NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 S 4.3265 8.3301 115.2878 57.4490 63.6047 172.9214 7 A 3.8955 8.2822 125.8188 49.4715 18.5432 175.0309 8 P 4.3577 0.0000 0.0000 62.7368 32.9099 174.0399 9 A 4.6863 8.0183 121.4154 50.6763 22.0978 175.8057 10 I 4.0592 8.6613 122.9904 61.5402 38.6538 174.9070 11 A 4.9920 8.5896 128.0776 50.5268 21.0529 175.7842 12 I 4.9599 8.7114 123.1538 59.3947 40.7036 174.4656 13 A 4.9170 9.4070 130.3829 50.5221 20.7512 175.7874 14 V 4.4121 8.6423 124.0333 62.0647 32.8429 174.6667 15 I 4.8274 8.7960 129.7980 60.1407 39.5530 175.7194 16 D 4.1532 9.3661 124.9351 55.2086 40.1323 173.4087 17 G 4.0104 8.2109 101.7294 46.4458 0.0000 174.4550 18 C 4.5098 8.1425 110.9547 58.1058 30.1041 175.1274 19 D 4.3813 7.8863 119.9726 58.6447 40.6863 178.7480 20 G 3.9256 7.8591 106.4375 46.6441 0.0000 174.1225 21 L 3.9910 8.0422 120.1886 56.0106 42.0039 177.6677 22 W 4.9709 7.7613 118.6271 56.0051 30.2092 177.2909 23 R 3.9430 8.4334 121.1181 60.1328 29.2516 177.9159 24 E 4.1065 8.2276 117.2605 58.8778 29.5533 179.3810 25 V 3.7302 7.9092 118.7646 66.0948 31.6509 178.0452 26 L 3.6271 7.8643 118.1936 57.6912 41.3534 179.4165 27 L 4.2245 8.1410 119.2033 57.6956 41.2501 179.7681 28 G 3.6038 8.2166 105.8093 47.6462 0.0000 175.9672 29 I 3.9169 7.6738 121.6889 64.2982 37.1637 177.9584 30 E 4.0880 8.2466 119.8659 59.2498 29.2939 178.3586 31 E 3.9640 8.3401 118.7301 59.1940 29.8004 177.9177 32 E 4.3337 7.8089 115.6743 56.6590 29.7071 177.4792 33 G 3.9435 8.2709 107.7336 45.3164 0.0000 172.9289 34 I 4.6817 7.2955 119.3497 58.3531 39.1684 174.1887 35 P 4.5901 0.0000 0.0000 63.0067 32.6442 174.9811 36 F 5.5526 7.8049 114.9044 55.8341 41.3814 173.4877 37 R 4.8549 9.2040 117.5799 54.5081 34.3425 174.2361 38 L 5.2730 8.6831 121.5252 53.0751 44.1971 175.5881 39 Q 4.5950 8.9981 124.2927 54.6050 32.1650 173.5042 40 H 5.1791 8.8554 123.2053 54.9443 30.5748 174.2356 41 H 5.0353 9.1316 119.8392 53.2791 31.8911 172.9070 42 P 4.4174 0.0000 0.0000 65.3052 31.8121 175.9401 43 A 4.7305 8.5543 120.3981 49.7112 22.4651 173.8787 44 G 4.2292 8.1603 107.7995 43.8836 0.0000 173.1383 45 E 4.2086 8.1813 123.1801 55.2596 31.4514 177.9162 46 V 3.5625 8.3031 125.6161 66.1046 31.7973 178.4993 47 V 3.5828 8.0544 117.4627 66.1343 31.4518 177.3635 48 D 4.4551 8.5748 117.8574 57.4056 40.9731 178.2900 49 S 4.1104 8.2732 115.5603 61.5182 62.7950 176.4648 50 A 3.9940 8.3832 123.7798 54.9274 18.0943 179.5345 51 W 3.9812 8.2528 126.8364 60.7719 30.6979 178.2934 52 Q 3.6976 8.6105 118.1544 58.6784 28.0597 178.6236 53 A 3.9304 8.2640 121.8798 55.1247 17.9852 179.5818 54 A 3.8769 8.0037 119.3449 55.3208 18.2071 180.1212 55 R 3.6486 7.5366 115.9935 58.9303 30.0583 178.9116 56 S 4.2432 7.3894 112.8795 59.3595 63.8189 174.7532 57 S 4.2573 7.2919 118.3449 57.1649 62.5786 172.8678 58 P 4.3468 0.0000 0.0000 64.5551 31.3283 176.6670 59 L 4.4171 8.1384 118.9361 54.0481 42.0270 177.4999 60 L 3.8586 8.1219 117.6643 54.5655 40.2715 173.4501 61 V 4.9344 7.4875 118.5179 61.1030 33.9603 174.7666 62 G 4.5770 9.1445 113.8084 44.5609 0.0000 171.2877 63 I 5.6968 9.2358 120.9679 58.1026 41.3777 174.5068 64 A 5.3359 8.3993 126.4541 50.4893 22.9255 174.4390 65 C 4.8735 8.7477 113.6028 57.1399 33.2137 173.2842 66 D 5.3406 8.2727 120.7769 51.5211 41.0370 175.9425 67 R 4.2341 8.6734 116.6162 58.4294 30.5778 176.4411 68 H 5.1208 9.2316 114.7120 56.2252 32.4120 173.3615 69 M 5.4343 8.5978 116.2723 53.6340 36.1537 173.6867 70 L 4.7206 8.8645 126.4315 52.9326 45.6107 175.1292 71 V 4.7942 8.6994 125.3499 61.0088 35.1161 174.0521 72 V 4.7362 8.6004 127.1063 61.5659 33.5862 173.9632 73 H 5.3087 9.5746 127.1582 54.5408 34.1490 171.2306 74 Y 5.3936 8.6671 120.6173 55.6084 41.6008 175.7055 75 K 3.5953 8.3741 127.7431 59.3043 32.3290 177.3019 76 N 4.6305 7.0798 113.3166 53.8297 39.1327 175.3039 77 L 4.4387 7.7509 118.7039 53.3110 42.6225 175.0573 78 P 4.2787 0.0000 0.0000 62.2703 32.0638 177.1811 79 A 2.5800 7.7830 123.8226 54.6854 17.9719 178.6177 80 S 4.3839 7.5887 106.6176 58.4159 63.6777 174.4979 81 A 4.5147 7.5782 125.0521 49.3586 18.3162 174.1149 82 P 3.9763 0.0000 0.0000 61.8463 32.7047 177.6979 83 L 3.8304 8.0869 121.1772 57.5317 42.1920 176.8796 84 F 5.1972 7.6266 115.9152 55.9006 43.4121 173.7834 85 T 4.9962 8.5792 117.1668 61.7197 72.0820 172.9929 86 L 4.8754 9.0077 128.0562 53.5326 45.2682 175.0291 87 M 4.9271 9.0103 126.0890 54.4626 33.1617 177.1997 88 H 4.0384 9.4481 123.4184 59.3408 30.1374 176.0825 89 H 4.4337 7.9795 112.5951 56.7292 28.8644 175.6000 90 Q 4.1691 7.7088 119.9984 55.6659 29.3067 176.1792 91 D 4.6204 8.3019 120.8296 52.8286 42.0353 177.2467 92 S 3.9924 8.3726 112.7690 61.4461 62.1792 175.5975 93 Q 3.9809 8.0857 121.7929 58.9361 28.9164 177.7820 94 A 3.9818 8.5375 122.0736 55.0929 18.4269 179.3501 95 H 4.1012 8.2602 114.7289 59.1037 28.7752 177.9417 96 R 4.1351 8.0589 120.3554 59.7192 29.9323 178.3320 97 N 4.5530 8.3383 117.7003 55.9188 38.4490 177.6065 98 T 3.6714 7.8726 117.4212 66.3576 68.4407 176.8799 99 G 4.0027 7.8605 108.8124 47.3936 0.0000 175.1660 100 N 4.4767 8.3512 119.5552 56.5151 38.6234 177.2306 101 N 4.7424 8.2672 117.1775 55.9391 38.5773 177.4374 102 A 4.1641 8.2066 122.3435 55.1326 18.4506 179.5715 103 A 4.1477 7.9926 119.0581 55.4114 18.4866 180.1497 104 R 3.9868 8.5025 116.7378 58.9539 29.8253 178.9961 105 L 4.0114 8.0777 119.9576 58.1470 42.1797 178.8678 106 V 3.7960 7.3139 115.6406 65.9607 31.6398 177.7266 107 K 4.2132 8.0262 116.0639 56.2020 32.8184 176.6673 108 G 3.7507 8.2065 107.1143 46.7598 0.0000 173.4215 109 I 4.5369 7.1456 109.6798 57.4393 40.9251 173.5585 110 P 3.9808 0.0000 0.0000 63.0808 31.6574 176.4790 111 F 4.7107 8.1796 120.5781 57.4880 39.6373 175.1310 112 R 4.2439 9.4076 124.5813 56.4887 31.0624 175.9869 113 D 4.8105 8.6177 121.0965 54.7573 41.9680 173.6716 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 6 S 8.33 4.33 0.00 3.83 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 7 A 8.28 3.90 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 8 P 0.00 4.36 0.00 2.20 2.09 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 9 A 8.02 4.69 1.21 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 10 I 8.66 4.06 2.02 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 1.25 0.81 1.00 0.00 0.00 11 A 8.59 4.99 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 12 I 8.71 4.96 1.98 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.83 0.86 0.00 0.00 13 A 9.41 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 14 V 8.64 4.41 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 1.10 0.00 0.00 0.88 0.00 0.00 15 I 8.80 4.83 2.03 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 1.16 1.10 0.97 0.00 0.00 16 D 9.37 4.15 0.00 2.83 2.76 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 17 G 8.21 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 18 C 8.14 4.51 0.00 3.28 3.27 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 19 D 7.89 4.38 0.00 2.87 2.81 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 20 G 7.86 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 0.00 0.00 0.00 21 L 8.04 3.99 0.00 1.13 0.74 0.86 0.47 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 22 W 7.76 4.97 0.00 3.31 3.08 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 23 R 8.43 3.94 0.00 1.90 1.97 0.00 3.20 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 24 E 8.23 4.11 0.00 2.09 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 2.40 2.29 0.00 25 V 7.91 3.73 2.29 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 0.94 0.00 0.00 1.10 0.00 0.00 26 L 7.86 3.63 0.00 1.86 1.53 0.95 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.14 4.22 0.00 1.88 1.76 1.04 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.22 3.60 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 0.00 0.00 0.00 29 I 7.67 3.92 2.03 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 1.67 1.05 1.15 0.00 0.00 30 E 8.25 4.09 0.00 2.30 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 2.37 2.37 0.00 31 E 8.34 3.96 0.00 2.07 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 2.35 2.42 0.00 32 E 7.81 4.33 0.00 2.18 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 2.47 2.67 0.00 33 G 8.27 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 34 I 7.30 4.68 1.97 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.16 0.99 0.00 0.00 35 P 0.00 4.59 0.00 2.16 2.13 0.00 3.71 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 2.16 1.95 0.00 36 F 7.80 5.55 0.00 3.08 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 37 R 9.20 4.85 0.00 1.76 1.84 0.00 3.19 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 38 L 8.68 5.27 0.00 1.59 1.56 1.06 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 39 Q 9.00 4.59 0.00 2.12 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.85 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 40 H 8.86 5.18 0.00 3.02 3.23 0.00 5.89 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 9.13 5.04 0.00 3.03 3.14 0.00 5.62 0.00 0.00 0.00 0.00 6.69 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 4.42 0.00 2.10 2.21 0.00 3.78 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 2.02 2.01 0.00 43 A 8.55 4.73 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 44 G 8.16 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 45 E 8.18 4.21 0.00 2.03 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 2.38 2.31 0.00 46 V 8.30 3.56 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 1.05 0.00 0.00 0.95 0.00 0.00 47 V 8.05 3.58 2.34 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 1.00 0.00 0.00 0.91 0.00 0.00 48 D 8.57 4.46 0.00 2.86 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 49 S 8.27 4.11 0.00 4.12 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 50 A 8.38 3.99 1.45 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 51 W 8.25 3.98 0.00 3.23 3.36 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 52 Q 8.61 3.70 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.74 2.56 0.00 53 A 8.26 3.93 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 54 A 8.00 3.88 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 55 R 7.54 3.65 0.00 1.53 1.62 0.00 2.21 0.00 0.00 2.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.65 0.00 56 S 7.39 4.24 0.00 3.93 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 57 S 7.29 4.26 0.00 3.90 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 58 P 0.00 4.35 0.00 2.21 2.14 0.00 3.94 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.05 0.00 59 L 8.14 4.42 0.00 1.78 1.78 1.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.12 3.86 0.00 1.91 1.38 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.49 4.93 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 1.11 0.00 0.00 1.24 0.00 0.00 62 G 9.14 4.58 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 63 I 9.24 5.70 1.79 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.92 0.79 0.00 0.00 64 A 8.40 5.34 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 65 C 8.75 4.87 0.00 1.98 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 0.00 0.00 0.00 0.00 66 D 8.27 5.34 0.00 2.80 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 67 R 8.67 4.23 0.00 1.61 1.86 0.00 3.20 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 68 H 9.23 5.12 0.00 3.13 3.35 0.00 5.56 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 M 8.60 5.43 0.00 2.07 1.91 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.47 0.00 70 L 8.86 4.72 0.00 0.27 0.40 0.18 0.53 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 71 V 8.70 4.79 2.03 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 0.89 0.00 0.00 0.87 0.00 0.00 72 V 8.60 4.74 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 0.95 0.00 0.00 0.99 0.00 0.00 73 H 9.57 5.31 0.00 3.23 3.19 0.00 5.58 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 8.67 5.39 0.00 2.95 2.81 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 75 K 8.37 3.60 0.00 1.59 1.40 0.00 1.61 0.00 0.00 1.51 0.00 0.00 2.64 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.23 1.08 7.81 76 N 7.08 4.63 0.00 2.70 2.90 0.00 0.00 6.94 7.85 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 77 L 7.75 4.44 0.00 2.07 1.85 1.02 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.28 0.00 2.09 2.10 0.00 3.74 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 2.02 1.93 0.00 79 A 7.78 2.58 -0.12 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 80 S 7.59 4.38 0.00 3.89 3.83 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 81 A 7.58 4.51 1.17 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 82 P 0.00 3.98 0.00 2.01 1.78 0.00 3.72 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.86 0.00 83 L 8.09 3.83 0.00 1.35 1.38 0.42 0.17 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 84 F 7.63 5.20 0.00 2.87 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 85 T 8.58 5.00 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 86 L 9.01 4.88 0.00 1.63 1.48 1.01 0.76 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 87 M 9.01 4.93 0.00 1.91 1.75 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.64 0.00 88 H 9.45 4.04 0.00 2.93 3.31 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 H 7.98 4.43 0.00 3.26 3.45 0.00 5.78 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 7.71 4.17 0.00 2.26 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 91 D 8.30 4.62 0.00 2.91 2.81 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 92 S 8.37 3.99 0.00 3.84 3.86 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 93 Q 8.09 3.98 0.00 2.19 2.07 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 2.42 2.47 0.00 94 A 8.54 3.98 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 95 H 8.26 4.10 0.00 3.43 3.44 0.00 5.65 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 96 R 8.06 4.14 0.00 1.95 2.07 0.00 3.16 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 97 N 8.34 4.55 0.00 2.74 2.77 0.00 0.00 6.58 7.72 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 98 T 7.87 3.67 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 1.09 0.00 0.00 99 G 7.86 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 0.00 100 N 8.35 4.48 0.00 2.96 2.93 0.00 0.00 7.10 7.69 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 0.00 101 N 8.27 4.74 0.00 2.48 2.47 0.00 0.00 6.95 7.15 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 0.00 102 A 8.21 4.16 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 0.00 103 A 7.99 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 104 R 8.50 3.99 0.00 2.21 2.21 0.00 3.42 0.00 0.00 3.35 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.96 0.00 105 L 8.08 4.01 0.00 2.11 2.10 0.73 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.31 3.80 2.33 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 0.94 0.00 0.00 1.02 0.00 0.00 107 K 8.03 4.21 0.00 1.79 1.85 0.00 1.88 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.49 1.67 7.81 108 G 8.21 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 0.00 0.00 0.00 109 I 7.15 4.54 1.82 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 1.38 0.73 0.88 0.00 0.00 110 P 0.00 3.98 0.00 2.02 2.01 0.00 3.61 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 1.99 2.06 0.00 111 F 8.18 4.71 0.00 3.14 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 0.00 112 R 9.41 4.24 0.00 1.75 1.93 0.00 3.46 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 113 D 8.62 4.81 0.00 2.83 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