NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 N 4.5231 8.4249 119.1951 53.8257 39.9813 174.2415 14 H 4.4096 8.4538 119.5153 54.3526 27.4221 171.7265 15 I 3.1875 8.2015 125.0070 57.7378 36.3958 174.3870 16 S 3.9477 7.3675 116.9052 58.0241 62.5840 172.4610 17 T 4.3215 7.6823 117.7741 62.6936 69.0705 175.3983 18 S 4.1250 7.8365 115.4332 59.2514 62.8791 169.3963 19 D 4.4652 8.6661 131.4756 53.1860 40.8349 174.0669 20 Q 4.0684 8.6612 121.6585 56.7790 28.6874 174.9850 21 E 4.6260 7.9290 121.3104 57.3500 34.8797 175.6421 22 K 4.3017 7.9991 121.7146 56.5662 33.7109 176.4336 23 L 5.0010 8.2183 120.0727 53.1632 45.8306 175.8078 24 V 4.6368 8.7203 113.9941 59.8301 35.8064 174.9092 25 Q 4.6443 8.4916 122.6227 53.4110 30.6266 172.1024 26 P 4.8889 0.0000 0.0000 62.1684 32.1020 176.4977 27 T 4.0596 8.5751 115.1878 61.2619 69.3360 172.9944 28 P 3.7440 0.0000 0.0000 66.5084 30.2659 177.8995 29 L 3.8975 7.7678 119.6360 57.8331 42.2985 178.3827 30 L 3.6972 7.6312 119.7490 57.6512 41.9885 178.6094 31 L 3.8875 8.6676 121.5134 58.4253 41.9925 179.0414 32 S 4.0984 7.7390 114.7478 61.5967 62.6959 176.5632 33 L 3.8279 7.3135 120.9456 57.8882 41.2306 179.7607 34 L 3.7840 7.4508 117.8736 57.7573 41.3061 179.4107 35 K 4.1926 7.8254 118.7210 58.9346 32.1620 178.5728 36 S 4.4062 8.6188 112.4368 60.0128 62.3302 175.1952 37 A 4.2307 7.9766 121.9260 52.3058 18.2581 177.5461 38 G 4.0126 7.1902 104.8902 45.1004 0.0000 174.1109 39 A 4.3899 8.5401 123.7874 51.3554 19.2681 176.9258 40 Q 4.5138 8.3454 117.3234 56.8168 31.3739 177.4983 41 K 3.8413 7.6778 116.8837 57.3231 32.7946 176.0986 42 E 4.3436 8.2895 116.6251 57.5523 30.1965 176.8814 43 T 4.7699 7.2033 113.7768 61.6213 71.1605 173.9756 44 F 5.1008 8.8377 122.8913 55.7475 43.6824 174.5338 45 T 4.4161 8.6528 111.5413 61.4254 70.0036 175.0442 46 M 3.5777 9.0125 122.3310 59.0004 32.0590 178.8039 47 K 3.9458 8.0071 119.0626 59.6326 32.5723 178.6047 48 E 4.0426 7.7815 118.5882 59.3492 29.4116 179.2422 49 V 3.4701 8.7207 119.0455 66.1513 31.2751 177.8797 50 L 4.0746 8.0261 119.5855 57.6939 41.5741 178.3714 51 Y 4.2298 7.7141 119.4150 61.3131 38.9140 177.1797 52 H 3.9786 8.1748 117.1593 58.3358 28.4294 177.6742 53 L 4.0709 8.0251 122.7278 58.1244 41.4603 179.2791 54 G 3.6654 7.7872 104.4216 47.9252 0.0000 175.6239 55 Q 4.0725 7.6969 119.7018 58.3254 28.6949 177.9254 56 Y 4.0622 8.0541 121.1816 60.4100 38.7385 177.9639 57 I 3.6610 7.7015 120.8852 64.6194 37.1743 178.2960 58 M 4.4914 7.6421 115.5613 58.3099 30.9066 178.2162 59 A 4.0675 7.7597 121.2173 55.0718 18.8825 179.6107 60 K 3.7092 7.8810 115.9516 56.7973 33.3769 176.1360 61 Q 2.8889 8.1060 119.6969 56.3901 26.3782 172.7404 62 L 4.4453 7.0678 116.6351 54.0524 43.5446 176.5609 63 Y 4.5081 6.7957 116.9303 56.2331 38.2669 174.5308 64 D 4.7123 8.9020 121.4392 53.6755 42.3062 177.2917 65 E 4.1134 8.9710 125.9317 59.7380 29.8929 178.5767 66 K 4.0871 8.5128 116.5766 58.7290 31.9046 177.1051 67 Q 4.6144 7.6392 113.7818 54.2827 30.3449 176.2997 68 Q 4.0723 8.7702 121.8892 58.1353 29.3941 176.1521 69 H 4.7749 8.1667 112.7674 55.6150 30.0117 174.4606 70 I 4.6520 7.4497 119.6588 59.6294 40.5879 174.7601 71 V 4.6448 8.2540 125.8240 60.2177 33.8336 174.0082 72 H 5.6689 8.7102 123.7065 52.8837 30.0807 172.8125 73 C 4.5787 8.5277 121.2833 58.0919 30.1021 174.4056 74 S 4.1770 8.9974 120.6030 61.2914 62.5872 175.3967 75 N 4.7228 7.7121 120.1119 51.9792 37.6285 173.7927 76 D 4.6137 7.8879 119.4315 51.3077 45.4053 173.7453 77 P 4.9733 0.0000 0.0000 64.5936 31.2682 178.8439 78 L 3.7051 8.7690 120.2687 57.8695 42.0576 178.9400 79 G 3.7608 8.1011 105.4813 47.2018 0.0000 175.2632 80 E 3.9752 8.1726 119.8511 58.8504 29.3744 178.8648 81 L 3.7601 7.0406 120.8865 58.1406 42.2808 178.7380 82 F 4.6063 7.5146 117.4433 58.5224 38.8628 176.3815 83 G 3.9133 8.8236 105.9677 45.8028 0.0000 173.0459 84 V 4.6593 7.6013 110.9661 59.6793 36.0530 175.9731 85 Q 4.5275 8.6867 118.3305 56.6030 30.4511 175.7262 86 E 5.4535 7.9356 113.9748 54.8125 32.8339 175.1456 87 F 4.9062 8.5248 115.3459 56.1269 41.5717 173.5117 88 S 4.5175 8.8508 119.0443 58.2593 63.6712 174.2080 89 V 4.2117 8.2378 116.2088 61.6575 31.2981 177.3586 90 K 4.0369 8.1506 124.0719 59.2080 32.7323 177.5781 91 E 4.3827 7.8635 119.9824 54.8650 28.1608 176.3253 92 H 4.2797 8.2247 119.9073 58.8309 28.8584 177.1635 93 R 3.9887 7.9814 117.6075 58.9890 29.3774 178.8618 94 R 3.8734 8.1413 119.5227 59.2749 30.2214 178.2281 95 I 3.3053 7.7453 119.0591 64.7649 36.8951 177.3788 96 Y 3.9443 7.9757 119.5670 60.8923 38.4436 178.2543 97 A 4.1233 7.8333 121.2739 55.3780 18.3790 178.9311 98 M 3.8811 8.2290 117.1452 58.4528 32.2077 178.3583 99 I 3.9840 7.9237 112.9232 64.3419 37.3609 178.0329 100 S 3.9381 7.6190 114.3721 61.4554 62.0020 176.5033 101 R 3.9614 7.7782 118.9516 58.4087 30.4097 177.2672 102 N 5.1063 8.1049 117.0496 52.2644 39.0566 175.0955 103 L 5.1017 7.1472 119.9734 52.9361 44.4686 177.4827 104 V 3.6960 8.4685 117.6777 64.1699 32.2103 177.1820 105 S 4.5608 8.1760 120.4845 56.6659 63.5384 172.1111 106 A 4.5867 8.4511 129.5320 50.2235 20.2482 175.8376 107 N 4.7989 8.4237 119.6960 52.9744 38.4585 175.5238 108 V 4.5416 8.0294 122.2171 58.9579 34.7057 175.7233 109 K 4.0942 8.5224 120.9303 56.2348 32.2248 176.9926 110 E 4.4653 8.4475 122.3019 54.5852 30.9002 175.0091 111 S 4.2939 8.4973 119.4333 57.6493 64.0030 174.0418 112 S 4.3672 8.5748 118.5875 57.6105 63.3810 173.0406 113 E 4.6351 8.6887 123.6959 54.2394 31.1642 174.8064 114 D 4.7710 8.6027 122.6767 52.3284 43.3160 175.8610 115 I 4.2929 7.9945 124.2168 60.1410 37.4318 175.2815 116 F 4.7948 8.5894 125.8928 57.0993 39.4467 176.1226 117 G 3.8409 8.2022 105.9986 46.8079 0.0000 174.2698 118 N 4.7016 8.3427 117.2957 52.0417 39.3784 176.0852 119 V 4.0211 8.3339 115.8501 61.4466 32.0915 175.6299 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 13 N 8.42 4.52 0.00 2.68 2.78 0.00 0.00 6.92 7.00 0.00 0.00 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 H 8.45 4.41 0.00 3.27 3.23 0.00 5.89 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 15 I 8.20 3.19 1.89 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 1.31 0.46 0.92 0.00 0.00 16 S 7.37 3.95 0.00 4.22 3.78 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 17 T 7.68 4.32 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 1.21 0.00 0.00 18 S 7.84 4.13 0.00 3.99 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 19 D 8.67 4.47 0.00 2.88 2.67 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 0.00 0.00 0.00 0.00 20 Q 8.66 4.07 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.86 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 21 E 7.93 4.63 0.00 1.91 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.47 0.00 22 K 8.00 4.30 0.00 1.77 1.86 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.79 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.43 7.81 23 L 8.22 5.00 0.00 1.55 1.53 0.91 0.85 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 24 V 8.72 4.64 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 1.03 0.00 0.00 1.02 0.00 0.00 25 Q 8.49 4.64 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.01 0.00 0.00 0.00 0.00 0.00 2.25 2.45 0.00 26 P 0.00 4.89 0.00 2.02 1.93 0.00 3.91 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 2.06 2.10 0.00 27 T 8.58 4.06 4.20 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 1.19 0.00 0.00 28 P 0.00 3.74 0.00 2.25 2.37 0.00 3.67 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 29 L 7.77 3.90 0.00 1.70 1.56 0.92 0.51 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 30 L 7.63 3.70 0.00 1.63 1.55 0.67 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.67 3.89 0.00 1.97 1.79 0.96 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 32 S 7.74 4.10 0.00 3.80 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 33 L 7.31 3.83 0.00 1.11 0.13 0.31 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 34 L 7.45 3.78 0.00 1.49 1.07 0.44 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 35 K 7.83 4.19 0.00 1.84 1.93 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.39 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.68 1.52 7.81 36 S 8.62 4.41 0.00 4.07 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 37 A 7.98 4.23 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 38 G 7.19 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 0.00 0.00 0.00 0.00 39 A 8.54 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.35 4.51 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.88 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 41 K 7.68 3.84 0.00 1.51 1.67 0.00 1.45 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.30 0.91 7.81 42 E 8.29 4.34 0.00 1.90 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 2.25 2.28 0.00 43 T 7.20 4.77 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 1.25 0.00 0.00 44 F 8.84 5.10 0.00 2.93 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 45 T 8.65 4.42 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 1.25 0.00 0.00 46 M 9.01 3.58 0.00 2.27 2.23 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.89 0.00 47 K 8.01 3.95 0.00 1.94 1.80 0.00 1.70 0.00 0.00 1.83 0.00 0.00 3.12 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.57 7.81 48 E 7.78 4.04 0.00 2.17 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 49 V 8.72 3.47 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 1.03 0.00 0.00 1.06 0.00 0.00 50 L 8.03 4.07 0.00 2.10 1.73 1.09 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.71 4.23 0.00 3.18 2.92 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 52 H 8.17 3.98 0.00 3.03 3.20 0.00 5.68 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 53 L 8.03 4.07 0.00 1.80 1.73 0.97 0.99 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 54 G 7.79 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 7.70 4.07 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.68 0.00 0.00 0.00 0.00 0.00 2.15 2.10 0.00 56 Y 8.05 4.06 0.00 3.13 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 57 I 7.70 3.66 2.11 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.02 1.04 0.00 0.00 58 M 7.64 4.49 0.00 2.22 2.28 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.61 0.00 59 A 7.76 4.07 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 60 K 7.88 3.71 0.00 1.22 1.54 0.00 1.29 0.00 0.00 0.61 0.00 0.00 3.09 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.44 1.14 7.81 61 Q 8.11 2.89 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.86 0.00 0.00 0.00 0.00 0.00 1.96 1.60 0.00 62 L 7.07 4.45 0.00 1.69 1.59 1.08 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 6.80 4.51 0.00 2.98 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 64 D 8.90 4.71 0.00 2.88 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 65 E 8.97 4.11 0.00 2.04 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 2.41 2.31 0.00 66 K 8.51 4.09 0.00 1.93 1.88 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.45 7.81 67 Q 7.64 4.61 0.00 2.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.81 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 68 Q 8.77 4.07 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.28 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 69 H 8.17 4.77 0.00 3.19 3.49 0.00 5.39 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 I 7.45 4.65 1.75 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.93 0.80 0.00 0.00 71 V 8.25 4.64 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 1.09 0.00 0.00 0.77 0.00 0.00 72 H 8.71 5.67 0.00 3.16 3.23 0.00 5.13 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 C 8.53 4.58 0.00 2.84 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 74 S 9.00 4.18 0.00 3.86 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 75 N 7.71 4.72 0.00 2.69 2.78 0.00 0.00 6.62 8.06 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 76 D 7.89 4.61 0.00 2.75 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 77 P 0.00 4.97 0.00 2.22 2.08 0.00 4.03 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.04 0.00 78 L 8.77 3.71 0.00 1.97 1.89 0.62 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.10 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 0.00 0.00 0.00 0.00 80 E 8.17 3.98 0.00 2.20 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 0.00 2.32 2.23 0.00 81 L 7.04 3.76 0.00 1.45 1.21 0.82 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 82 F 7.51 4.61 0.00 2.92 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 83 G 8.82 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 84 V 7.60 4.66 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 0.97 0.00 0.00 1.06 0.00 0.00 85 Q 8.69 4.53 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 7.01 0.00 0.00 0.00 0.00 0.00 2.40 2.29 0.00 86 E 7.94 5.45 0.00 1.94 1.93 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 2.23 2.36 0.00 87 F 8.52 4.91 0.00 3.09 3.16 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 0.00 0.00 0.00 88 S 8.85 4.52 0.00 3.82 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 89 V 8.24 4.21 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 0.66 0.00 0.00 0.98 0.00 0.00 90 K 8.15 4.04 0.00 1.74 1.84 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.42 7.81 91 E 7.86 4.38 0.00 2.08 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 2.40 2.29 0.00 92 H 8.22 4.28 0.00 3.18 3.37 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 7.98 3.99 0.00 2.04 2.18 0.00 2.96 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 94 R 8.14 3.87 0.00 2.02 1.93 0.00 3.08 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 95 I 7.75 3.31 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 1.51 1.00 0.82 0.00 0.00 96 Y 7.98 3.94 0.00 3.16 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 97 A 7.83 4.12 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 98 M 8.23 3.88 0.00 1.22 1.57 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 99 I 7.92 3.98 1.86 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.57 1.08 0.00 0.00 100 S 7.62 3.94 0.00 3.90 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 0.00 101 R 7.78 3.96 0.00 2.02 2.00 0.00 3.20 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.90 0.00 102 N 8.10 5.11 0.00 2.88 2.77 0.00 0.00 6.68 7.05 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 0.00 103 L 7.15 5.10 0.00 1.61 1.55 0.85 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.47 3.70 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 0.55 0.00 0.00 1.02 0.00 0.00 105 S 8.18 4.56 0.00 3.88 3.75 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 0.00 106 A 8.45 4.59 1.22 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 0.00 107 N 8.42 4.80 0.00 2.74 2.83 0.00 0.00 6.80 7.56 0.00 0.00 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 8.03 4.54 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 0.88 0.00 0.00 0.98 0.00 0.00 109 K 8.52 4.09 0.00 1.79 1.81 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.44 7.81 110 E 8.45 4.47 0.00 1.99 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 2.18 2.36 0.00 111 S 8.50 4.29 0.00 4.01 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 0.00 112 S 8.57 4.37 0.00 4.00 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 0.00 113 E 8.69 4.64 0.00 2.04 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 2.17 2.35 0.00 114 D 8.60 4.77 0.00 2.71 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 I 7.99 4.29 1.77 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.52 0.89 0.00 0.00 116 F 8.59 4.79 0.00 3.06 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 0.00 117 G 8.20 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 0.00 118 N 8.34 4.70 0.00 2.78 2.81 0.00 0.00 7.06 7.73 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 0.00 119 V 8.33 4.02 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 0.70 0.00 0.00 0.94 0.00 0.00