NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 54 K 4.2428 8.3144 121.7884 56.3261 33.5770 176.4095 55 V 3.8073 8.0127 118.8935 62.6775 33.7520 172.9410 56 E 4.0944 8.5093 117.4636 55.2949 29.2715 176.8678 57 R 4.4441 8.4590 113.0575 55.9326 33.3146 171.9892 58 K 4.4182 8.6560 125.3199 54.1367 33.4828 176.2161 59 A 4.1638 8.5143 127.2781 51.6024 18.9795 174.4817 60 P 4.6233 0.0000 0.0000 61.8190 32.6282 175.8543 61 D 4.4952 8.4503 120.2301 52.6962 42.4008 174.5970 62 A 4.3554 8.1780 127.1304 50.8962 21.4663 178.6509 63 G 3.6603 8.1278 101.6582 45.8097 0.0000 174.2069 64 G 4.3729 7.8067 115.3173 45.7269 0.0000 168.5856 65 C 4.8867 8.5089 113.6728 56.7690 33.4712 172.7126 66 L 4.5851 8.3109 122.3016 54.4365 42.5825 175.7038 67 H 4.3874 9.2465 127.1428 55.8986 29.9756 174.7734 68 A 3.9594 8.5665 128.6379 55.1551 18.5156 177.4744 69 D 4.6269 6.8455 115.0167 52.6561 42.4450 174.5718 70 P 4.2180 0.0000 0.0000 66.0565 31.4368 178.2039 71 D 4.4990 8.5586 116.6098 56.6621 41.1209 177.7902 72 L 4.4412 7.8113 117.4499 55.0602 44.0712 178.2655 73 G 3.6369 8.5344 109.5340 45.8549 0.0000 173.1443 74 V 4.0434 8.4674 122.3197 63.8715 31.9313 175.5127 75 L 4.8231 9.5456 127.4934 53.2415 44.5364 175.7518 76 C 4.8283 8.5758 120.6072 56.8318 31.2255 171.8814 77 P 4.1638 0.0000 0.0000 63.4335 31.3648 177.4946 78 T 4.2776 8.4133 113.4294 61.1974 70.8520 175.7186 79 G 3.5849 8.4983 107.5860 47.9888 0.0000 175.5501 80 C 4.2722 8.2807 119.1801 62.7639 28.1416 175.8514 81 Q 3.9999 8.1597 118.9395 59.7506 28.3264 178.8934 82 L 3.9554 8.2256 119.5113 58.0891 41.4829 179.0860 83 Q 3.7725 9.3543 121.0836 60.6421 29.0702 179.8767 84 E 3.9583 8.8798 118.5627 61.4721 29.6718 181.3788 85 A 4.2455 7.9755 120.5973 55.4701 18.5576 179.0659 86 L 3.9971 8.4206 118.2134 57.6043 41.8452 179.2594 87 L 3.6991 8.2397 122.2038 58.2016 41.6257 180.1041 88 Q 4.2268 7.8016 119.3732 59.0574 28.1797 182.6021 89 Q 4.6508 8.5215 116.5791 57.9410 30.0818 176.2442 90 E 3.8198 8.1643 119.4759 57.9829 29.3696 179.4850 91 R 3.7574 7.6340 116.5781 58.4375 31.0015 176.3091 92 P 4.2497 0.0000 0.0000 66.8085 31.0427 177.6124 93 I 3.6646 8.3384 119.8819 63.7164 36.9379 178.8300 94 R 3.8329 7.5838 117.7753 59.4131 30.3413 178.4619 95 N 4.2727 8.1729 116.0199 56.5358 38.4293 177.3858 96 S 4.1522 7.9599 115.4356 61.9653 63.2682 177.2089 97 V 3.7265 8.1577 120.8152 66.2253 31.2779 177.9467 98 D 4.4935 8.3949 117.0892 56.4153 40.7210 177.4057 99 E 4.3006 8.5949 121.0465 58.2502 29.9814 178.0202 100 L 4.3020 8.2604 122.3615 57.6362 40.9563 183.6705 101 N 4.2760 7.6740 115.0118 56.1218 38.5237 176.7397 102 N 4.2340 8.1068 117.8274 55.8876 38.7006 177.0208 103 N 4.5818 8.3973 113.4062 55.1147 38.8977 176.5154 104 V 3.8767 7.8099 117.6328 63.8396 32.0433 175.5440 105 E 4.2758 7.6378 120.8671 56.4206 29.4832 175.3888 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 54 K 8.31 4.24 0.00 1.73 1.87 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.44 7.81 55 V 8.01 3.81 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 0.80 0.00 0.00 0.93 0.00 0.00 56 E 8.51 4.09 0.00 1.93 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 2.20 2.33 0.00 57 R 8.46 4.44 0.00 1.77 1.78 0.00 3.30 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.50 0.00 58 K 8.66 4.42 0.00 1.76 1.72 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.34 7.81 59 A 8.51 4.16 1.24 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 0.00 0.00 60 P 0.00 4.62 0.00 2.18 2.05 0.00 3.71 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 1.94 1.97 0.00 61 D 8.45 4.50 0.00 2.62 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.18 4.36 1.23 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 0.00 0.00 63 G 8.13 3.66 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 0.00 0.00 0.00 64 G 7.81 4.37 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 0.00 65 C 8.51 4.89 0.00 2.92 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 66 L 8.31 4.59 0.00 1.68 1.61 0.92 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 67 H 9.25 4.39 0.00 3.23 3.46 0.00 5.84 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.57 3.96 1.17 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 0.00 0.00 69 D 6.85 4.63 0.00 2.79 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.22 0.00 2.22 2.10 0.00 3.68 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 71 D 8.56 4.50 0.00 2.94 2.77 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 72 L 7.81 4.44 0.00 1.82 1.61 1.05 1.25 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 73 G 8.53 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 0.00 0.00 0.00 74 V 8.47 4.04 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 0.81 0.00 0.00 0.94 0.00 0.00 75 L 9.55 4.82 0.00 1.57 1.52 0.96 0.79 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 76 C 8.58 4.83 0.00 2.83 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 77 P 0.00 4.16 0.00 2.03 2.02 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.23 0.00 78 T 8.41 4.28 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 79 G 8.50 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.28 4.27 0.00 2.97 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 81 Q 8.16 4.00 0.00 2.32 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.87 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 82 L 8.23 3.96 0.00 1.89 1.66 0.97 0.69 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 83 Q 9.35 3.77 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 84 E 8.88 3.96 0.00 2.00 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 2.25 2.23 0.00 85 A 7.98 4.25 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.42 4.00 0.00 1.94 1.65 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.24 3.70 0.00 1.61 1.73 0.95 1.10 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 88 Q 7.80 4.23 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 89 Q 8.52 4.65 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.96 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 90 E 8.16 3.82 0.00 2.13 1.94 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 2.31 2.36 0.00 91 R 7.63 3.76 0.00 1.90 1.93 0.00 3.31 0.00 0.00 3.39 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 92 P 0.00 4.25 0.00 2.25 2.32 0.00 3.71 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 2.35 2.22 0.00 93 I 8.34 3.66 2.18 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 1.52 0.45 0.91 0.00 0.00 94 R 7.58 3.83 0.00 2.00 1.97 0.00 3.29 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 95 N 8.17 4.27 0.00 2.97 2.86 0.00 0.00 7.04 7.23 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 96 S 7.96 4.15 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 97 V 8.16 3.73 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 1.03 0.00 0.00 0.93 0.00 0.00 98 D 8.39 4.49 0.00 2.63 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 99 E 8.59 4.30 0.00 2.09 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 0.00 2.32 2.31 0.00 100 L 8.26 4.30 0.00 1.70 1.52 0.92 0.37 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 0.00 101 N 7.67 4.28 0.00 2.94 3.10 0.00 0.00 5.97 6.96 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 0.00 102 N 8.11 4.23 0.00 2.72 2.94 0.00 0.00 7.16 6.78 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 0.00 103 N 8.40 4.58 0.00 2.75 2.87 0.00 0.00 7.04 7.69 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 0.00 104 V 7.81 3.88 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 0.78 0.00 0.00 1.01 0.00 0.00 105 E 7.64 4.28 0.00 2.13 1.84 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 2.40 2.20 0.00