NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2516 8.2493 123.5806 51.8086 20.4757 176.5299 2 Q 4.4498 7.5606 110.9941 51.8560 31.1580 173.1746 3 S 4.1563 9.1756 113.4471 59.0912 63.9657 175.9986 4 V 4.2097 7.9075 114.8126 59.0814 33.8026 173.5203 5 P 4.3643 0.0000 0.0000 61.3639 31.8090 174.9820 6 P 4.4038 0.0000 0.0000 62.0764 29.9396 175.9453 7 G 3.7566 8.6701 113.0850 46.2469 0.0000 170.5478 8 D 4.9258 8.8942 123.8765 54.5920 41.4090 176.3643 9 I 4.2021 7.6303 118.3130 59.9851 38.2750 175.9261 10 N 4.5721 8.6379 124.7303 53.5735 39.5042 174.0261 11 T 4.9470 8.1650 111.0959 60.2656 72.9449 172.8644 12 Q 4.5622 8.8548 123.5213 53.4072 32.2893 173.1289 13 P 4.6166 0.0000 0.0000 62.8480 31.9391 176.2986 14 S 4.3787 8.1580 112.2626 59.4589 63.2031 173.5498 15 Q 4.7109 7.0303 117.1672 54.3810 29.3404 175.1360 16 K 4.3000 7.4350 114.1538 55.9673 36.2235 175.5594 17 I 4.1842 7.7106 126.0362 59.0734 40.9144 174.3246 18 V 4.1403 8.1182 130.1261 60.5462 31.9233 173.2288 19 F 3.5176 7.5876 125.9284 57.2895 39.2888 174.1860 20 N 4.8774 9.0077 120.7006 52.7170 39.2268 174.9288 21 A 3.6878 8.2628 125.2620 51.7802 19.2714 175.0335 22 P 4.3501 0.0000 0.0000 61.7384 33.5302 175.2476 23 Y 5.0855 7.9586 115.0454 58.2770 38.3151 176.6680 24 D 4.8278 8.0347 117.2935 54.1110 41.7260 174.8434 25 D 4.6052 7.6049 114.5674 53.4185 44.2234 174.6231 26 K 4.0896 8.8510 123.1175 56.9212 32.9649 175.8723 27 H 4.6091 8.8717 126.3523 54.8292 31.4160 173.7760 28 T 4.5770 8.2731 123.8742 62.5895 69.4765 174.1656 29 Y 4.3167 8.3341 125.4128 57.1741 39.3439 174.9800 30 H 5.6732 8.7472 122.1245 55.2605 29.8460 174.8990 31 I 4.6468 8.5270 122.9054 59.4366 40.9812 174.3781 32 K 4.7947 8.4466 123.5665 54.8232 34.4434 175.4733 33 I 5.1707 8.0781 124.5926 58.9212 41.3662 174.7649 34 T 4.9000 7.7502 119.4259 62.1797 73.5179 172.6584 35 N 4.3772 8.6661 123.8655 52.3177 39.5770 174.4761 36 A 4.2483 8.4537 129.3089 52.0345 19.1061 176.7224 37 G 4.2258 7.7076 109.4154 45.3952 0.0000 173.7891 38 G 3.8059 8.5492 106.1957 46.3286 0.0000 173.2657 39 R 4.8618 7.4777 116.7297 53.5122 33.8256 175.1498 40 R 4.9876 8.5669 116.5134 56.5807 31.2243 175.4632 41 I 4.7362 8.1697 111.3632 59.6886 41.3199 173.9444 42 G 4.7459 9.0517 113.9262 45.2749 0.0000 172.5834 43 W 6.3000 9.4987 123.2022 54.1491 31.7582 174.5332 44 A 4.8380 8.8954 120.7769 50.6731 22.3226 174.9828 45 I 5.6091 8.0048 119.7938 59.0293 40.5519 175.7200 46 K 4.7759 8.4732 123.0307 55.3260 36.2683 175.2518 47 T 5.1760 8.4986 114.3012 59.6573 72.0049 174.7426 48 T 3.7723 8.1390 112.8654 64.6069 69.6481 173.6961 49 N 4.7692 7.9729 118.9431 52.0440 41.6813 174.1234 50 M 4.7906 8.7680 122.5050 55.4541 32.3591 176.7160 51 R 4.4310 7.8745 118.0318 58.1760 31.7638 177.8618 52 R 4.1071 7.9576 116.1073 59.1697 30.9085 176.8043 53 L 4.7211 7.2946 117.3232 53.9605 43.4759 177.0194 54 S 4.4835 8.6910 115.7297 57.0221 65.7803 173.0790 55 V 5.2560 8.3418 118.5919 59.0580 33.2564 175.4547 56 D 5.0391 8.4738 124.7564 51.7879 45.4162 173.2056 57 P 4.6449 0.0000 0.0000 61.7054 32.5636 174.5990 58 P 4.3188 0.0000 0.0000 65.1892 31.5314 175.7157 59 C 4.5846 6.3191 111.1939 54.6312 32.8064 173.1111 60 G 3.8091 6.6989 105.9010 46.1329 0.0000 171.8998 61 V 4.8936 8.5628 119.7147 61.0967 33.0111 175.2393 62 L 4.5706 9.0542 128.5981 54.7973 43.4414 176.1001 63 D 5.1558 8.3868 120.0827 51.6697 44.5055 173.6107 64 P 4.0942 0.0000 0.0000 63.0904 31.7074 176.5017 65 K 3.8868 8.3967 127.5510 57.3543 31.3348 174.5765 66 E 4.6485 7.9350 117.3591 54.3545 31.7196 174.4861 67 K 5.1009 8.5279 125.0872 54.9485 34.4354 176.0676 68 V 4.6042 8.3775 122.0897 60.1852 35.1755 173.8943 69 L 5.1028 8.5594 121.8486 53.5231 43.8267 175.3598 70 M 5.0100 8.7222 121.1401 53.7097 36.3745 174.2563 71 A 4.8873 8.7471 123.8558 50.3894 22.3596 175.4770 72 V 4.5501 8.4269 123.2839 60.3253 32.1380 174.8332 73 S 4.9713 8.9833 123.6636 58.0246 64.2502 172.3951 74 C 4.8046 8.3692 119.6605 56.1573 31.8587 172.8301 75 D 4.7688 8.3436 123.6804 54.6806 41.1315 177.1618 76 T 4.4816 8.7289 112.0530 62.5610 69.6887 172.6873 77 F 4.6218 7.4797 115.4721 57.3517 41.9424 172.4257 78 N 4.6029 8.5395 117.2349 52.0972 39.2876 174.0437 79 A 4.6178 8.2188 125.4956 52.0164 19.0780 177.5530 80 A 4.3475 7.8910 123.1591 55.4739 19.2495 179.0858 81 T 4.7834 7.4857 106.2232 60.3721 68.7041 173.9140 82 E 4.6619 8.0315 119.9410 55.3233 33.6150 175.5580 83 D 4.4826 8.7558 123.6066 53.6531 40.3517 176.7165 84 L 4.6924 8.0675 121.4241 52.3991 41.7800 176.6447 85 N 4.9307 7.6985 114.5241 53.5200 39.7491 174.0464 86 N 4.9619 8.2932 110.1431 52.1112 40.8123 173.5401 87 D 4.9947 8.2846 119.9857 52.2043 42.6743 175.6441 88 R 4.9854 8.3919 119.4679 54.8023 33.2139 174.6050 89 I 4.8179 8.4242 122.9339 60.4808 40.3786 174.7203 90 T 4.9846 8.7024 119.2719 62.1608 72.7606 173.2798 91 I 5.1756 8.8762 127.5709 59.6486 40.0610 174.4828 92 E 5.7849 9.1899 125.1555 54.6731 33.2740 174.9513 93 W 6.3000 8.4378 116.1323 56.7220 32.2536 173.2366 94 T 4.6766 8.5069 115.8877 59.8320 70.5180 172.3888 95 N 4.7623 8.8977 126.0847 53.6868 37.3747 174.8771 96 T 3.1557 7.6881 113.1658 60.2240 69.7451 172.5980 97 P 4.2965 0.0000 0.0000 61.9986 32.1909 175.0645 98 D 4.3591 8.7343 118.4152 55.9467 40.9847 177.6109 99 G 3.9087 8.8406 114.5686 45.8338 0.0000 172.3221 100 A 4.1665 7.6818 119.8613 51.8036 19.2373 177.8039 101 A 4.4203 8.5532 122.2033 52.0046 19.6264 178.8188 102 K 4.4430 8.2020 120.4472 53.1014 30.6387 176.4996 103 Q 4.7930 7.7830 117.0012 55.0434 32.5424 173.8538 104 F 3.7157 9.1559 125.4028 58.7348 39.7046 174.1220 105 R 4.0726 5.8400 126.7210 53.9038 32.5830 176.1156 106 R 3.6404 7.8489 121.8028 58.3949 30.3231 178.2070 107 E 4.0385 7.7656 118.5961 58.7410 29.4496 178.0934 108 W 4.6145 7.4151 117.5285 58.7986 29.0975 177.1180 109 F 4.6173 8.4225 116.4006 57.4796 39.5220 176.1449 110 Q 4.8432 7.9710 116.9088 55.7353 30.0203 176.2925 111 G 4.2050 7.8759 108.4687 45.7531 0.0000 173.2635 112 D 4.5981 8.5914 123.9078 54.0181 42.6887 176.4401 113 G 3.8101 8.9193 109.7332 44.1925 0.0000 172.2745 114 M 4.7381 8.0161 114.3422 53.1670 34.1615 174.4331 115 V 4.0280 7.9788 119.5157 61.0767 34.0396 174.7057 116 R 4.2479 7.2945 126.9667 55.1330 32.1715 174.8032 117 R 5.2468 7.8847 121.8155 55.5168 33.3991 174.1729 118 K 4.7681 9.0599 124.2559 55.1147 36.8805 174.8399 119 N 5.7618 8.8195 122.0094 51.7291 40.2868 174.3926 120 L 4.6708 8.3631 123.5142 52.2589 43.8598 174.0716 121 P 4.5790 0.0000 0.0000 62.9915 32.2828 175.6276 122 I 4.2141 7.9436 124.6241 60.3405 38.6942 174.8946 123 E 4.7487 7.8730 123.0913 55.0008 34.5934 174.2548 124 Y 5.5315 8.5336 117.6777 55.5620 41.1988 174.3044 125 N 4.9374 9.1596 124.0380 51.9418 41.1288 175.1392 126 L 4.1652 8.4934 124.5585 54.8922 42.0423 176.2587 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 A 8.25 4.25 1.30 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 0.00 0.00 0.00 2 Q 7.56 4.45 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.88 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 3 S 9.18 4.16 0.00 3.97 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 4 V 7.91 4.21 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 0.71 0.00 0.00 0.90 0.00 0.00 5 P 0.00 4.36 0.00 2.16 2.04 0.00 3.76 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 1.99 1.94 0.00 6 P 0.00 4.40 0.00 2.04 2.03 0.00 3.73 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 1.83 1.95 0.00 7 G 8.67 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 8 D 8.89 4.93 0.00 2.62 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 9 I 7.63 4.20 1.29 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 -0.30 -0.17 0.27 0.00 0.00 10 N 8.64 4.57 0.00 2.55 2.67 0.00 0.00 6.55 7.01 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 11 T 8.16 4.95 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 0.99 0.00 0.00 12 Q 8.85 4.56 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.88 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 13 P 0.00 4.62 0.00 2.13 2.08 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 14 S 8.16 4.38 0.00 3.94 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 0.00 15 Q 7.03 4.71 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.82 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 16 K 7.44 4.30 0.00 1.59 1.64 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.69 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.12 1.20 7.81 17 I 7.71 4.18 1.70 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 0.50 1.31 0.42 0.00 0.00 18 V 8.12 4.14 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 0.95 0.00 0.00 0.83 0.00 0.00 19 F 7.59 3.52 0.00 2.89 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 20 N 9.01 4.88 0.00 2.83 2.86 0.00 0.00 7.23 7.40 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 21 A 8.26 3.69 1.05 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 0.00 0.00 22 P 0.00 4.35 0.00 2.02 1.98 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 23 Y 7.96 5.09 0.00 2.75 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 24 D 8.03 4.83 0.00 2.62 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 25 D 7.60 4.61 0.00 2.65 2.44 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 26 K 8.85 4.09 0.00 1.67 1.80 0.00 1.83 0.00 0.00 2.46 0.00 0.00 2.69 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.32 7.81 27 H 8.87 4.61 0.00 3.18 3.08 0.00 5.66 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.27 4.58 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 1.14 0.00 0.00 29 Y 8.33 4.32 0.00 3.02 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 30 H 8.75 5.67 0.00 3.08 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 8.53 4.65 1.89 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 1.42 1.39 0.92 0.00 0.00 32 K 8.45 4.79 0.00 1.77 1.70 0.00 1.50 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.40 7.81 33 I 8.08 5.17 1.48 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.79 0.36 0.00 0.00 34 T 7.75 4.90 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 1.14 0.00 0.00 35 N 8.67 4.38 0.00 2.72 2.90 0.00 0.00 7.21 8.44 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 36 A 8.45 4.25 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 37 G 7.71 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 0.00 0.00 0.00 0.00 38 G 8.55 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 39 R 7.48 4.86 0.00 1.62 1.80 0.00 3.19 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 40 R 8.57 4.99 0.00 2.00 2.07 0.00 3.08 0.00 0.00 3.35 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.33 0.00 41 I 8.17 4.74 2.20 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 1.40 0.75 1.10 0.00 0.00 42 G 9.05 4.75 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 43 W 9.50 6.30 0.00 3.87 3.46 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 44 A 8.90 4.84 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 45 I 8.00 5.61 1.95 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.97 1.06 0.00 0.00 46 K 8.47 4.78 0.00 1.70 1.66 0.00 1.61 0.00 0.00 1.88 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.47 7.81 47 T 8.50 5.18 4.28 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 1.26 0.00 0.00 48 T 8.14 3.77 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 1.25 0.00 0.00 49 N 7.97 4.77 0.00 2.72 2.69 0.00 0.00 6.88 7.53 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 50 M 8.77 4.79 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 51 R 7.87 4.43 0.00 1.76 1.93 0.00 3.36 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 52 R 7.96 4.11 0.00 1.69 1.90 0.00 3.19 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 53 L 7.29 4.72 0.00 1.55 1.61 1.07 0.90 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 54 S 8.69 4.48 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 55 V 8.34 5.26 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 1.16 0.00 0.00 0.96 0.00 0.00 56 D 8.47 5.04 0.00 2.55 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 57 P 0.00 4.64 0.00 2.06 2.05 0.00 3.96 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.08 0.00 58 P 0.00 4.32 0.00 2.04 2.25 0.00 3.52 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.85 0.00 59 C 6.32 4.58 0.00 1.75 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 0.00 0.00 0.00 0.00 60 G 6.70 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 61 V 8.56 4.89 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 0.97 0.00 0.00 1.28 0.00 0.00 62 L 9.05 4.57 0.00 1.89 1.62 1.12 0.71 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 63 D 8.39 5.16 0.00 2.90 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 64 P 0.00 4.09 0.00 1.93 2.20 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 65 K 8.40 3.89 0.00 1.89 1.87 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.33 7.81 66 E 7.94 4.65 0.00 2.12 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 2.25 2.28 0.00 67 K 8.53 5.10 0.00 1.65 1.66 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.39 7.81 68 V 8.38 4.60 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 0.55 0.00 0.00 1.08 0.00 0.00 69 L 8.56 5.10 0.00 1.55 1.64 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 70 M 8.72 5.01 0.00 2.16 1.90 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.58 0.00 71 A 8.75 4.89 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 72 V 8.43 4.55 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 0.99 0.00 0.00 0.96 0.00 0.00 73 S 8.98 4.97 0.00 3.95 3.74 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 0.00 0.00 0.00 74 C 8.37 4.80 0.00 2.98 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 75 D 8.34 4.77 0.00 2.62 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 76 T 8.73 4.48 4.52 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 1.31 0.00 0.00 77 F 7.48 4.62 0.00 2.96 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 78 N 8.54 4.60 0.00 2.92 2.79 0.00 0.00 6.93 7.23 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 79 A 8.22 4.62 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 80 A 7.89 4.35 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 81 T 7.49 4.78 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 1.22 0.00 0.00 82 E 8.03 4.66 0.00 2.10 1.84 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 2.23 2.47 0.00 83 D 8.76 4.48 0.00 2.77 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 84 L 8.07 4.69 0.00 1.63 1.62 0.90 -0.16 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 85 N 7.70 4.93 0.00 2.63 2.73 0.00 0.00 7.09 7.80 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 86 N 8.29 4.96 0.00 2.68 2.75 0.00 0.00 7.09 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 87 D 8.28 4.99 0.00 2.77 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 88 R 8.39 4.99 0.00 1.83 1.97 0.00 2.96 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 89 I 8.42 4.82 1.91 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 1.29 0.88 1.04 0.00 0.00 90 T 8.70 4.98 4.39 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 91 I 8.88 5.18 2.00 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 1.32 1.27 1.00 0.00 0.00 92 E 9.19 5.78 0.00 2.35 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 2.43 2.62 0.00 93 W 8.44 6.30 0.00 3.67 3.51 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 94 T 8.51 4.68 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 0.52 0.00 0.00 95 N 8.90 4.76 0.00 2.65 2.80 0.00 0.00 6.16 7.63 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 96 T 7.69 3.16 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 0.35 0.00 0.00 97 P 0.00 4.30 0.00 2.25 2.22 0.00 2.60 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 98 D 8.73 4.36 0.00 2.65 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.84 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 0.00 100 A 7.68 4.17 1.23 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 0.00 0.00 101 A 8.55 4.42 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 0.00 102 K 8.20 4.44 0.00 1.82 1.85 0.00 1.90 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.51 7.81 103 Q 7.78 4.79 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.84 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 104 F 9.16 3.72 0.00 2.99 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 0.00 105 R 5.84 4.07 0.00 0.67 0.66 0.00 2.98 0.00 0.00 2.97 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.19 0.00 106 R 7.85 3.64 0.00 1.78 1.77 0.00 3.17 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 107 E 7.77 4.04 0.00 1.94 1.94 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 2.39 2.37 0.00 108 W 7.42 4.61 0.00 3.68 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 0.00 109 F 8.42 4.62 0.00 3.09 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 0.00 110 Q 7.97 4.84 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.64 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 111 G 7.88 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 0.00 0.00 0.00 0.00 112 D 8.59 4.60 0.00 2.64 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 0.00 113 G 8.92 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 0.00 114 M 8.02 4.74 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 115 V 7.98 4.03 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 0.20 0.00 0.00 0.55 0.00 0.00 116 R 7.29 4.25 0.00 1.15 0.66 0.00 3.02 0.00 0.00 2.95 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.17 0.00 117 R 7.88 5.25 0.00 1.87 1.76 0.00 3.32 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 118 K 9.06 4.77 0.00 1.91 1.72 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.66 7.81 119 N 8.82 5.76 0.00 2.63 2.85 0.00 0.00 7.44 7.91 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 0.00 120 L 8.36 4.67 0.00 1.64 1.55 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.58 0.00 2.05 2.16 0.00 3.60 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.96 0.00 122 I 7.94 4.21 1.91 0.00 0.00 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 1.31 0.85 0.20 0.00 0.00 123 E 7.87 4.75 0.00 1.80 1.63 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 2.19 2.22 0.00 124 Y 8.53 5.53 0.00 2.95 3.29 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 0.00 125 N 9.16 4.94 0.00 2.95 2.80 0.00 0.00 6.96 6.60 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 0.00 126 L 8.49 4.17 0.00 1.67 1.51 0.98 1.06 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