NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 L 4.4430 8.0427 120.6455 54.5088 43.3839 177.2896 -1 Y 3.3383 8.5134 122.3067 58.8743 38.5848 177.1536 0 S 3.9795 8.4023 116.7924 61.3260 63.4624 175.8221 1 A 3.9115 7.7955 123.9394 54.6432 18.2326 179.2621 2 L 3.7588 7.6376 118.3376 58.0834 42.1867 178.8864 3 A 3.6867 7.7286 121.1571 55.0063 18.2245 179.0947 4 N 4.2208 7.9621 115.4215 56.6307 38.9730 176.9090 5 K 3.8715 8.1379 121.0864 59.8467 32.3014 177.8937 6 C 4.1738 8.5401 117.0401 60.3668 39.9006 175.8502 7 C 3.9313 7.7494 118.4802 62.0662 31.2466 174.4347 8 H 4.7032 8.1024 115.8898 56.4900 29.2340 176.1959 9 V 4.3242 8.2731 110.4219 59.8086 34.0786 176.5609 10 G 4.0721 8.9668 105.1053 45.7874 0.0000 170.1858 11 C 4.9015 7.9385 113.0355 53.8772 38.9660 173.7493 12 T 4.4659 8.1670 110.5294 60.6763 70.0081 175.9204 13 K 3.9899 8.6095 122.1465 59.6000 31.5280 179.3480 14 R 3.9298 8.0989 118.8227 59.5652 29.7049 178.5348 15 S 4.2584 7.7568 112.2116 61.6548 63.3542 176.2535 16 L 4.4054 8.0454 121.9610 57.1853 41.5434 179.0640 17 A 4.1475 8.1485 120.9376 54.9444 18.0619 179.5771 18 R 4.0019 7.6677 114.3163 58.2324 30.1052 177.3773 19 F 4.4804 7.7440 116.2500 57.3190 39.3133 175.6812 20 C 4.3465 7.8629 124.2513 60.0983 27.8736 173.4127 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 L 8.04 4.44 0.00 1.75 1.69 0.94 0.50 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 -1 Y 8.51 3.34 0.00 2.66 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 S 8.40 3.98 0.00 4.05 4.11 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.80 3.91 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.64 3.76 0.00 1.71 1.34 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 3 A 7.73 3.69 0.98 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 0.00 0.00 0.00 0.00 0.00 4 N 7.96 4.22 0.00 2.92 2.97 0.00 0.00 6.87 6.41 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 5 K 8.14 3.87 0.00 1.90 1.90 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.48 7.81 6 C 8.54 4.17 0.00 2.87 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 7 C 7.75 3.93 0.00 2.88 3.09 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 8 H 8.10 4.70 0.00 3.20 3.33 0.00 5.85 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.27 4.32 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 0.69 0.00 0.00 0.96 0.00 0.00 10 G 8.97 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 11 C 7.94 4.90 0.00 3.04 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.17 4.47 4.26 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 1.22 0.00 0.00 13 K 8.61 3.99 0.00 1.84 1.93 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.52 7.81 14 R 8.10 3.93 0.00 1.89 1.96 0.00 3.19 0.00 0.00 3.40 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 15 S 7.76 4.26 0.00 4.18 4.04 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 16 L 8.05 4.41 0.00 1.97 1.89 0.95 1.04 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 17 A 8.15 4.15 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 0.00 0.00 18 R 7.67 4.00 0.00 1.67 1.74 0.00 3.05 0.00 0.00 3.18 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 19 F 7.74 4.48 0.00 3.34 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 20 C 7.86 4.35 0.00 3.10 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