NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 59 R 4.2918 8.2549 120.8661 56.1059 31.2203 174.6895 60 I 4.4166 8.1004 124.5278 58.2162 40.0887 173.0215 61 P 4.4001 0.0000 0.0000 63.1258 32.6005 176.1532 62 L 4.4261 8.4100 120.2157 55.7878 42.4925 177.2432 63 S 4.7653 7.8900 114.7664 57.0922 64.2496 174.3163 64 C 3.8742 8.5147 119.6809 58.4715 31.0512 174.8790 65 T 3.8065 7.8446 113.6756 65.3790 68.0471 176.7360 66 I 3.6342 7.4368 121.7147 64.4323 37.2533 178.0900 67 C 4.3014 7.9432 116.9883 62.4705 27.6840 175.9810 68 R 3.8596 7.6422 119.6826 59.5823 29.8455 178.5357 69 K 4.1200 7.9574 116.8578 59.4441 32.1003 179.3203 70 R 4.0409 8.3042 117.6731 56.5276 30.1979 176.6677 71 K 3.8634 8.0427 116.7028 57.8415 29.6824 175.7566 72 V 4.4529 7.5586 109.6762 58.8320 34.8200 175.4464 73 K 4.0970 8.3945 122.6213 56.3551 32.5150 175.5092 74 C 4.5499 8.5471 126.6031 58.1756 32.8637 173.2750 75 D 4.5302 8.7837 125.0086 53.1512 39.4836 176.5110 76 K 4.1943 7.4482 116.8628 56.1832 30.4405 174.8502 77 L 4.3357 7.5794 116.5037 54.3112 42.4117 176.8623 78 R 4.8251 8.0743 120.8739 53.6735 32.4687 174.8714 79 P 4.4283 0.0000 0.0000 65.1841 31.7256 176.4902 80 H 5.1158 7.7564 114.5399 53.0327 32.4351 173.4832 81 C 4.6889 8.5139 118.1650 58.2808 31.8223 174.9768 82 Q 4.1353 9.2889 120.8610 58.6271 28.1225 179.2287 83 Q 3.9701 7.7361 119.4418 59.1671 28.7080 178.3983 84 C 4.1999 7.8700 118.5160 62.4606 28.2507 175.8217 85 T 3.8737 7.9121 117.3054 66.9757 67.9282 176.7770 86 K 4.0337 8.3314 119.1741 59.0682 31.8263 178.5391 87 T 4.3750 7.7469 108.1373 61.2752 68.8883 176.0637 88 G 3.9930 8.0210 109.7950 46.3024 0.0000 174.3367 89 V 4.4040 7.9081 111.7925 60.5286 32.4220 177.8186 90 A 4.0153 8.2591 126.3372 55.5921 18.1621 180.1204 91 H 4.3393 8.2592 109.0917 57.2757 28.7299 175.7499 92 L 4.4030 7.8690 119.1795 54.4567 42.3339 175.4490 93 C 4.4485 7.7228 121.2017 58.8006 31.8653 172.3945 94 H 5.0012 8.2566 120.4597 54.5304 31.4751 171.6974 95 Y 4.8569 8.5352 116.7122 56.3230 40.9432 175.3754 96 M 4.3351 8.7900 121.9128 55.6492 32.7213 176.3173 97 E 4.6335 8.3763 119.7836 56.3850 31.3526 175.4276 98 Q 4.5827 7.6172 116.2148 53.2216 33.3174 174.4576 99 T 4.2212 8.5802 109.9751 61.4905 70.5761 175.1642 100 W 4.0444 8.8239 130.3919 60.3801 30.7236 177.9180 101 A 4.0828 8.3623 120.4600 55.2894 18.1434 179.2342 102 E 3.8883 8.3096 117.1638 59.4075 29.4898 179.3610 103 E 3.7547 8.1872 118.9982 59.1888 29.7500 178.4680 104 A 3.5501 7.3038 120.9074 55.1985 18.2475 179.2767 105 E 3.8218 7.9649 117.5666 59.0210 29.6657 178.9925 106 K 3.8989 7.7062 119.4918 59.5385 32.3426 178.6774 107 E 4.0619 8.2317 118.2732 58.6455 29.4154 179.2706 108 L 4.0026 7.5255 119.4041 57.6507 41.6320 179.2748 109 L 4.0486 7.7833 118.5058 57.4355 41.4126 179.7146 110 K 3.9348 7.8973 118.6056 59.4285 32.0007 178.7875 111 D 4.3632 8.0031 119.2024 57.6830 40.7912 178.7449 112 N 4.3237 8.0018 116.6989 56.7417 38.9803 176.8130 113 E 3.9690 8.5229 120.4013 59.0153 29.4249 179.1192 114 L 3.8994 8.2410 120.8969 57.9569 42.2926 178.7375 115 K 3.8450 7.9704 119.5393 59.7651 32.1223 178.8580 116 K 4.1968 8.2146 118.4338 59.1919 31.8006 179.5409 117 L 3.9258 7.8751 119.4951 57.8918 41.7041 179.3114 118 R 3.9533 8.1336 118.6503 59.5760 29.8979 178.3810 119 E 4.0196 8.1729 118.3504 59.1925 29.4779 179.1808 120 R 3.9465 7.9626 118.9718 59.1900 30.0466 178.7453 121 V 3.6463 8.2547 118.7221 65.6511 31.4842 178.1545 122 K 4.0798 7.8823 117.8062 59.5529 31.7441 178.8187 123 S 4.0697 7.7628 111.7655 61.8421 62.6660 175.7987 124 L 4.0809 8.4741 121.7121 58.1018 41.3573 179.4895 125 E 4.0567 8.6476 117.4236 59.3906 29.3162 178.7828 126 K 4.5998 8.3529 116.3073 56.8155 32.0418 177.7550 127 T 4.5536 7.6276 115.3269 63.0668 70.8871 173.9164 128 L 4.1341 8.0013 127.6332 55.1762 42.0267 176.1742 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 59 R 8.25 4.29 0.00 1.79 1.92 0.00 3.21 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.75 0.00 60 I 8.10 4.42 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.94 1.01 0.00 0.00 61 P 0.00 4.40 0.00 2.09 2.04 0.00 3.74 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 2.10 2.17 0.00 62 L 8.41 4.43 0.00 1.67 1.74 0.93 0.89 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 63 S 7.89 4.77 0.00 3.89 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 64 C 8.51 3.87 0.00 2.62 2.09 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 65 T 7.84 3.81 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 1.16 0.00 0.00 66 I 7.44 3.63 1.78 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.68 0.87 0.00 0.00 67 C 7.94 4.30 0.00 3.07 3.13 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 68 R 7.64 3.86 0.00 2.04 2.00 0.00 3.34 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 69 K 7.96 4.12 0.00 1.98 1.85 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.49 7.81 70 R 8.30 4.04 0.00 1.90 1.98 0.00 3.26 0.00 0.00 3.21 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 71 K 8.04 3.86 0.00 1.92 1.94 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.55 7.81 72 V 7.56 4.45 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 0.76 0.00 0.00 0.98 0.00 0.00 73 K 8.39 4.10 0.00 1.70 1.72 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.50 7.81 74 C 8.55 4.55 0.00 3.02 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 75 D 8.78 4.53 0.00 2.89 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 76 K 7.45 4.19 0.00 1.96 1.83 0.00 1.84 0.00 0.00 1.57 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.60 1.47 7.81 77 L 7.58 4.34 0.00 1.86 1.62 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 78 R 8.07 4.83 0.00 1.73 1.80 0.00 3.24 0.00 0.00 2.99 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.37 0.00 79 P 0.00 4.43 0.00 1.89 2.11 0.00 3.70 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 1.84 1.93 0.00 80 H 7.76 5.12 0.00 3.16 3.19 0.00 5.70 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 C 8.51 4.69 0.00 3.55 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 82 Q 9.29 4.14 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.85 0.00 0.00 0.00 0.00 0.00 2.41 2.56 0.00 83 Q 7.74 3.97 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 84 C 7.87 4.20 0.00 3.10 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 85 T 7.91 3.87 4.33 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 1.23 0.00 0.00 86 K 8.33 4.03 0.00 1.84 1.88 0.00 1.73 0.00 0.00 1.76 0.00 0.00 3.19 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.50 7.81 87 T 7.75 4.38 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 1.21 0.00 0.00 88 G 8.02 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 89 V 7.91 4.40 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 0.75 0.00 0.00 0.97 0.00 0.00 90 A 8.26 4.02 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 91 H 8.26 4.34 0.00 3.27 3.39 0.00 5.49 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.87 4.40 0.00 1.55 1.61 0.85 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.72 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 94 H 8.26 5.00 0.00 3.25 3.31 0.00 5.66 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Y 8.54 4.86 0.00 3.01 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 96 M 8.79 4.34 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.61 0.00 97 E 8.38 4.63 0.00 1.97 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 2.26 2.29 0.00 98 Q 7.62 4.58 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.04 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 99 T 8.58 4.22 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 1.28 0.00 0.00 100 W 8.82 4.04 0.00 3.47 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 0.00 101 A 8.36 4.08 1.53 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 0.00 102 E 8.31 3.89 0.00 2.18 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 0.00 2.34 2.35 0.00 103 E 8.19 3.75 0.00 2.12 1.67 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 2.20 2.25 0.00 104 A 7.30 3.55 0.33 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 0.00 105 E 7.96 3.82 0.00 2.04 2.09 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 2.27 2.31 0.00 106 K 7.71 3.90 0.00 1.96 1.88 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.44 7.81 107 E 8.23 4.06 0.00 1.91 1.91 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 2.36 2.40 0.00 108 L 7.53 4.00 0.00 1.90 1.67 0.89 0.88 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 0.00 109 L 7.78 4.05 0.00 1.81 1.69 0.90 1.27 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 0.00 110 K 7.90 3.93 0.00 1.98 1.83 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.50 7.81 111 D 8.00 4.36 0.00 3.01 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 0.00 112 N 8.00 4.32 0.00 2.85 2.79 0.00 0.00 7.30 7.12 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 0.00 113 E 8.52 3.97 0.00 2.29 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 2.31 2.35 0.00 114 L 8.24 3.90 0.00 1.96 1.75 0.91 0.55 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 0.00 115 K 7.97 3.84 0.00 1.87 1.96 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.44 1.49 7.81 116 K 8.21 4.20 0.00 1.98 1.84 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.78 7.81 117 L 7.88 3.93 0.00 1.91 1.70 0.91 0.60 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 0.00 118 R 8.13 3.95 0.00 1.87 1.93 0.00 3.09 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 1.63 1.68 0.00 119 E 8.17 4.02 0.00 2.27 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 2.32 2.38 0.00 120 R 7.96 3.95 0.00 2.01 2.07 0.00 3.14 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 121 V 8.25 3.65 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 1.09 0.00 0.00 0.96 0.00 0.00 122 K 7.88 4.08 0.00 2.05 1.84 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.49 7.81 123 S 7.76 4.07 0.00 4.04 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 0.00 124 L 8.47 4.08 0.00 1.90 1.69 0.92 0.85 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 0.00 125 E 8.65 4.06 0.00 2.17 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 2.64 2.35 0.00 126 K 8.35 4.60 0.00 1.88 1.86 0.00 1.63 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.52 7.81 127 T 7.63 4.55 4.60 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 1.23 0.00 0.00 128 L 8.00 4.13 0.00 1.71 1.54 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00