 T 4.2210 7.6517 109.1570 62.3971 69.5325 174.6299 89 K 4.5259 7.7648 121.9381 55.2768 34.1282 175.9366 90 T 4.5737 8.1322 117.7196 63.3257 70.1766 173.7149 91 I 4.9246 8.8332 126.5194 59.5824 40.3412 174.4435 92 Q 5.1288 9.2512 126.2020 53.9892 32.1008 174.7172 93 V 4.9441 8.7901 123.0982 61.1778 34.6520 174.0162 94 F 5.4411 9.6787 126.9484 55.6422 41.9889 174.8708 95 V 4.5209 8.9590 123.4911 60.9536 33.1599 174.9039 96 V 4.7672 8.7568 125.3812 61.1176 33.6670 174.4664 97 I 4.4940 8.6874 130.0466 60.0228 37.6628 174.5514 98 P 4.3528 0.0000 0.0000 63.6730 31.9032 175.1696 99 D 4.4961 8.7083 116.6008 56.0062 38.1843 174.4741 100 T 4.5315 7.5925 105.8348 60.6820 69.3521 173.9289 101 G 3.9120 8.8778 107.7251 47.2286 0.0000 174.0063 102 N 4.2605 8.3929 112.6033 53.8095 36.1261 175.4970 103 S 4.3101 7.9662 113.9271 58.9637 64.0074 173.3986 104 E 4.5727 8.0102 123.5362 54.4622 30.6897 174.5532 105 E 5.2127 8.0932 123.6123 55.3557 33.2286 173.9591 106 Y 4.8483 9.0169 117.2515 55.8841 42.4672 174.8326 107 I 3.4524 8.8037 123.9715 61.6373 38.0578 175.0896 108 I 4.5110 8.6695 127.4120 60.6192 39.9513 174.8450 109 A 4.8498 7.6121 121.0850 51.2523 22.4953 174.7100 110 E 5.1584 9.0763 121.2151 54.3618 32.9878 174.1369 111 W 4.1827 9.1736 135.0000 55.3207 32.4480 175.9423 112 K 3.7820 7.3059 127.1927 56.5163 31.9114 175.4104 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 S 8.19 4.41 0.00 4.04 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 2 A 8.70 3.79 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 3 T 8.03 3.83 4.31 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 1.42 0.00 0.00 4 S 8.32 4.18 0.00 3.93 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 5 L 8.21 3.99 0.00 1.86 1.70 0.92 1.03 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 6 T 7.92 3.69 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 0.53 0.00 0.00 7 F 7.96 4.39 0.00 3.14 3.07 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 8 Q 8.49 4.11 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.63 0.00 9 L 8.20 3.97 0.00 1.84 1.88 0.94 1.08 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 10 A 8.30 4.01 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 11 Y 7.94 4.23 0.00 2.99 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 12 L 7.69 3.94 0.00 1.76 1.82 0.89 1.28 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 13 V 7.88 4.07 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 0.84 0.00 0.00 0.99 0.00 0.00 14 K 8.25 4.50 0.00 1.94 2.01 0.00 1.66 0.00 0.00 1.79 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.31 1.48 7.81 15 K 7.56 4.58 0.00 1.65 1.63 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.38 7.81 16 I 8.00 4.45 1.90 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.87 0.81 0.00 0.00 17 D 8.34 4.27 0.00 2.55 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.57 5.04 0.00 3.12 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 19 D 9.15 4.59 0.00 2.62 2.59 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 20 Y 8.39 4.44 0.00 2.67 2.36 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 21 T 8.36 3.90 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 1.27 0.00 0.00 22 P 0.00 4.28 0.00 1.76 2.12 0.00 3.87 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 23 N 8.42 4.70 0.00 2.65 2.71 0.00 0.00 6.61 6.95 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 24 W 8.87 4.97 0.00 3.11 2.93 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 25 G 8.93 4.12 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 0.00 0.00 0.00 26 R 8.60 5.01 0.00 1.70 2.00 0.00 3.18 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 27 G 8.78 4.40 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 0.00 28 T 8.42 4.78 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 1.23 0.00 0.00 29 P 0.00 4.63 0.00 2.33 2.28 0.00 3.81 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 2.43 2.12 0.00 30 S 8.73 4.66 0.00 4.02 4.06 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 31 S 7.99 4.19 0.00 3.81 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 32 Y 7.93 4.72 0.00 3.20 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 33 I 8.79 4.58 1.61 0.00 0.00 -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 0.67 0.23 1.08 0.00 0.00 34 D 9.21 4.86 0.00 2.67 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 35 N 7.66 3.81 0.00 2.39 2.60 0.00 0.00 5.65 6.67 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 36 L 7.72 4.48 0.00 1.10 0.66 -0.61 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.51 4.67 4.01 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 1.13 0.00 0.00 38 F 8.35 5.38 0.00 2.78 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 39 P 0.00 4.24 0.00 2.04 2.09 0.00 3.92 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 2.14 2.07 0.00 40 K 8.25 4.45 0.00 1.75 1.67 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.40 7.81 41 V 8.47 3.63 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 0.64 0.00 0.00 1.07 0.00 0.00 42 L 8.56 4.38 0.00 1.72 1.95 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.39 4.85 4.31 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 1.35 0.00 0.00 44 D 8.42 4.52 0.00 2.84 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 45 K 7.36 4.47 0.00 0.79 1.20 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.20 1.33 7.81 46 K 7.89 4.21 0.00 1.62 1.72 0.00 1.56 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.46 7.81 47 Y 7.81 4.50 0.00 2.81 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 48 S 8.50 4.94 0.00 4.04 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 49 Y 9.18 5.51 0.00 3.37 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 50 R 9.50 5.38 0.00 2.03 2.01 0.00 3.15 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 51 V 8.61 4.94 1.43 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 0.46 0.00 0.00 0.43 0.00 0.00 52 V 8.94 4.90 2.24 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 1.09 0.00 0.00 1.13 0.00 0.00 53 V 8.79 4.62 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 0.89 0.00 0.00 0.80 0.00 0.00 54 N 10.14 4.22 0.00 2.81 2.84 0.00 0.00 7.15 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 55 G 8.40 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 0.00 0.00 0.00 56 S 7.92 4.36 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 57 D 8.65 4.65 0.00 2.69 2.61 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 58 L 9.10 4.43 0.00 1.88 1.90 0.98 1.04 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 59 G 8.90 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 60 V 8.14 5.23 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 0.83 0.00 0.00 1.10 0.00 0.00 61 E 9.00 4.69 0.00 1.58 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.66 0.00 62 S 8.67 4.81 0.00 3.93 3.90 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 0.00 0.00 0.00 63 N 7.30 4.39 0.00 2.47 2.49 0.00 0.00 6.82 7.02 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 64 F 7.42 4.89 0.00 3.35 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 65 A 8.80 4.13 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 66 V 8.19 4.41 2.15 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 0.97 0.00 0.00 1.09 0.00 0.00 67 T 8.62 4.33 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 1.21 0.00 0.00 68 P 0.00 4.23 0.00 2.06 2.17 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 69 S 7.94 4.14 0.00 3.97 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 70 G 8.53 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 71 G 7.76 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 0.00 0.00 0.00 72 Q 8.82 5.02 0.00 2.21 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.70 0.00 73 T 8.46 4.59 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 0.97 0.00 0.00 74 I 7.99 2.45 1.02 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 -0.19 0.48 0.00 0.00 75 N 7.87 4.67 0.00 2.83 3.04 0.00 0.00 7.17 7.71 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 76 F 8.86 4.91 0.00 3.29 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 77 L 8.28 4.30 0.00 2.00 1.75 1.02 0.57 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 78 Q 8.25 4.23 0.00 2.39 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 79 Y 8.39 4.68 0.00 3.17 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 80 N 8.26 5.07 0.00 2.93 3.14 0.00 0.00 7.26 6.10 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 81 K 9.35 3.92 0.00 2.12 1.99 0.00 1.88 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.52 7.81 82 G 8.58 3.81 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 0.00 0.00 0.00 83 Y 7.48 4.69 0.00 3.01 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 84 G 8.41 4.38 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 0.00 85 V 8.63 4.69 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 0.80 0.00 0.00 0.80 0.00 0.00 86 A 8.85 3.93 1.07 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 87 D 8.60 4.29 0.00 2.80 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 88 T 7.65 4.22 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 1.17 0.00 0.00 89 K 7.76 4.53 0.00 1.81 1.75 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.46 7.81 90 T 8.13 4.57 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 1.23 0.00 0.00 91 I 8.83 4.92 1.75 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.69 0.63 0.00 0.00 92 Q 9.25 5.13 0.00 2.07 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 93 V 8.79 4.94 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 1.16 0.00 0.00 1.14 0.00 0.00 94 F 9.68 5.44 0.00 3.02 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 95 V 8.96 4.52 2.15 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 0.67 0.00 0.00 0.66 0.00 0.00 96 V 8.76 4.77 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 1.05 0.00 0.00 1.04 0.00 0.00 97 I 8.69 4.49 1.97 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.37 1.00 0.00 0.00 98 P 0.00 4.35 0.00 2.10 2.11 0.00 3.79 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 1.84 1.90 0.00 99 D 8.71 4.50 0.00 2.84 2.80 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 0.00 0.00 0.00 0.00 100 T 7.59 4.53 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 1.39 0.00 0.00 101 G 8.88 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 0.00 102 N 8.39 4.26 0.00 2.88 2.91 0.00 0.00 7.11 7.57 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 0.00 103 S 7.97 4.31 0.00 3.95 3.96 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 0.00 104 E 8.01 4.57 0.00 2.10 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 2.17 2.19 0.00 105 E 8.09 5.21 0.00 2.14 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 1.99 2.24 0.00 106 Y 9.02 4.85 0.00 2.84 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 0.00 107 I 8.80 3.45 1.72 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.44 0.91 0.00 0.00 108 I 8.67 4.51 1.79 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.53 1.23 0.00 0.00 109 A 7.61 4.85 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 0.00 110 E 9.08 5.16 0.00 1.95 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 2.13 2.39 0.00 111 W 9.17 4.18 0.00 1.78 2.26 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 0.00 112 K 7.31 3.78 0.00 1.49 1.31 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.13 1.29 7.81