NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 V 4.0381 8.0549 120.3887 62.3507 32.7520 174.3493 29 R 3.9652 8.2390 120.6605 55.0541 30.5743 174.9174 30 T 4.3775 8.8762 117.8722 60.6100 69.5603 174.0619 31 K 4.2502 8.3764 126.9192 56.5000 32.7482 177.1022 32 K 4.4241 8.5052 123.2865 55.4584 33.6447 176.7738 33 V 3.6257 8.2539 122.9147 62.2226 31.7359 174.3489 34 P 4.2717 0.0000 0.0000 63.0711 31.6496 176.5057 35 L 4.0984 8.3021 125.2401 53.6151 40.7796 174.6086 36 D 4.7524 7.8692 123.5952 51.6975 42.6456 176.7331 37 T 3.9053 8.5323 115.0727 66.9056 68.3713 175.9174 38 N 4.5174 8.2863 117.2338 55.6242 39.0233 175.0728 39 H 5.3566 8.1993 112.3212 54.5657 31.0116 175.1076 40 K 3.9590 8.3790 121.9378 59.8099 31.7854 178.5909 41 R 3.8068 7.7984 115.4825 59.1917 29.1220 178.7478 42 F 4.4286 7.6698 118.1968 60.4763 38.9783 177.0973 43 Y 3.4793 8.4246 115.9917 61.1624 37.5766 178.5313 44 D 4.3518 8.5408 119.5434 57.2734 40.9594 178.6636 45 A 4.0045 8.2710 121.4741 55.1368 18.4369 179.2696 46 F 4.1914 8.5429 119.2385 61.6414 39.1949 177.2642 47 A 3.8872 7.9585 118.6241 54.4848 18.1987 178.5566 48 Q 4.3183 7.3854 114.3026 55.6896 29.3066 176.5142 49 G 3.9046 7.7707 108.3379 44.6327 0.0000 174.0630 50 A 4.1070 7.8453 122.8927 52.0853 19.1147 178.7373 51 G 3.8931 8.5813 108.5198 44.4690 0.0000 175.3168 52 K 4.1645 8.8065 122.8160 59.1773 32.2712 179.8433 53 L 4.1644 7.9254 119.0025 57.8921 41.4114 178.9929 54 D 4.4345 8.0667 117.2965 57.3533 41.1792 178.3882 55 L 4.2785 8.0902 119.4891 57.9965 41.2413 179.1105 56 D 4.3195 8.4733 119.1960 57.6326 40.6882 179.2689 57 R 3.9797 7.9470 117.9630 59.3491 29.9282 179.0776 58 Q 4.1321 8.0954 117.4795 58.7233 28.6679 178.2942 59 C 3.9845 7.6599 118.0235 62.6093 27.8380 176.1032 60 V 3.9998 7.1619 119.7872 65.0978 31.0633 177.2583 61 E 4.1266 7.6880 118.2004 59.3674 29.6086 177.3930 62 C 4.4673 8.0057 114.5346 61.0814 31.1548 173.2670 63 H 4.8259 8.6438 117.9928 54.0958 28.4998 174.2095 64 H 4.9262 7.5416 118.2656 54.4086 32.2306 172.6612 65 E 4.5831 8.8876 117.8119 55.1374 30.3277 176.5879 66 K 3.9413 8.2948 119.6932 56.1370 32.8068 174.7311 67 P 4.5766 0.0000 0.0000 62.3365 33.0412 176.2148 68 G 3.7949 8.7916 108.6315 45.4777 0.0000 173.9174 69 G 3.4875 8.3396 106.1449 44.6904 0.0000 173.0141 70 I 4.1538 7.8907 122.2035 58.5138 37.8504 173.5997 71 P 4.9632 0.0000 0.0000 61.5762 32.0256 176.6251 72 F 4.3014 8.1667 118.4118 56.7010 39.7605 173.6295 73 P 4.5990 0.0000 0.0000 61.5127 32.0041 176.1688 74 K 4.1030 8.2860 118.9389 58.8822 32.5436 177.1574 75 N 4.5791 8.9521 117.9934 53.3679 36.8666 174.3491 76 H 4.0419 7.7145 117.5689 55.4630 30.3778 173.0186 77 P 4.1700 0.0000 0.0000 63.0768 31.6820 175.7725 78 V 4.1446 7.6907 119.6991 60.4302 33.8030 175.2628 79 K 4.0434 8.1582 124.1774 55.3784 32.5291 174.8207 80 P 4.5207 0.0000 0.0000 62.0217 32.4531 176.3208 81 A 4.0248 8.5064 121.2054 54.5192 18.4796 177.5202 82 D 4.5905 7.9900 116.0134 53.5507 41.6869 177.4607 83 G 3.9706 8.6786 112.1062 43.8764 0.0000 170.5636 84 P 4.4502 0.0000 0.0000 61.8780 32.0550 175.9909 85 M 3.9972 8.4317 119.2769 56.3690 32.8532 177.5277 86 R 4.5855 8.1715 125.6792 54.0013 29.2614 176.3963 87 C 4.0508 8.2630 120.0013 62.9124 28.6136 176.2082 88 L 4.4136 7.9041 115.3797 55.2608 41.4795 178.0041 89 F 4.4952 8.1357 121.5729 60.6934 39.5882 175.9399 90 C 3.9779 7.9497 116.1150 60.7650 28.8819 172.7857 91 H 4.7759 8.1660 117.9405 53.6499 29.2372 174.6436 92 K 4.0822 8.1712 123.0211 55.7913 33.3181 176.8702 93 F 4.3783 8.0876 121.6789 57.5116 39.4675 175.6132 94 K 4.3869 9.4954 122.2448 56.4963 33.0436 177.0986 95 L 3.7756 8.5483 115.9340 56.2357 38.8517 174.5513 96 E 4.8967 7.5240 113.4887 55.2164 31.9172 175.8932 97 H 4.3638 8.5188 119.3328 56.6822 30.0884 173.0795 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 28 V 8.05 4.04 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 0.98 0.00 0.00 0.92 0.00 0.00 29 R 8.24 3.97 0.00 1.91 1.82 0.00 3.24 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 30 T 8.88 4.38 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 31 K 8.38 4.25 0.00 1.71 1.73 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.49 7.81 32 K 8.51 4.42 0.00 1.67 1.84 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.55 1.42 7.81 33 V 8.25 3.63 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 0.81 0.00 0.00 0.49 0.00 0.00 34 P 0.00 4.27 0.00 2.19 2.02 0.00 3.38 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 35 L 8.30 4.10 0.00 1.20 1.46 0.12 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 36 D 7.87 4.75 0.00 2.87 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 37 T 8.53 3.91 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 1.20 0.00 0.00 38 N 8.29 4.52 0.00 2.88 2.76 0.00 0.00 6.68 8.16 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 39 H 8.20 5.36 0.00 3.71 3.76 0.00 5.83 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.38 3.96 0.00 1.96 1.82 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.46 7.81 41 R 7.80 3.81 0.00 1.85 1.97 0.00 2.76 0.00 0.00 3.06 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.56 0.00 42 F 7.67 4.43 0.00 3.67 3.41 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 43 Y 8.42 3.48 0.00 3.28 2.99 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 44 D 8.54 4.35 0.00 2.82 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 45 A 8.27 4.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 8.54 4.19 0.00 2.92 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 7.96 3.89 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 48 Q 7.39 4.32 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.57 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 49 G 7.77 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 50 A 7.85 4.11 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 51 G 8.58 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 0.00 0.00 0.00 52 K 8.81 4.16 0.00 1.89 1.90 0.00 1.81 0.00 0.00 1.85 0.00 0.00 3.19 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.81 7.81 53 L 7.93 4.16 0.00 1.71 1.72 0.91 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.07 4.43 0.00 2.87 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.09 4.28 0.00 1.94 1.83 1.26 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.47 4.32 0.00 2.84 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 57 R 7.95 3.98 0.00 2.00 2.01 0.00 3.15 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.01 0.00 58 Q 8.10 4.13 0.00 2.47 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.52 2.51 0.00 59 C 7.66 3.98 0.00 2.87 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 60 V 7.16 4.00 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 1.19 0.00 0.00 1.03 0.00 0.00 61 E 7.69 4.13 0.00 2.08 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 2.40 2.53 0.00 62 C 8.01 4.47 0.00 2.74 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 63 H 8.64 4.83 0.00 3.10 2.75 0.00 5.63 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 64 H 7.54 4.93 0.00 3.17 3.54 0.00 5.45 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 E 8.89 4.58 0.00 2.06 1.98 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 2.38 2.49 0.00 66 K 8.29 3.94 0.00 1.76 1.80 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.49 7.81 67 P 0.00 4.58 0.00 2.18 2.05 0.00 3.87 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 68 G 8.79 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 0.00 0.00 0.00 69 G 8.34 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.89 4.15 1.55 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.02 0.78 0.00 0.00 71 P 0.00 4.96 0.00 2.16 2.00 0.00 3.27 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.90 0.00 72 F 8.17 4.30 0.00 3.04 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 73 P 0.00 4.60 0.00 2.25 2.02 0.00 3.82 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 2.21 2.13 0.00 74 K 8.29 4.10 0.00 1.88 1.86 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.44 7.81 75 N 8.95 4.58 0.00 2.93 3.12 0.00 0.00 6.92 8.16 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 76 H 7.71 4.04 0.00 3.34 3.21 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 77 P 0.00 4.17 0.00 1.86 1.86 0.00 2.85 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.93 0.00 78 V 7.69 4.14 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 0.76 0.00 0.00 0.88 0.00 0.00 79 K 8.16 4.04 0.00 1.71 1.67 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.16 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.47 7.81 80 P 0.00 4.52 0.00 2.19 2.02 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.92 0.00 81 A 8.51 4.02 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 82 D 7.99 4.59 0.00 2.64 2.60 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 83 G 8.68 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 0.00 0.00 0.00 84 P 0.00 4.45 0.00 2.19 2.07 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 85 M 8.43 4.00 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 86 R 8.17 4.59 0.00 1.93 1.88 0.00 3.29 0.00 0.00 3.04 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 87 C 8.26 4.05 0.00 2.99 2.92 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 88 L 7.90 4.41 0.00 1.51 1.41 0.78 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.14 4.50 0.00 2.87 3.22 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 90 C 7.95 3.98 0.00 2.77 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 91 H 8.17 4.78 0.00 2.93 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.17 4.08 0.00 1.61 1.67 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.35 7.81 93 F 8.09 4.38 0.00 2.74 2.60 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 94 K 9.50 4.39 0.00 2.08 1.90 0.00 1.93 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.58 7.81 95 L 8.55 3.78 0.00 2.02 1.88 0.91 0.87 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 96 E 7.52 4.90 0.00 2.11 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 0.00 2.61 2.59 0.00 97 H 8.52 4.36 0.00 3.08 3.12 0.00 5.95 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