NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 53 R 4.2661 8.3545 119.7064 56.1803 31.0784 175.0202 54 R 4.5476 8.0582 120.0522 53.7779 33.4990 169.3586 55 W 4.2335 9.6038 118.1716 57.4567 30.0477 176.3720 56 L 4.4942 8.3785 124.4463 54.0326 42.1662 177.8693 57 S 4.4409 9.2061 118.2270 57.8091 65.0505 175.2764 58 K 3.9654 8.7807 123.7212 60.4907 31.7100 179.0791 59 T 3.9151 7.8922 115.0323 66.6157 68.4393 176.1268 60 E 3.9520 8.3122 120.5227 59.6131 29.4822 178.9461 61 F 4.2639 8.6805 120.5122 61.8446 39.5747 177.4152 62 L 3.3326 7.9957 117.9470 57.4627 41.0574 179.8950 63 S 4.0800 7.8911 114.9640 61.5959 62.8741 176.5484 64 R 4.0253 7.8521 119.8753 58.7290 30.0268 178.3091 65 L 4.1713 7.7977 120.2875 56.1298 42.0325 176.9828 66 R 4.0704 7.1214 118.5375 57.3666 30.1184 177.0322 67 G 3.8921 9.1815 111.4058 45.3839 0.0000 173.1664 68 A 4.6770 7.9205 120.7664 51.5168 19.7520 176.4621 69 Q 4.0757 7.9648 116.3065 56.2697 29.3408 176.4341 70 A 4.2258 8.3210 124.7003 51.5377 19.3879 177.1780 71 D 4.5362 8.4286 119.3285 52.7160 40.2367 175.8937 72 P 4.3325 0.0000 0.0000 65.8228 31.2456 178.9800 73 G 3.7476 7.7569 103.7601 46.9475 0.0000 175.3102 74 L 4.0369 8.1444 122.9478 58.0625 42.0166 179.0249 75 R 3.9388 7.9767 118.2909 59.2060 29.8736 178.7234 76 N 4.3293 7.9701 115.6264 56.5086 38.7184 177.0273 77 D 4.3728 8.0555 120.2278 57.5002 40.9034 178.9935 78 L 4.0544 8.4464 119.5585 57.3991 41.4117 179.3184 79 A 4.0172 8.0959 121.1157 55.1143 18.0623 179.9021 80 V 3.5264 7.4462 115.5150 65.9461 31.7493 177.7069 81 L 4.4273 7.8905 116.6369 56.0177 41.9172 177.7428 82 A 4.7215 8.3553 121.1475 52.0160 19.6923 176.6273 83 G 4.1251 8.4602 106.2926 46.1056 0.0000 174.7014 84 D 4.3208 7.9725 120.6635 53.6572 39.6024 176.3586 85 T 4.4512 8.1176 114.0712 59.6710 71.1860 174.6618 86 T 4.0438 8.2423 110.4296 62.0595 68.8388 174.1951 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 53 R 8.35 4.27 0.00 1.80 1.92 0.00 3.13 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 54 R 8.06 4.55 0.00 1.85 1.64 0.00 3.26 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.28 0.00 55 W 9.60 4.23 0.00 3.24 3.25 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 56 L 8.38 4.49 0.00 1.67 1.71 0.98 1.08 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 57 S 9.21 4.44 0.00 4.09 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.78 3.97 0.00 1.92 1.94 0.00 1.77 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.62 1.67 7.81 59 T 7.89 3.92 4.27 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 0.00 0.00 0.00 1.22 0.00 0.00 60 E 8.31 3.95 0.00 2.36 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 2.37 2.38 0.00 61 F 8.68 4.26 0.00 3.05 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 62 L 8.00 3.33 0.00 1.72 1.56 0.95 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 63 S 7.89 4.08 0.00 4.02 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 64 R 7.85 4.03 0.00 1.85 1.99 0.00 3.33 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.82 0.00 65 L 7.80 4.17 0.00 1.21 1.04 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 66 R 7.12 4.07 0.00 1.84 1.80 0.00 3.17 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 67 G 9.18 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 68 A 7.92 4.68 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 69 Q 7.96 4.08 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 70 A 8.32 4.23 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 71 D 8.43 4.54 0.00 2.83 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 72 P 0.00 4.33 0.00 2.18 2.16 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 2.17 0.00 73 G 7.76 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.14 4.04 0.00 1.82 1.75 0.92 0.77 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 75 R 7.98 3.94 0.00 2.05 1.97 0.00 3.18 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 76 N 7.97 4.33 0.00 2.97 2.86 0.00 0.00 7.13 8.08 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 77 D 8.06 4.37 0.00 2.78 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 78 L 8.45 4.05 0.00 1.66 1.71 0.92 0.78 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 79 A 8.10 4.02 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 80 V 7.45 3.53 2.22 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 0.87 0.00 0.00 0.96 0.00 0.00 81 L 7.89 4.43 0.00 1.67 1.70 0.94 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 82 A 8.36 4.72 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.46 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 0.00 0.00 0.00 84 D 7.97 4.32 0.00 2.79 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 85 T 8.12 4.45 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 86 T 8.24 4.04 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