NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3657 8.1633 118.3156 55.1204 33.7220 173.4387 2 K 4.3496 7.9542 118.4753 53.5814 34.4434 170.2214 3 V 5.1060 8.9174 125.6471 61.0296 35.1954 174.0037 4 V 4.9504 9.2759 128.2886 60.3070 33.3564 174.6924 5 V 4.8461 9.2196 126.5467 61.1332 33.7152 173.9527 6 Q 5.2023 9.0459 129.0126 54.5134 31.6222 174.1170 7 I 4.9886 8.8628 126.6221 59.6259 40.4390 175.7820 8 K 4.9992 8.7766 124.1649 55.1762 35.3849 175.3553 9 D 4.8843 7.9887 121.3579 52.6594 41.5450 176.3014 10 F 4.1890 9.1707 127.8363 61.8143 39.1302 176.8976 11 D 4.3307 8.2398 115.5408 56.0537 40.9077 177.5165 12 K 5.1934 7.9064 119.6506 55.4217 32.5854 178.0208 13 V 3.5144 7.3206 120.6929 65.5556 31.4872 175.8743 14 P 4.1577 0.0000 0.0000 65.9324 31.1400 178.5875 15 Q 3.9732 7.9854 115.8418 58.7851 28.6906 178.4788 16 A 3.9659 8.1396 121.8899 55.2833 18.5744 179.7629 17 L 3.9792 8.4167 117.8345 57.7073 41.5898 179.7853 18 R 3.9103 7.8331 118.6891 59.5182 29.9573 178.7632 19 S 4.1398 8.2962 115.2983 61.5023 62.6889 176.8107 20 V 3.6164 7.8666 121.0480 65.9842 31.1452 178.2257 21 I 3.7768 7.6315 119.2309 64.5341 37.1036 178.0873 22 N 4.3396 8.2871 117.3715 56.1233 38.2346 177.2875 23 L 3.9290 8.1742 121.9127 58.3440 42.0752 178.0919 24 Y 4.1605 8.1087 118.3922 61.2000 38.7608 177.9036 25 N 4.3477 8.4911 115.7286 55.4337 38.7002 176.3517 26 D 4.6988 7.6695 118.3107 55.1252 42.1604 176.8227 27 I 4.1981 7.6280 122.8068 57.7359 36.8214 174.2799 28 K 3.7935 7.8507 122.6553 58.1742 32.8684 177.0100 29 D 4.3244 8.4931 120.0285 55.3424 38.3289 173.5194 30 A 4.4917 7.3754 118.5776 51.3147 20.3538 177.5071 31 E 4.5127 9.0714 121.9933 54.9056 31.3519 174.8201 32 I 5.2312 8.4964 127.5328 59.5671 40.8053 174.2515 33 E 4.9232 9.3711 126.4478 54.5907 32.8566 174.1732 34 V 4.6548 9.2203 128.1445 61.4596 33.5639 174.4416 35 V 4.5963 9.2977 129.8267 61.4514 33.3828 174.2325 36 L 5.3981 8.9150 129.0334 53.5121 44.2090 175.5295 37 H 5.2348 8.5184 118.9261 54.5940 32.4470 173.5172 38 Q 3.2358 8.8528 116.3623 57.0950 27.2726 176.2814 39 S 4.1609 8.5852 113.8148 62.1987 63.1315 176.1229 40 A 4.3060 7.9471 123.9260 54.6271 17.9381 179.1151 41 I 3.6934 7.6528 117.1757 63.9832 37.8588 177.8170 42 K 3.9514 8.2306 118.7355 58.5253 31.5081 178.5703 43 A 4.4110 8.0793 120.3460 54.0753 18.5338 178.4075 44 L 4.3619 7.9200 116.8977 53.9378 42.1790 176.6816 45 L 4.5146 7.2683 120.5978 54.2982 42.1780 178.3742 46 K 3.8864 8.7814 122.6271 59.0420 32.1203 177.6409 47 D 4.8851 7.8217 116.1372 52.7739 40.0033 176.2534 48 S 4.3272 8.0119 115.0322 58.9344 62.8136 175.0016 49 D 4.4928 8.7769 126.1890 56.6890 41.0552 177.7204 50 T 4.4265 7.8695 109.1564 61.2886 68.9429 175.9649 51 R 3.8814 7.6290 123.1507 60.2824 30.0188 178.3899 52 S 4.1279 8.0767 114.0022 61.7824 62.8703 176.7564 53 I 3.6968 7.6500 121.8025 64.3340 37.0174 178.4144 54 I 3.6922 7.8351 120.6024 64.5655 36.7808 178.4806 55 E 4.0288 8.3349 118.2316 59.1035 29.3222 178.6762 56 D 4.4166 7.9585 118.5540 57.1920 41.2832 178.1663 57 L 3.8448 7.8511 119.5452 57.8317 41.5807 179.5465 58 I 4.0119 7.5801 120.8909 63.8178 36.7818 178.6484 59 K 4.0685 7.5622 118.4513 58.7952 31.8045 178.3839 60 K 4.3204 7.4815 116.6472 55.7134 32.0980 176.2464 61 N 4.2798 7.8407 114.7207 54.3382 36.3893 173.7854 62 I 4.3263 7.4797 119.6186 60.0882 39.0420 174.9268 63 L 4.3624 8.6644 130.0117 54.8862 43.4059 175.3216 64 I 4.7216 8.3916 127.2648 59.9171 39.1495 174.5719 65 V 4.7910 9.3274 127.8907 60.9355 34.3594 174.3162 66 G 4.3792 9.1697 114.8263 44.4155 0.0000 171.7449 67 C 4.6732 8.5037 124.8152 58.6080 32.2561 173.8586 68 E 3.9149 9.5148 128.2839 59.4989 29.2068 178.4357 69 N 4.3190 7.8889 116.5727 56.6161 38.6385 177.6064 70 S 4.4024 7.9048 117.2181 61.0472 62.9136 176.4559 71 I 3.6975 8.0290 122.8284 64.5751 36.8134 178.7586 72 R 3.9362 8.0569 118.9839 59.2317 29.9930 179.2708 73 S 4.2936 8.4248 113.9319 60.7414 62.6571 175.3901 74 Q 4.4058 7.8421 119.9218 54.4158 29.1727 174.9745 75 N 4.1871 8.1529 116.8113 54.4816 36.7620 173.8322 76 L 4.8477 7.9408 115.7922 53.2207 44.6310 176.5440 77 S 4.8920 9.0916 115.8524 56.7862 65.3354 175.5129 78 H 4.2647 9.0135 120.7690 58.9751 28.5707 176.8452 79 D 4.5968 8.0458 116.2410 54.5553 39.8859 176.7691 80 Q 4.2922 8.4175 119.4286 56.7733 29.5196 175.4047 81 L 5.0398 7.1507 117.0407 53.2325 43.1052 176.8708 82 I 4.0867 8.3443 115.6403 60.2731 38.3478 174.0593 83 P 4.4155 0.0000 0.0000 63.3872 32.3491 176.5339 84 G 3.9173 8.9651 107.2531 45.2643 0.0000 173.1484 85 I 4.2061 7.2876 120.3605 60.0346 38.5459 175.2548 86 K 4.2239 8.6696 128.9631 56.0295 33.2884 175.2883 87 I 4.8585 8.3378 128.3856 59.9270 38.7644 175.4517 88 V 4.5196 8.3535 120.1982 59.4423 34.5396 176.7743 89 T 3.9150 8.6447 113.7020 64.5530 69.7171 174.1416 90 S 4.5360 7.8500 116.2498 54.9811 65.5954 174.3979 91 G 3.5596 8.8408 114.6274 48.0660 0.0000 176.0769 92 V 3.6192 7.6320 114.6194 63.8825 31.5421 178.7588 93 G 3.5311 7.9728 105.5314 47.5798 0.0000 175.4402 94 E 3.8163 8.1748 121.6082 59.0692 29.8018 178.9003 95 I 3.5514 7.6858 119.8710 64.4120 37.1674 178.6774 96 V 3.4460 7.7750 119.0378 65.6882 31.3109 177.9527 97 R 3.8209 8.1541 118.8426 59.5155 29.8968 178.6414 98 K 3.7387 8.1853 118.5342 59.5171 31.9355 179.4019 99 Q 4.4978 8.2625 119.6603 58.4592 28.3913 178.9327 100 S 4.2499 8.0371 114.4099 60.9245 63.0523 175.3671 101 E 4.5003 7.7108 119.9435 56.1997 29.4441 177.2667 102 G 4.0571 8.2107 108.3638 44.6047 0.0000 174.3365 103 W 4.3880 8.6221 120.6291 56.7280 30.5252 175.3601 104 I 4.3024 8.9533 125.3566 60.8632 38.0381 174.3972 105 Y 5.1630 8.7533 128.6976 57.0490 39.9936 174.2583 106 L 4.4241 8.7962 127.4862 53.2681 45.4054 174.5772 107 A 4.6694 8.0997 128.5532 50.4846 20.2458 176.6155 108 L 4.3423 8.6852 122.5762 54.8467 41.8633 176.6738 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 M 8.16 4.37 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 K 7.95 4.35 0.00 0.79 0.74 0.00 0.78 0.00 0.00 0.70 0.00 0.00 2.68 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.67 0.95 7.81 3 V 8.92 5.11 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 1.13 0.00 0.00 0.96 0.00 0.00 4 V 9.28 4.95 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 0.86 0.00 0.00 0.88 0.00 0.00 5 V 9.22 4.85 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 0.95 0.00 0.00 1.01 0.00 0.00 6 Q 9.05 5.20 0.00 2.40 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 7 I 8.86 4.99 1.90 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 1.30 0.58 0.92 0.00 0.00 8 K 8.78 5.00 0.00 1.64 1.74 0.00 1.66 0.00 0.00 1.84 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.25 7.81 9 D 7.99 4.88 0.00 2.72 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 10 F 9.17 4.19 0.00 3.13 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 11 D 8.24 4.33 0.00 2.68 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 12 K 7.91 5.19 0.00 1.85 1.78 0.00 1.83 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.25 7.81 13 V 7.32 3.51 1.90 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 0.93 0.00 0.00 0.98 0.00 0.00 14 P 0.00 4.16 0.00 2.12 2.03 0.00 3.45 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 15 Q 7.99 3.97 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 16 A 8.14 3.97 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 17 L 8.42 3.98 0.00 1.77 1.71 0.90 0.81 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 18 R 7.83 3.91 0.00 2.04 2.09 0.00 3.08 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 19 S 8.30 4.14 0.00 4.06 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 20 V 7.87 3.62 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 1.14 0.00 0.00 0.98 0.00 0.00 21 I 7.63 3.78 2.08 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.74 0.97 0.00 0.00 22 N 8.29 4.34 0.00 2.94 2.89 0.00 0.00 6.70 6.34 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 23 L 8.17 3.93 0.00 1.78 1.94 0.94 1.15 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 24 Y 8.11 4.16 0.00 2.93 3.21 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 25 N 8.49 4.35 0.00 2.75 2.86 0.00 0.00 7.00 8.50 0.00 0.00 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 D 7.67 4.70 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 27 I 7.63 4.20 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.29 0.87 0.00 0.00 28 K 7.85 3.79 0.00 1.77 1.73 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.42 7.81 29 D 8.49 4.32 0.00 2.80 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 30 A 7.38 4.49 1.26 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 0.00 0.00 31 E 9.07 4.51 0.00 1.91 1.54 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 2.41 2.37 0.00 32 I 8.50 5.23 1.99 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.80 1.02 0.00 0.00 33 E 9.37 4.92 0.00 2.09 1.72 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 2.09 2.16 0.00 34 V 9.22 4.65 2.10 0.00 0.00 0.00 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 0.97 0.00 0.00 35 V 9.30 4.60 2.10 0.00 0.00 0.00 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 36 L 8.91 5.40 0.00 1.68 1.59 1.00 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 37 H 8.52 5.23 0.00 3.24 3.38 0.00 5.61 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 38 Q 8.85 3.24 0.00 2.26 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.94 0.00 0.00 0.00 0.00 0.00 2.36 2.28 0.00 39 S 8.59 4.16 0.00 4.04 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 0.00 40 A 7.95 4.31 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 41 I 7.65 3.69 1.95 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 1.51 1.41 0.95 0.00 0.00 42 K 8.23 3.95 0.00 1.29 1.44 0.00 1.42 0.00 0.00 1.57 0.00 0.00 2.13 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.28 1.35 7.81 43 A 8.08 4.41 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 44 L 7.92 4.36 0.00 1.80 1.70 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.27 4.51 0.00 1.75 1.76 0.90 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.78 3.89 0.00 1.72 1.90 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.48 1.51 7.81 47 D 7.82 4.89 0.00 2.77 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 48 S 8.01 4.33 0.00 4.00 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 49 D 8.78 4.49 0.00 2.69 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 50 T 7.87 4.43 4.22 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 1.15 0.00 0.00 51 R 7.63 3.88 0.00 2.01 1.99 0.00 3.26 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 52 S 8.08 4.13 0.00 3.89 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 53 I 7.65 3.70 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.86 0.89 0.00 0.00 54 I 7.84 3.69 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.18 0.91 0.00 0.00 55 E 8.33 4.03 0.00 1.90 2.01 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 2.34 2.58 0.00 56 D 7.96 4.42 0.00 2.89 2.84 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 57 L 7.85 3.84 0.00 1.85 1.63 0.90 0.57 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 58 I 7.58 4.01 2.03 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.90 0.00 0.00 59 K 7.56 4.07 0.00 1.83 1.85 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.73 7.81 60 K 7.48 4.32 0.00 1.38 1.00 0.00 1.11 0.00 0.00 0.77 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.20 1.52 7.81 61 N 7.84 4.28 0.00 2.95 2.97 0.00 0.00 6.85 7.07 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 62 I 7.48 4.33 1.96 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.87 0.94 0.00 0.00 63 L 8.66 4.36 0.00 1.86 1.59 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.39 4.72 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 1.23 0.99 0.91 0.00 0.00 65 V 9.33 4.79 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 1.05 0.00 0.00 0.88 0.00 0.00 66 G 9.17 4.38 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 0.00 67 C 8.50 4.67 0.00 3.06 2.85 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 68 E 9.51 3.91 0.00 2.15 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 0.00 2.32 2.41 0.00 69 N 7.89 4.32 0.00 2.73 2.86 0.00 0.00 7.07 7.42 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 70 S 7.90 4.40 0.00 4.02 4.08 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 71 I 8.03 3.70 2.03 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.90 0.96 0.00 0.00 72 R 8.06 3.94 0.00 2.01 1.97 0.00 3.13 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.96 0.00 73 S 8.42 4.29 0.00 4.03 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 74 Q 7.84 4.41 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 75 N 8.15 4.19 0.00 2.75 2.84 0.00 0.00 6.79 7.42 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 76 L 7.94 4.85 0.00 1.71 1.57 0.88 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 77 S 9.09 4.89 0.00 3.88 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 78 H 9.01 4.26 0.00 3.21 3.38 0.00 5.81 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 79 D 8.05 4.60 0.00 2.79 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 80 Q 8.42 4.29 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 81 L 7.15 5.04 0.00 1.54 1.65 0.86 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 82 I 8.34 4.09 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 1.46 0.52 0.92 0.00 0.00 83 P 0.00 4.42 0.00 2.10 2.11 0.00 3.78 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 1.98 1.97 0.00 84 G 8.97 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 0.00 0.00 0.00 85 I 7.29 4.21 1.85 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 1.40 0.87 0.89 0.00 0.00 86 K 8.67 4.22 0.00 1.86 1.66 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.40 7.81 87 I 8.34 4.86 1.86 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 1.43 0.91 0.95 0.00 0.00 88 V 8.35 4.52 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 0.66 0.00 0.00 0.93 0.00 0.00 89 T 8.64 3.91 4.22 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 1.20 0.00 0.00 90 S 7.85 4.54 0.00 3.78 3.64 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 0.00 0.00 0.00 0.00 91 G 8.84 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 92 V 7.63 3.62 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 0.63 0.00 0.00 0.87 0.00 0.00 93 G 7.97 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 0.00 0.00 0.00 94 E 8.17 3.82 0.00 2.11 2.06 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 2.18 2.22 0.00 95 I 7.69 3.55 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.09 0.55 0.00 0.00 96 V 7.78 3.45 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 0.93 0.00 0.00 0.83 0.00 0.00 97 R 8.15 3.82 0.00 2.08 1.92 0.00 3.08 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.63 0.00 98 K 8.19 3.74 0.00 1.72 1.38 0.00 0.61 0.00 0.00 0.95 0.00 0.00 2.20 0.00 0.00 2.31 0.00 0.00 0.00 0.00 1.19 0.98 7.81 99 Q 8.26 4.50 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.59 2.35 0.00 100 S 8.04 4.25 0.00 4.04 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 0.00 101 E 7.71 4.50 0.00 2.33 2.24 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 2.38 2.48 0.00 102 G 8.21 4.06 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 0.00 0.00 0.00 103 W 8.62 4.39 0.00 3.32 3.26 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 0.00 104 I 8.95 4.30 1.93 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 1.16 0.77 0.97 0.00 0.00 105 Y 8.75 5.16 0.00 2.94 2.91 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 0.00 106 L 8.80 4.42 0.00 1.76 1.45 0.85 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 107 A 8.10 4.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.69 4.34 0.00 1.60 1.52 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00