NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2801 8.2549 117.2656 56.3670 31.8011 175.7035 3 H 4.7019 8.0184 116.1491 55.2576 28.8691 176.2873 4 L 3.9140 9.5144 125.6480 56.8086 43.0136 176.0814 5 K 3.9827 7.7944 117.3132 59.4586 33.3142 178.8326 6 S 4.6314 7.3588 110.8025 56.9184 62.2460 177.5963 7 G 3.8630 8.8245 103.4913 46.2636 0.0000 173.0425 8 R 4.1626 10.5079 119.4807 56.0032 29.6993 174.3480 9 K 4.5896 7.3612 117.2547 54.9781 35.0655 174.8438 10 L 5.0226 7.6597 125.1314 55.8424 41.5912 173.6833 11 N 4.7677 8.2338 120.5116 53.6005 40.5965 173.8859 12 R 3.6380 9.8850 115.7070 56.9520 30.0119 174.0689 13 H 5.0448 7.8677 112.6850 53.7164 33.2249 173.3913 14 S 4.0269 8.7691 114.7498 62.4692 62.2597 176.6812 15 S 4.0554 8.0590 117.9261 60.7909 63.1152 175.4373 16 H 4.0161 8.0929 122.5672 58.1904 29.2336 176.7594 17 R 3.5594 8.1979 120.4928 58.4070 30.1127 177.8006 18 L 3.5605 7.4094 119.4726 58.2461 42.0637 178.8100 19 A 3.9671 8.1508 120.8237 54.9684 18.0765 179.3682 20 L 3.7397 7.1229 118.9338 58.5019 42.1469 178.8803 21 Y 4.1416 6.9045 116.2075 61.0962 37.5827 178.3221 22 R 4.1317 7.8003 118.9005 59.7988 30.1355 178.6185 23 N 4.3512 8.4076 115.8433 56.6703 38.5148 177.6413 24 Q 3.9976 8.4575 119.1876 58.7628 28.7828 178.3426 25 A 4.0784 8.6193 122.1761 55.2673 18.4865 179.3647 26 K 3.8887 8.4285 117.2661 60.3135 32.2233 179.6454 27 S 4.1249 7.9584 114.7225 61.3176 62.6201 176.6273 28 L 3.9771 8.2918 123.5792 58.1671 41.7508 178.6877 29 L 4.0992 8.5204 116.5431 56.4360 41.5981 178.7501 30 T 4.1800 7.4742 115.7793 65.9415 69.1588 175.9362 31 H 4.8154 8.6260 114.9881 54.8431 29.9265 175.8013 32 G 4.3823 8.9593 115.3474 45.4513 0.0000 173.5561 33 R 5.1302 7.5512 117.1048 54.4782 32.4446 175.8786 34 I 4.7525 8.9235 122.1949 60.2915 42.3593 173.7455 35 T 5.4385 8.7613 115.6980 59.4442 71.0213 173.0472 36 T 4.7561 8.0912 115.6321 60.4813 72.6487 172.6924 37 T 4.4620 8.1230 110.3014 61.6923 69.7201 175.1348 38 V 3.5288 8.2097 125.6219 66.5340 31.4046 176.0205 39 P 4.1608 0.0000 0.0000 65.7912 31.0989 178.1577 40 K 3.8553 7.9667 116.0041 59.8893 32.1868 178.9287 41 A 3.9433 8.2343 120.7057 55.4327 18.1221 179.6915 42 K 3.7835 8.3396 115.7914 59.5844 32.3101 179.0639 43 E 3.9073 8.4309 119.6610 59.2364 29.7182 178.3422 44 L 3.6800 8.2506 120.7154 58.2520 41.7755 178.4983 45 R 3.8814 8.2473 118.5755 59.9412 29.9711 178.4447 46 G 3.5323 8.1428 104.3436 47.9344 0.0000 175.1417 47 F 3.9721 8.0821 122.3709 60.9200 39.6620 177.2785 48 V 3.6374 8.0289 117.4589 66.1869 31.4035 177.1896 49 D 4.5332 7.7626 118.5122 58.2709 40.8028 178.6277 50 H 4.0632 8.1715 117.5978 59.6574 29.5740 177.1098 51 L 3.7090 8.2341 120.8064 57.8277 41.4370 178.8467 52 I 3.3725 7.6521 118.7566 65.3079 36.8200 177.6175 53 H 3.7976 8.6093 118.6407 58.8622 30.0261 176.8903 54 L 4.0991 7.5244 121.7900 57.9056 41.7608 178.5012 55 A 3.9738 7.7649 119.6287 54.2451 18.1968 179.1108 56 K 3.9406 7.7703 118.2048 59.7831 32.5112 177.5260 57 R 4.4430 7.6722 117.5652 55.4282 33.0129 174.2426 58 G 3.9420 8.2319 104.2103 46.8867 0.0000 173.4105 59 D 4.3397 7.9967 120.5183 52.7709 40.7925 177.7667 60 L 3.8603 8.6042 122.8105 59.4974 40.1451 177.7865 61 H 4.0729 8.5709 118.0226 60.0206 29.4749 176.1106 62 A 3.9871 8.8887 122.8523 55.1260 18.3435 179.6269 63 R 4.1394 8.0128 117.4225 59.9546 29.9709 178.8210 64 R 3.9276 8.7340 117.8636 59.2376 30.3479 178.7336 65 L 4.1140 8.1394 119.0758 57.9941 41.5455 179.8699 66 V 3.6516 7.9358 117.9195 65.5292 31.2252 177.5236 67 L 4.1111 8.0127 119.3677 57.1677 41.8741 178.9489 68 R 4.0982 7.4475 117.1853 59.8119 30.2406 178.1991 69 D 4.5878 7.9275 116.6443 56.5920 41.4032 177.1367 70 L 4.3757 6.9989 118.3970 54.7757 42.3297 176.8740 71 Q 4.4101 8.3038 118.4581 55.6755 31.0083 174.7301 72 D 4.5081 8.0269 118.1349 53.6070 41.7433 176.3706 73 V 3.5739 8.6672 126.5905 66.3483 31.3845 177.6729 74 K 3.8746 8.3302 117.5934 59.7735 31.6490 178.7250 75 L 4.0255 8.0542 120.3350 57.9881 41.9129 179.3649 76 V 3.7012 7.8590 112.6245 64.0512 31.3167 178.6061 77 R 4.0341 8.1079 117.5906 59.3544 30.0429 178.4528 78 K 3.6122 7.7717 119.0089 59.8356 31.9416 178.3166 79 L 3.8192 7.5795 120.2653 58.1141 41.8121 178.9239 80 F 4.0941 8.2748 116.6723 59.4214 39.4554 176.4236 81 D 5.0057 8.9227 118.9309 53.0772 41.1994 176.9064 82 E 5.5106 7.6518 130.9318 56.6149 30.7183 178.0762 83 I 3.8523 7.1589 119.9500 63.6323 37.4045 177.6841 84 A 3.9342 8.6521 122.1684 55.0307 18.2734 177.5492 85 P 4.1398 0.0000 0.0000 66.1931 31.2044 178.6902 86 R 3.7935 7.2474 115.0578 59.2329 30.0214 177.7470 87 Y 4.6739 7.2290 112.7762 56.8489 38.5727 175.9321 88 R 3.9590 7.1845 120.8706 57.8462 30.6776 175.2596 89 D 4.4490 9.1285 120.0848 54.7698 37.8510 174.7263 90 R 4.3204 7.9235 118.8164 55.6847 32.0546 174.4029 91 Q 4.2302 8.7651 126.3011 55.4002 28.0163 176.9348 92 G 3.0762 8.8223 114.3704 45.5676 0.0000 172.2652 93 G 3.6513 7.8461 107.9510 46.8209 0.0000 174.4790 94 Y 3.9732 6.0442 114.1035 58.7508 38.4499 175.6000 95 T 4.9854 7.6173 115.9177 61.7770 72.4810 173.3371 96 R 4.6581 8.8258 125.8205 54.7833 33.6916 175.2845 97 V 5.0954 8.0257 116.1279 58.9894 34.0907 174.1019 98 L 4.4587 8.2492 125.4748 53.4774 43.5167 176.1440 99 K 4.4326 8.5410 123.1973 55.9820 32.5721 177.0266 100 L 4.1874 8.1972 125.3040 54.4407 42.3005 176.8732 101 A 4.5063 8.4729 124.4990 51.9857 19.2873 176.4069 102 E 4.7055 7.7619 118.9172 55.4639 33.0392 174.5454 103 R 4.6579 8.5831 125.6473 54.7424 31.7683 176.2804 104 R 3.9517 9.0467 124.4251 57.0469 29.7398 175.6286 105 R 4.4129 8.6828 125.0252 56.3735 31.3905 176.2682 106 G 4.0716 9.1863 110.2590 46.1996 0.0000 173.3410 107 D 4.3348 7.9950 117.5667 52.1143 42.8529 176.3844 108 G 3.8964 8.0692 106.3029 46.3355 0.0000 173.3165 109 A 4.3038 8.3925 122.6951 50.6540 19.6230 175.9670 110 P 4.6482 0.0000 0.0000 62.7594 32.4765 176.4355 111 L 4.7128 8.1188 123.9186 54.0248 44.6596 174.6967 112 A 4.5263 8.2740 120.4400 51.7177 23.6142 174.8653 113 L 4.9600 9.2126 121.1043 53.5902 44.8235 175.3483 114 V 4.6955 8.9341 127.4307 61.7323 33.6596 174.3377 115 E 5.1882 8.6870 126.9935 54.6286 33.6046 173.8353 116 L 4.6593 9.0044 128.0646 54.7165 41.9127 177.6036 117 V 3.8684 8.5823 124.8075 62.2483 32.2658 176.1760 118 E 4.5679 8.4911 121.0804 57.2275 29.5244 175.6592 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 2 R 8.25 4.28 0.00 1.88 1.97 0.00 3.00 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.70 0.00 3 H 8.02 4.70 0.00 3.28 3.04 0.00 5.72 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.51 3.91 0.00 1.84 1.79 0.93 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.79 3.98 0.00 1.79 1.91 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.47 7.81 6 S 7.36 4.63 0.00 3.93 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 8.82 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 0.00 0.00 0.00 8 R 10.51 4.16 0.00 1.93 2.17 0.00 3.31 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 9 K 7.36 4.59 0.00 1.87 1.74 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.52 1.44 7.81 10 L 7.66 5.02 0.00 1.84 1.83 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.23 4.77 0.00 2.69 2.73 0.00 0.00 7.15 7.65 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 12 R 9.88 3.64 0.00 1.82 1.86 0.00 2.94 0.00 0.00 2.79 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.48 0.00 13 H 7.87 5.04 0.00 3.32 3.40 0.00 5.70 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 14 S 8.77 4.03 0.00 4.07 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 15 S 8.06 4.06 0.00 4.08 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 16 H 8.09 4.02 0.00 2.97 3.02 0.00 5.85 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.20 3.56 0.00 1.62 1.94 0.00 3.11 0.00 0.00 3.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.98 0.00 18 L 7.41 3.56 0.00 1.68 1.82 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.15 3.97 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 20 L 7.12 3.74 0.00 1.52 1.33 0.84 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 6.90 4.14 0.00 2.21 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 22 R 7.80 4.13 0.00 2.05 2.17 0.00 3.19 0.00 0.00 3.43 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 23 N 8.41 4.35 0.00 2.92 2.89 0.00 0.00 7.16 6.92 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 24 Q 8.46 4.00 0.00 2.36 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 25 A 8.62 4.08 1.61 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 0.00 0.00 26 K 8.43 3.89 0.00 2.01 1.92 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.79 7.81 27 S 7.96 4.12 0.00 3.97 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 28 L 8.29 3.98 0.00 1.84 1.85 0.96 0.60 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 29 L 8.52 4.10 0.00 1.81 1.69 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.47 4.18 4.19 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 0.88 0.00 0.00 31 H 8.63 4.82 0.00 3.21 3.32 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.96 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 33 R 7.55 5.13 0.00 1.70 1.87 0.00 3.31 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 34 I 8.92 4.75 1.90 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 1.34 0.69 0.94 0.00 0.00 35 T 8.76 5.44 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 36 T 8.09 4.76 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 1.23 0.00 0.00 37 T 8.12 4.46 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 38 V 8.21 3.53 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 0.88 0.00 0.00 0.97 0.00 0.00 39 P 0.00 4.16 0.00 2.20 2.04 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 40 K 7.97 3.86 0.00 1.73 1.94 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.51 7.81 41 A 8.23 3.94 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 42 K 8.34 3.78 0.00 1.87 1.88 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.61 7.81 43 E 8.43 3.91 0.00 2.02 1.85 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 2.22 2.00 0.00 44 L 8.25 3.68 0.00 1.71 1.94 0.95 0.99 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 45 R 8.25 3.88 0.00 2.04 2.05 0.00 3.11 0.00 0.00 3.14 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 46 G 8.14 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 47 F 8.08 3.97 0.00 2.74 3.17 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 48 V 8.03 3.64 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 0.85 0.00 0.00 1.05 0.00 0.00 49 D 7.76 4.53 0.00 2.84 2.78 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 50 H 8.17 4.06 0.00 3.22 3.23 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 51 L 8.23 3.71 0.00 1.70 1.52 0.33 0.62 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 52 I 7.65 3.37 1.69 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 1.61 0.85 0.07 0.00 0.00 53 H 8.61 3.80 0.00 3.41 3.36 0.00 5.75 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.52 4.10 0.00 1.86 1.60 0.89 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.76 3.97 0.45 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 56 K 7.77 3.94 0.00 1.60 1.82 0.00 1.68 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.33 1.42 7.81 57 R 7.67 4.44 0.00 1.89 2.08 0.00 3.50 0.00 0.00 3.24 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 58 G 8.23 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 59 D 8.00 4.34 0.00 2.92 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 60 L 8.60 3.86 0.00 1.80 1.91 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.57 4.07 0.00 3.19 3.62 0.00 5.69 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.89 3.99 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 63 R 8.01 4.14 0.00 1.58 1.98 0.00 2.75 0.00 0.00 3.00 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.88 0.00 64 R 8.73 3.93 0.00 1.80 1.98 0.00 3.22 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 65 L 8.14 4.11 0.00 1.82 1.71 0.85 0.69 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 66 V 7.94 3.65 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 0.96 0.00 0.00 0.80 0.00 0.00 67 L 8.01 4.11 0.00 1.88 1.85 0.94 1.21 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 68 R 7.45 4.10 0.00 2.10 2.00 0.00 3.23 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 69 D 7.93 4.59 0.00 2.66 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 70 L 7.00 4.38 0.00 1.63 1.63 0.88 0.90 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 71 Q 8.30 4.41 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.00 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 72 D 8.03 4.51 0.00 2.77 2.56 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 73 V 8.67 3.57 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 1.03 0.00 0.00 0.95 0.00 0.00 74 K 8.33 3.87 0.00 2.00 1.89 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.54 7.81 75 L 8.05 4.03 0.00 1.71 1.82 0.92 1.03 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 76 V 7.86 3.70 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 0.93 0.00 0.00 1.17 0.00 0.00 77 R 8.11 4.03 0.00 2.05 2.02 0.00 3.18 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.90 0.00 78 K 7.77 3.61 0.00 1.81 2.05 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.48 7.81 79 L 7.58 3.82 0.00 1.75 1.35 0.59 0.71 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 80 F 8.27 4.09 0.00 3.06 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 81 D 8.92 5.01 0.00 2.57 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 82 E 7.65 5.51 0.00 1.93 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 0.00 2.00 2.05 0.00 83 I 7.16 3.85 1.93 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 1.65 0.87 1.00 0.00 0.00 84 A 8.65 3.93 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 85 P 0.00 4.14 0.00 2.11 2.11 0.00 3.48 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 86 R 7.25 3.79 0.00 1.35 1.49 0.00 3.02 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 87 Y 7.23 4.67 0.00 2.81 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 88 R 7.18 3.96 0.00 1.92 1.85 0.00 3.43 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 89 D 9.13 4.45 0.00 2.89 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 90 R 7.92 4.32 0.00 1.87 2.29 0.00 3.50 0.00 0.00 3.51 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.71 0.00 91 Q 8.77 4.23 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.67 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 92 G 8.82 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 0.00 0.00 0.00 93 G 7.85 3.65 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 0.00 0.00 0.00 94 Y 6.04 3.97 0.00 2.89 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 0.00 0.00 0.00 0.00 95 T 7.62 4.99 4.32 0.00 0.00 0.00 0.00 0.00 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 96 R 8.83 4.66 0.00 1.88 1.74 0.00 3.05 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 97 V 8.03 5.10 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 0.91 0.00 0.00 0.91 0.00 0.00 98 L 8.25 4.46 0.00 1.60 1.58 0.93 0.95 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 99 K 8.54 4.43 0.00 1.64 1.76 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.41 7.81 100 L 8.20 4.19 0.00 1.70 1.60 0.92 0.75 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 0.00 101 A 8.47 4.51 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 0.00 102 E 7.76 4.71 0.00 2.00 1.75 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 2.26 2.31 0.00 103 R 8.58 4.66 0.00 1.73 1.84 0.00 3.28 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 104 R 9.05 3.95 0.00 2.03 2.08 0.00 3.13 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 105 R 8.68 4.41 0.00 1.88 1.76 0.00 3.33 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 106 G 9.19 4.07 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 0.00 0.00 0.00 107 D 8.00 4.33 0.00 2.76 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 0.00 108 G 8.07 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 0.00 0.00 0.00 109 A 8.39 4.30 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 0.00 110 P 0.00 4.65 0.00 2.13 2.21 0.00 3.69 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 111 L 8.12 4.71 0.00 1.85 1.65 0.92 0.61 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 0.00 112 A 8.27 4.53 1.25 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 0.00 0.00 0.00 113 L 9.21 4.96 0.00 1.70 1.64 1.00 0.73 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 0.00 114 V 8.93 4.70 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 0.84 0.00 0.00 0.94 0.00 0.00 115 E 8.69 5.19 0.00 2.10 1.73 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 2.25 2.33 0.00 116 L 9.00 4.66 0.00 1.61 1.83 1.01 1.00 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 0.00 117 V 8.58 3.87 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 0.79 0.00 0.00 0.98 0.00 0.00 118 E 8.49 4.57 0.00 1.93 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 2.08 2.25 0.00