NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6534 8.3493 120.1961 54.1113 43.0743 175.1982 2 I 4.0714 7.4600 118.8223 59.8818 38.8435 171.6872 3 E 4.6200 9.3397 121.0094 55.0420 33.8211 176.0508 4 L 5.0362 8.6727 126.8895 53.6777 43.9061 176.4613 5 T 4.5154 8.9978 120.7774 61.6429 70.3103 172.8409 6 Q 4.7673 8.5960 127.5149 56.2047 30.3557 174.9380 7 T 4.8222 9.2053 120.1360 60.2769 71.1315 171.1541 8 P 4.8455 0.0000 0.0000 61.8016 33.0585 176.9078 9 V 3.7318 8.3546 120.0871 66.1577 32.4095 175.4566 10 S 5.1054 7.6567 112.7698 56.9371 65.8879 173.3208 11 L 4.6939 8.9760 126.5177 53.8184 46.1711 173.9904 12 S 5.3979 8.6993 119.8511 56.6665 65.2300 172.3590 13 A 4.8970 9.0276 127.0849 51.2469 23.4088 174.9551 14 S 5.0529 9.0257 114.0524 56.0635 66.4971 173.6827 15 V 3.8574 8.4647 120.4338 65.0902 31.0245 175.4891 16 G 4.0207 8.7861 115.6794 45.6173 0.0000 173.4021 17 E 4.3773 8.1598 119.3728 56.2190 31.4807 175.9097 18 T 5.3385 8.1596 116.7923 61.4795 70.6471 174.5844 19 V 4.2147 8.0242 119.7671 60.3909 34.8524 175.8316 20 T 4.7493 7.9349 117.9642 62.6137 71.0727 173.7703 21 I 4.3161 8.1304 128.1441 60.7323 38.9193 175.4579 22 T 5.3262 9.0738 115.5995 60.1188 72.3134 171.8413 23 C 5.5976 9.6324 123.1419 55.0267 43.8583 172.7146 24 R 5.3995 8.7949 123.8308 54.4379 33.2117 174.3154 25 A 5.1935 8.9560 125.7530 50.1560 20.4560 177.1631 26 S 4.3623 8.8458 116.7471 61.1960 63.5931 173.7612 27 E 4.5915 7.6679 115.2477 54.3031 32.6851 173.4327 28 N 4.5198 8.5392 117.3419 53.8134 39.5320 174.9758 29 I 4.5320 8.5855 117.1787 59.6698 40.5119 177.7700 30 Y 3.7411 8.4920 122.2183 59.3098 35.8139 170.7974 31 S 5.0502 8.4091 122.2616 58.7729 65.4528 174.7689 32 Y 4.8020 7.3525 120.7085 57.7199 35.8204 174.1352 33 L 5.0512 7.4991 121.9613 53.0936 45.9450 175.5982 34 A 5.3329 9.2557 127.7556 50.2299 22.4095 175.0596 35 W 5.4777 8.7952 118.6254 55.2574 33.3137 174.4635 36 Y 5.3789 9.7784 119.5630 56.5168 42.0978 173.9298 37 Q 4.7019 9.0252 123.3330 54.4532 32.4488 174.4068 38 Q 4.6285 9.0237 126.5265 54.0175 31.3214 174.3816 39 K 4.6381 8.4919 125.5368 55.6288 33.8476 176.4237 40 Q 3.9245 8.7420 123.2580 57.8262 29.1593 176.5587 41 G 3.9650 8.9182 112.9678 46.5670 0.0000 172.8979 42 K 4.7259 7.5760 117.0622 53.7491 35.9177 176.4686 43 S 4.3462 8.3727 116.3442 57.7037 63.4411 172.8925 44 P 4.7091 0.0000 0.0000 63.0390 31.9850 175.6364 45 Q 4.8893 9.2362 122.2724 53.9795 31.8625 174.6828 46 F 4.4680 9.0208 125.2790 58.6976 39.8452 173.8314 47 L 4.1960 8.2804 125.9294 55.7930 43.0764 176.5785 48 V 4.7707 6.6690 110.3778 59.9240 36.6031 172.7186 49 Y 5.1044 8.8886 120.7891 54.6866 42.1485 174.2007 50 N 4.6098 10.5023 113.4251 53.5041 37.2169 174.6848 51 A 4.4468 9.1417 125.5312 52.4719 18.4884 180.6537 52 K 4.6104 7.6716 109.0683 57.0180 34.1334 175.4999 53 T 4.3728 7.9520 117.9248 62.0581 69.5955 174.3315 54 L 4.3973 8.5747 127.2853 54.7557 42.7991 177.6925 55 G 4.1622 8.9441 110.9552 45.3408 0.0000 172.3048 56 E 4.0446 8.7122 121.3096 57.2897 29.9696 175.3737 57 G 4.1198 9.0505 114.2984 45.5027 0.0000 174.1282 58 V 3.5294 6.9108 118.0676 62.1129 31.7352 174.0847 59 P 4.5422 0.0000 0.0000 62.5701 31.8845 177.5245 60 S 4.2094 8.6600 115.9185 61.6012 63.2439 175.8287 61 R 4.0139 8.3076 119.4111 59.3871 30.7613 177.1887 62 F 4.3927 7.9726 116.8226 57.4525 39.8781 176.0398 63 S 4.3907 9.0674 117.9057 56.1856 64.1527 173.2805 64 G 3.9895 8.4911 113.1680 46.0140 0.0000 169.9397 65 S 4.5866 9.0507 114.9435 57.6151 66.6919 174.1569 66 G 4.1376 9.8778 108.5377 45.2520 0.0000 172.7283 67 S 4.3454 8.0329 110.3495 58.1134 65.4751 173.9506 68 G 4.5266 9.3098 118.2994 46.1575 0.0000 175.1505 69 T 4.7951 6.9706 111.0886 60.2850 70.7731 172.3251 70 Q 4.8297 7.5779 120.1660 54.3012 31.4429 174.7564 71 F 5.5299 9.1642 123.1468 55.9584 43.3242 174.6972 72 S 5.1277 9.1092 112.4105 57.5790 66.8479 173.8267 73 L 4.2458 8.3847 125.1776 53.1073 43.7121 174.8741 74 K 4.5437 8.5057 128.6824 55.3812 34.2941 175.5702 75 I 4.3122 8.0541 127.2054 59.1070 39.5863 174.1505 76 N 4.3877 8.7078 127.3678 54.5736 39.4151 175.3365 77 S 3.7932 8.4224 115.3250 57.8495 60.5292 171.7048 78 L 4.0266 8.3055 124.1117 54.7729 42.4491 176.7645 79 L 5.0633 8.1958 120.5050 51.8569 44.7312 176.1033 80 P 4.6652 0.0000 0.0000 65.7460 31.0596 177.3196 81 E 4.3147 8.1674 116.0891 58.1537 30.1725 177.8134 82 D 4.7688 7.6932 117.9394 55.5347 41.0125 176.6467 83 F 4.5904 7.3738 118.6518 56.6332 39.9324 176.5115 84 G 3.8149 7.7729 110.7653 45.1656 0.0000 172.0426 85 S 5.0221 7.9761 116.1635 58.2117 64.8539 173.3183 86 Y 5.3885 8.6481 119.3368 56.6840 41.7457 174.2193 87 Y 5.5951 9.7894 120.7177 56.3674 42.6712 171.8696 88 C 4.9584 9.0287 115.8923 53.5721 40.8079 172.4252 89 Q 4.8183 8.8915 122.3452 54.3940 32.5838 173.2563 90 H 4.8991 8.6322 126.4553 56.0786 30.2443 174.3530 91 H 4.9191 8.7467 120.6450 55.3165 29.1734 173.3848 92 Y 4.3969 7.6462 118.6179 56.6739 41.8881 174.1163 93 G 3.5623 6.6945 108.2579 44.0655 0.0000 172.4102 94 T 4.4321 7.9984 110.0419 58.7823 70.8005 172.5805 95 P 4.4346 0.0000 0.0000 61.7166 32.0593 174.3257 96 P 4.4326 0.0000 0.0000 62.6319 32.1219 175.7869 97 L 4.6418 8.0535 119.8836 53.5384 44.2161 175.9416 98 T 4.5939 7.9804 116.2575 62.8340 70.4538 173.9644 99 F 5.3004 8.7118 121.9684 55.5918 42.1470 175.5168 100 G 3.9599 9.3282 109.7406 45.6429 0.0000 174.4566 101 G 3.9225 8.9834 110.7219 46.7492 0.0000 174.8095 102 G 3.6983 8.8726 104.9769 45.7061 0.0000 172.8475 103 T 4.8977 8.1902 109.7060 59.6201 72.3895 172.8495 104 K 4.7619 8.7353 124.8667 55.3830 34.1159 175.2780 105 L 5.2935 9.1914 127.8042 53.6202 44.1534 174.9210 106 E 5.0408 8.9654 125.3515 54.2060 33.6547 175.7862 107 I 4.4704 7.4159 121.5992 60.3355 38.2037 176.4035 108 K 4.4732 8.2464 122.5792 56.2531 31.6199 177.0744 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 D 8.35 4.65 0.00 2.64 2.72 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 0.00 0.00 0.00 0.00 2 I 7.46 4.07 1.85 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 1.26 0.24 0.89 0.00 0.00 3 E 9.34 4.62 0.00 2.02 1.79 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 2.30 2.36 0.00 4 L 8.67 5.04 0.00 1.59 1.58 0.94 0.80 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 5 T 9.00 4.52 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 6 Q 8.60 4.77 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.65 0.00 0.00 0.00 0.00 0.00 2.53 2.64 0.00 7 T 9.21 4.82 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 1.39 0.00 0.00 8 P 0.00 4.85 0.00 2.47 2.17 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 9 V 8.35 3.73 2.11 0.00 0.00 0.00 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 0.96 0.00 0.00 10 S 7.66 5.11 0.00 3.82 3.68 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 11 L 8.98 4.69 0.00 1.80 1.48 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.70 5.40 0.00 3.92 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 13 A 9.03 4.90 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 14 S 9.03 5.05 0.00 3.94 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 15 V 8.46 3.86 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 0.87 0.00 0.00 1.14 0.00 0.00 16 G 8.79 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 17 E 8.16 4.38 0.00 1.98 1.87 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 2.32 2.42 0.00 18 T 8.16 5.34 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 1.11 0.00 0.00 19 V 8.02 4.21 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 0.75 0.00 0.00 0.70 0.00 0.00 20 T 7.93 4.75 4.18 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 1.13 0.00 0.00 21 I 8.13 4.32 1.52 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.48 1.08 0.00 0.00 22 T 9.07 5.33 4.43 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 1.32 0.00 0.00 23 C 9.63 5.60 0.00 3.12 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 24 R 8.79 5.40 0.00 1.96 1.82 0.00 3.18 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 25 A 8.96 5.19 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 26 S 8.85 4.36 0.00 3.89 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 0.00 27 E 7.67 4.59 0.00 1.99 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 2.15 2.26 0.00 28 N 8.54 4.52 0.00 2.66 2.51 0.00 0.00 6.42 7.83 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 29 I 8.59 4.53 1.97 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.85 0.82 0.00 0.00 30 Y 8.49 3.74 0.00 2.82 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 0.00 0.00 0.00 0.00 31 S 8.41 5.05 0.00 3.92 3.97 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 32 Y 7.35 4.80 0.00 3.19 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 33 L 7.50 5.05 0.00 0.57 0.87 0.29 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 34 A 9.26 5.33 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 35 W 8.80 5.48 0.00 3.11 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 36 Y 9.78 5.38 0.00 3.19 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 37 Q 9.03 4.70 0.00 2.25 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.07 1.72 0.00 38 Q 9.02 4.63 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.28 2.46 0.00 39 K 8.49 4.64 0.00 1.78 1.75 0.00 1.77 0.00 0.00 1.87 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.66 1.46 7.81 40 Q 8.74 3.92 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 41 G 8.92 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 42 K 7.58 4.73 0.00 1.79 1.70 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.52 7.81 43 S 8.37 4.35 0.00 3.87 3.79 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 44 P 0.00 4.71 0.00 1.89 2.01 0.00 3.57 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.03 0.00 45 Q 9.24 4.89 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.01 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 46 F 9.02 4.47 0.00 3.09 3.03 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 47 L 8.28 4.20 0.00 1.48 1.33 1.04 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 48 V 6.67 4.77 2.05 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 0.68 0.00 0.00 1.14 0.00 0.00 49 Y 8.89 5.10 0.00 2.99 3.44 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 50 N 10.50 4.61 0.00 2.75 2.51 0.00 0.00 7.36 7.96 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 51 A 9.14 4.45 1.70 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 0.00 0.00 52 K 7.67 4.61 0.00 1.78 1.95 0.00 1.39 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.54 7.81 53 T 7.95 4.37 3.31 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 1.18 0.00 0.00 54 L 8.57 4.40 0.00 1.55 1.60 0.95 0.96 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 55 G 8.94 4.16 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 0.00 0.00 0.00 56 E 8.71 4.04 0.00 2.00 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 2.32 2.35 0.00 57 G 9.05 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 58 V 6.91 3.53 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 0.52 0.00 0.00 0.88 0.00 0.00 59 P 0.00 4.54 0.00 2.39 2.24 0.00 3.69 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 2.37 2.13 0.00 60 S 8.66 4.21 0.00 3.89 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 61 R 8.31 4.01 0.00 1.51 1.78 0.00 3.26 0.00 0.00 3.28 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 62 F 7.97 4.39 0.00 2.82 2.90 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 S 9.07 4.39 0.00 3.78 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 64 G 8.49 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 0.00 0.00 0.00 65 S 9.05 4.59 0.00 3.91 3.82 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 66 G 9.88 4.14 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 0.00 0.00 0.00 67 S 8.03 4.35 0.00 3.75 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 68 G 9.31 4.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 6.97 4.80 4.16 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 1.16 0.00 0.00 70 Q 7.58 4.83 0.00 1.79 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.40 0.00 0.00 0.00 0.00 0.00 2.23 2.40 0.00 71 F 9.16 5.53 0.00 3.17 3.34 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 72 S 9.11 5.13 0.00 3.90 3.98 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 73 L 8.38 4.25 0.00 0.27 0.15 0.51 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.51 4.54 0.00 1.75 1.50 0.00 1.54 0.00 0.00 1.56 0.00 0.00 2.78 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.23 1.41 7.81 75 I 8.05 4.31 1.48 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.02 0.20 0.00 0.00 76 N 8.71 4.39 0.00 2.59 2.60 0.00 0.00 7.48 7.48 0.00 0.00 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 S 8.42 3.79 0.00 3.94 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 78 L 8.31 4.03 0.00 1.58 1.26 0.80 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.20 5.06 0.00 1.86 1.65 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 80 P 0.00 4.67 0.00 2.27 2.32 0.00 3.80 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.03 0.00 81 E 8.17 4.31 0.00 2.23 2.30 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 2.39 2.40 0.00 82 D 7.69 4.77 0.00 2.46 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 83 F 7.37 4.59 0.00 3.20 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 84 G 7.77 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 85 S 7.98 5.02 0.00 3.91 3.53 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 0.00 0.00 0.00 0.00 86 Y 8.65 5.39 0.00 2.95 3.03 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 87 Y 9.79 5.60 0.00 3.20 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 88 C 9.03 4.96 0.00 1.89 1.18 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 89 Q 8.89 4.82 0.00 1.70 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.05 0.00 0.00 0.00 0.00 0.00 1.90 1.16 0.00 90 H 8.63 4.90 0.00 3.11 3.11 0.00 5.78 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 H 8.75 4.92 0.00 3.20 3.54 0.00 5.55 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 Y 7.65 4.40 0.00 2.14 2.53 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 0.00 0.00 0.00 0.00 93 G 6.69 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 8.00 4.43 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 1.11 0.00 0.00 95 P 0.00 4.43 0.00 2.01 1.98 0.00 3.59 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 96 P 0.00 4.43 0.00 2.18 2.04 0.00 3.72 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 1.98 1.98 0.00 97 L 8.05 4.64 0.00 1.47 1.60 0.84 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.98 4.59 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 1.26 0.00 0.00 99 F 8.71 5.30 0.00 2.88 2.88 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 0.00 0.00 0.00 100 G 9.33 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 0.00 101 G 8.98 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 0.00 0.00 0.00 102 G 8.87 3.70 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 0.00 0.00 0.00 103 T 8.19 4.90 4.67 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 1.33 0.00 0.00 104 K 8.74 4.76 0.00 1.81 1.81 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.39 7.81 105 L 9.19 5.29 0.00 1.96 1.93 1.06 0.65 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 0.00 106 E 8.97 5.04 0.00 1.91 1.70 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 2.22 2.30 0.00 107 I 7.42 4.47 1.56 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.68 0.00 0.00 108 K 8.25 4.47 0.00 1.62 1.70 0.00 1.85 0.00 0.00 2.40 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.24 7.81