NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.5932 8.4293 116.1342 55.0011 30.5114 173.3910 2 C 4.2377 7.9206 114.2674 57.4189 30.8367 172.0361 3 D 4.9068 8.4233 118.6896 54.5190 39.8738 177.0881 4 L 4.1519 8.0048 120.6709 56.9647 42.6523 175.2124 5 P 4.5468 0.0000 0.0000 62.7150 31.9544 175.6880 6 C 4.2478 8.6009 114.6375 57.9122 30.5541 174.3652 7 G 4.0243 8.1897 107.5601 46.1930 0.0000 173.3699 8 V 4.1866 7.2760 119.1398 59.4863 32.0443 174.9453 9 F 4.7091 8.2587 122.3945 55.7484 43.0177 174.3472 10 D 3.7120 7.9753 120.9511 51.5885 43.6540 174.4059 11 P 4.1955 0.0000 0.0000 64.2962 31.1767 178.0547 12 A 4.0159 8.4618 120.7107 55.0274 17.9722 179.6881 13 Q 3.7914 8.0571 116.6196 59.0377 28.6833 178.7866 14 A 4.0485 7.8144 121.2698 54.9888 18.5055 179.2537 15 R 3.8345 8.1073 117.3060 59.8181 30.1716 178.7331 16 I 3.6990 7.9548 119.5101 64.5224 37.1174 178.3096 17 E 3.9895 7.9701 119.0398 59.4446 29.2899 179.3732 18 A 4.0726 8.3395 120.9252 55.0058 18.3042 179.5138 19 E 3.9495 8.8468 117.6662 59.7101 29.4621 179.6614 20 S 4.1071 8.1730 115.1981 61.4360 62.8457 176.7910 21 V 3.5566 7.7070 120.9240 66.0615 31.2590 178.0737 22 K 4.1283 8.1249 119.0052 59.3797 32.0512 178.5731 23 A 3.9905 8.3081 121.4161 55.1083 18.2493 179.7053 24 V 3.5500 8.1772 117.1196 66.3034 31.5911 178.1904 25 Q 3.9991 8.2108 117.7069 59.1547 28.5564 178.8443 26 E 4.0184 8.3991 119.5478 59.4103 29.5276 179.6133 27 K 4.1468 8.2269 118.5106 59.6745 31.8709 179.2870 28 M 4.3516 8.1748 118.2330 58.1843 31.8993 178.1928 29 A 4.3507 7.9857 119.5338 53.6266 18.5792 178.1707 30 G 3.9064 7.6427 104.5066 44.9539 0.0000 173.4194 31 N 4.4510 7.7709 118.6363 52.8099 39.3583 173.2614 32 D 4.7058 8.5173 124.3016 53.1720 40.2474 176.8120 33 D 4.3988 8.0886 120.5915 54.5375 42.2577 175.0694 34 P 4.2914 0.0000 0.0000 65.9597 31.3837 178.2285 35 H 4.2182 8.3064 116.5673 59.2371 29.8302 176.8495 36 F 4.0169 8.6429 122.4662 61.4666 39.1337 177.1422 37 Q 3.8817 8.4062 117.6630 59.0976 28.4128 178.8634 38 T 3.7954 7.9396 116.6965 66.7770 68.4804 176.9928 39 R 3.7657 7.9874 119.8444 59.0596 29.9179 179.0309 40 A 3.7020 7.7920 120.8468 55.3114 18.2955 179.8324 41 T 3.7283 7.9359 114.3923 66.5861 68.5948 177.0109 42 V 3.5218 7.8949 120.3034 66.1997 31.5309 178.2366 43 I 3.6987 7.8522 119.6135 64.0757 36.8205 178.2516 44 K 3.8637 8.2366 120.8235 59.4306 31.9790 178.3456 45 E 3.8890 8.1270 119.4543 59.3613 29.5868 178.7545 46 Q 3.9370 7.8868 117.6172 59.3043 28.8542 179.2508 47 R 3.9673 8.4217 119.1082 59.0410 30.0367 179.0468 48 A 3.9960 8.3533 121.1674 55.0833 18.3126 179.3231 49 E 3.8986 8.2608 117.9353 59.2239 29.7093 179.0075 50 L 3.9024 8.0406 118.9310 57.7385 41.7257 179.2665 51 A 4.0954 8.1668 120.6793 55.1475 18.3132 179.8605 52 K 3.9200 8.2144 116.9640 59.7467 32.1065 178.8794 53 H 4.0596 8.3559 118.5681 59.8163 29.7609 176.9364 54 H 4.2788 8.1980 117.7813 58.8639 28.6063 178.0792 55 V 3.6346 8.0096 120.0730 65.9477 31.3180 178.0046 56 S 4.2524 8.6393 113.3091 61.4727 62.2153 176.1721 57 V 3.6737 8.2337 121.3092 66.0255 31.1443 177.7108 58 L 3.8416 7.9898 118.6301 57.7666 41.3244 179.4785 59 W 4.7411 8.1619 126.3509 60.6739 30.7815 177.7457 60 S 4.0673 8.5921 113.3261 60.5901 62.8993 175.2008 61 D 4.6970 8.4298 120.9956 54.8368 41.8135 176.9511 62 Y 3.5555 7.2382 118.7377 59.1427 39.3794 175.6791 63 F 4.0058 7.6962 118.1617 57.2404 39.6375 174.8828 64 K 4.6654 7.8654 122.0646 53.0878 36.1334 175.3542 65 P 4.4673 0.0000 0.0000 65.7753 31.1222 177.1906 66 P 4.5310 0.0000 0.0000 65.4489 31.1427 178.2313 67 H 4.3550 7.9095 116.4742 58.8555 28.7258 177.7150 68 F 4.4222 7.6168 119.0941 60.2099 38.4033 177.4491 69 E 4.0835 8.6423 118.9455 59.5273 29.1399 179.4268 70 K 3.9829 8.0629 117.9677 57.8314 33.4147 176.1664 71 Y 4.7278 7.9767 117.5345 54.8226 38.0304 174.0664 72 P 4.5827 0.0000 0.0000 64.1759 31.9963 177.8079 73 E 4.4318 8.1420 116.0270 56.3162 30.4416 177.5870 74 L 3.8813 8.2260 122.8933 58.8682 42.1024 178.1052 75 H 4.2678 8.3859 115.7208 59.4061 28.6974 177.2966 76 Q 3.8453 8.0406 120.3812 58.8713 28.9886 177.5277 77 L 3.8946 8.1612 121.7689 58.2231 42.1224 179.2805 78 V 3.4476 7.9414 118.4010 65.7504 31.4401 177.4125 79 N 3.9717 7.8499 116.8474 56.8514 38.7880 176.5473 80 D 4.0975 8.3036 120.4088 57.4061 40.6416 179.0525 81 T 3.5256 7.4769 116.1970 66.4293 68.3738 176.7100 82 L 3.9055 7.6970 120.8283 57.8090 41.5431 179.8413 83 K 3.8868 8.0142 118.1335 59.2230 31.8530 179.2709 84 A 4.0042 8.3346 121.5006 55.1194 18.2870 179.6453 85 L 3.9301 8.1953 117.7600 58.1504 41.7687 179.9525 86 S 4.1552 8.3821 115.0905 61.4444 62.4887 176.6139 87 A 3.9714 8.1680 122.8037 55.0585 18.4781 179.1641 88 A 4.2550 8.1700 120.7809 54.6803 18.2310 179.6917 89 K 3.9199 8.2866 116.4972 59.6549 32.2758 178.7843 90 G 3.9611 7.5753 102.0584 44.0514 0.0000 173.1325 91 S 4.7140 7.3711 114.0294 56.4436 65.5716 173.8836 92 K 4.2464 8.4692 123.0813 56.6040 32.8108 176.3282 93 D 4.4980 8.1593 120.5002 53.0470 41.0242 175.0088 94 P 5.0540 0.0000 0.0000 64.6994 31.2684 178.3099 95 A 4.0084 8.5461 120.3463 55.0480 18.0460 179.7594 96 T 3.9920 8.3168 109.0714 64.8359 68.8646 177.1716 97 G 3.6326 8.1738 108.2434 47.6276 0.0000 175.2747 98 Q 3.9601 8.3563 122.4477 58.6182 29.0626 178.1358 99 K 3.8837 8.2743 120.5727 59.3298 32.1807 178.6064 100 A 4.1783 8.1349 121.0908 55.3493 18.2673 179.5888 101 L 3.9787 8.2730 117.6816 58.1016 41.5008 179.5920 102 D 4.3126 8.1458 118.9152 57.2940 40.7066 178.4309 103 Y 4.1789 7.9764 117.3362 61.2342 37.9093 178.4605 104 I 3.7731 8.1466 120.6161 64.4426 37.2636 178.2565 105 A 4.1354 8.3611 121.7180 55.3043 18.0375 179.7571 106 Q 3.9988 7.9012 116.6944 59.2110 28.8109 178.9888 107 I 3.7653 7.9373 120.8977 64.3927 37.1394 177.9691 108 D 4.4549 8.5921 119.4195 57.0712 40.9902 178.3172 109 K 4.0892 8.1658 119.9738 59.6211 32.3213 178.5679 110 I 3.4751 7.4763 119.8625 64.4604 36.7995 177.6726 111 F 4.0789 8.4632 120.0496 61.6533 39.2591 177.2116 112 W 4.3309 8.3632 117.9531 59.3680 28.7123 178.5025 113 E 4.1372 8.5864 119.2851 59.7639 28.7154 179.5075 114 T 3.9908 8.1109 109.2131 64.1267 68.4972 175.6416 115 K 4.2568 7.2545 119.6465 57.1182 32.4922 177.8838 116 K 4.2682 8.0984 119.3509 57.6823 32.3310 176.1651 117 A 4.2381 7.6069 125.0689 52.9992 19.3622 175.5604 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 H 8.43 4.59 0.00 3.19 3.33 0.00 5.67 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.92 4.24 0.00 3.19 3.14 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 3 D 8.42 4.91 0.00 2.78 3.19 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 4 L 8.00 4.15 0.00 1.63 1.78 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.55 0.00 2.30 2.13 0.00 3.82 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 2.01 1.98 0.00 6 C 8.60 4.25 0.00 3.02 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 7 G 8.19 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 0.00 0.00 0.00 8 V 7.28 4.19 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 0.44 0.00 0.00 0.83 0.00 0.00 9 F 8.26 4.71 0.00 2.82 2.57 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 10 D 7.98 3.71 0.00 2.61 2.41 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 11 P 0.00 4.20 0.00 2.26 1.92 0.00 3.01 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 12 A 8.46 4.02 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 13 Q 8.06 3.79 0.00 1.86 1.63 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 2.28 2.41 0.00 14 A 7.81 4.05 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 15 R 8.11 3.83 0.00 1.90 2.15 0.00 3.13 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 16 I 7.95 3.70 1.87 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 1.53 0.76 0.92 0.00 0.00 17 E 7.97 3.99 0.00 2.13 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 0.00 2.58 2.57 0.00 18 A 8.34 4.07 1.40 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 19 E 8.85 3.95 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 2.34 2.51 0.00 20 S 8.17 4.11 0.00 4.06 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 21 V 7.71 3.56 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 1.00 0.00 0.00 0.93 0.00 0.00 22 K 8.12 4.13 0.00 1.89 1.80 0.00 1.79 0.00 0.00 1.66 0.00 0.00 3.21 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.63 7.81 23 A 8.31 3.99 1.40 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 24 V 8.18 3.55 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 1.06 0.00 0.00 0.95 0.00 0.00 25 Q 8.21 4.00 0.00 2.34 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.59 0.00 26 E 8.40 4.02 0.00 2.21 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 2.34 2.52 0.00 27 K 8.23 4.15 0.00 2.11 2.21 0.00 1.79 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.80 7.81 28 M 8.17 4.35 0.00 2.03 2.34 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.50 0.00 29 A 7.99 4.35 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.64 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 31 N 7.77 4.45 0.00 2.13 2.03 0.00 0.00 7.12 8.47 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 32 D 8.52 4.71 0.00 2.85 2.77 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 33 D 8.09 4.40 0.00 2.85 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.29 0.00 2.24 2.12 0.00 3.70 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 35 H 8.31 4.22 0.00 3.26 3.59 0.00 5.87 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.64 4.02 0.00 3.15 3.24 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 0.00 37 Q 8.41 3.88 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.69 2.61 0.00 38 T 7.94 3.80 4.35 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 1.19 0.00 0.00 39 R 7.99 3.77 0.00 1.70 1.81 0.00 3.01 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 40 A 7.79 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.94 3.73 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 1.18 0.00 0.00 42 V 7.89 3.52 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 1.00 0.00 0.00 0.95 0.00 0.00 43 I 7.85 3.70 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.53 0.88 0.00 0.00 44 K 8.24 3.86 0.00 1.85 1.94 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.13 3.89 0.00 2.28 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 2.29 2.38 0.00 46 Q 7.89 3.94 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 47 R 8.42 3.97 0.00 1.78 1.98 0.00 3.28 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.79 0.00 48 A 8.35 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.26 3.90 0.00 2.16 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 0.00 2.29 2.38 0.00 50 L 8.04 3.90 0.00 1.93 1.69 0.98 0.51 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 51 A 8.17 4.10 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 52 K 8.21 3.92 0.00 1.98 1.87 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.58 7.81 53 H 8.36 4.06 0.00 3.22 3.41 0.00 5.79 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 54 H 8.20 4.28 0.00 3.39 3.31 0.00 5.67 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.01 3.63 2.22 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 1.01 0.00 0.00 0.98 0.00 0.00 56 S 8.64 4.25 0.00 3.93 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 57 V 8.23 3.67 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 1.34 0.00 0.00 0.83 0.00 0.00 58 L 7.99 3.84 0.00 2.11 1.82 0.84 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.16 4.74 0.00 3.41 3.59 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 60 S 8.59 4.07 0.00 3.99 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 61 D 8.43 4.70 0.00 2.94 2.98 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 62 Y 7.24 3.56 0.00 1.43 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 0.00 0.00 0.00 0.00 63 F 7.70 4.01 0.00 3.19 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 0.00 0.00 0.00 0.00 64 K 7.87 4.67 0.00 1.39 1.48 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.74 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.10 7.81 65 P 0.00 4.47 0.00 2.15 2.19 0.00 3.55 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 2.13 2.24 0.00 66 P 0.00 4.53 0.00 2.14 2.23 0.00 3.64 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 67 H 7.91 4.36 0.00 2.89 3.27 0.00 5.63 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 68 F 7.62 4.42 0.00 3.28 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 69 E 8.64 4.08 0.00 2.14 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 2.36 2.51 0.00 70 K 8.06 3.98 0.00 1.76 1.60 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.52 1.16 7.81 71 Y 7.98 4.73 0.00 3.10 3.04 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 72 P 0.00 4.58 0.00 2.21 2.22 0.00 3.38 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.92 0.00 73 E 8.14 4.43 0.00 2.18 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 2.37 2.29 0.00 74 L 8.23 3.88 0.00 1.89 1.95 0.53 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.39 4.27 0.00 3.24 3.33 0.00 5.67 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 76 Q 8.04 3.85 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.88 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 77 L 8.16 3.89 0.00 1.87 1.87 1.10 1.17 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 78 V 7.94 3.45 1.64 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 0.60 0.00 0.00 1.04 0.00 0.00 79 N 7.85 3.97 0.00 2.61 2.60 0.00 0.00 7.25 8.01 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 80 D 8.30 4.10 0.00 2.30 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 0.00 0.00 0.00 81 T 7.48 3.53 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 1.23 0.00 0.00 82 L 7.70 3.91 0.00 1.68 1.62 0.75 0.90 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 83 K 8.01 3.89 0.00 1.78 1.77 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.44 7.81 84 A 8.33 4.00 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 85 L 8.20 3.93 0.00 1.83 1.72 0.95 1.09 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 86 S 8.38 4.16 0.00 3.95 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 87 A 8.17 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.17 4.25 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 89 K 8.29 3.92 0.00 1.87 1.90 0.00 1.69 0.00 0.00 1.91 0.00 0.00 3.20 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.47 7.81 90 G 7.58 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 0.00 0.00 0.00 91 S 7.37 4.71 0.00 3.81 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 92 K 8.47 4.25 0.00 1.79 1.84 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.41 7.81 93 D 8.16 4.50 0.00 2.69 2.57 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 94 P 0.00 5.05 0.00 2.20 2.11 0.00 3.94 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.03 0.00 95 A 8.55 4.01 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 96 T 8.32 3.99 4.26 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 1.22 0.00 0.00 97 G 8.17 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 0.00 0.00 0.00 0.00 98 Q 8.36 3.96 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 99 K 8.27 3.88 0.00 2.06 2.00 0.00 1.36 0.00 0.00 1.34 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.51 1.70 7.81 100 A 8.13 4.18 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 0.00 101 L 8.27 3.98 0.00 1.86 1.75 0.93 1.44 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 0.00 102 D 8.15 4.31 0.00 2.70 2.52 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 0.00 103 Y 7.98 4.18 0.00 3.29 2.94 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 0.00 104 I 8.15 3.77 2.05 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 1.50 0.75 0.94 0.00 0.00 105 A 8.36 4.14 1.39 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 0.00 0.00 0.00 106 Q 7.90 4.00 0.00 2.30 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.67 0.00 107 I 7.94 3.77 2.07 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.76 1.09 0.00 0.00 108 D 8.59 4.45 0.00 2.91 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 0.00 109 K 8.17 4.09 0.00 1.99 1.85 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.26 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.67 1.57 7.81 110 I 7.48 3.48 1.82 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.54 -0.02 0.00 0.00 111 F 8.46 4.08 0.00 2.90 3.01 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 0.00 112 W 8.36 4.33 0.00 3.56 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 0.00 113 E 8.59 4.14 0.00 2.34 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 0.00 2.46 2.56 0.00 114 T 8.11 3.99 4.17 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 1.39 0.00 0.00 115 K 7.25 4.26 0.00 1.92 1.92 0.00 1.51 0.00 0.00 0.87 0.00 0.00 2.63 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.54 0.33 7.81 116 K 8.10 4.27 0.00 1.94 1.90 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.50 7.81 117 A 7.61 4.24 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