NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 100 D 4.9950 8.3493 120.3316 53.0614 40.6520 175.1305 101 D 4.5776 7.3772 116.7860 53.1416 43.0709 173.8551 102 D 4.4712 9.1653 119.9108 54.9729 39.1353 174.7411 103 R 4.7607 7.7154 118.1523 57.0442 37.6903 176.1779 104 Y 3.9904 8.2769 115.3942 60.4591 37.8177 177.7165 105 L 3.9681 8.0082 121.0769 58.4743 42.3382 179.2193 106 R 4.0950 8.0054 117.3149 59.0365 29.9666 178.5914 107 E 3.8970 7.8477 118.3233 59.5873 29.5437 179.3492 108 A 4.0383 8.0375 120.3450 55.0802 18.5713 179.5237 109 I 3.6438 8.2005 118.7881 64.8995 37.2780 178.5484 110 Q 4.0222 8.6450 120.4236 58.8985 28.8736 177.5915 111 E 3.9363 8.1164 120.6831 59.6691 29.5486 178.3544 112 Y 4.1795 8.1353 119.3599 60.5833 38.6259 177.0488 113 D 4.2488 7.8893 118.2429 57.2127 41.2876 177.6325 114 N 4.5113 7.9808 116.3528 55.9261 38.7787 177.2056 115 I 3.7219 7.4811 120.2667 62.0681 37.3499 176.2032 116 A 3.4782 7.6615 120.7146 52.8413 16.6605 177.1041 117 K 4.1151 7.3587 123.6086 58.0588 32.3103 177.1783 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 100 D 8.35 5.00 0.00 2.56 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 D 7.38 4.58 0.00 2.85 2.64 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 0.00 102 D 9.17 4.47 0.00 2.88 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 0.00 103 R 7.72 4.76 0.00 1.83 1.80 0.00 3.18 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.52 0.00 104 Y 8.28 3.99 0.00 3.08 3.01 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 0.00 0.00 0.00 0.00 105 L 8.01 3.97 0.00 1.81 1.70 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.01 4.10 0.00 1.90 1.96 0.00 3.20 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 107 E 7.85 3.90 0.00 2.07 2.00 0.00 0.00 0.00 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 2.32 0.00 108 A 8.04 4.04 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 8.20 3.64 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.08 0.95 0.00 0.00 110 Q 8.65 4.02 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 111 E 8.12 3.94 0.00 2.38 2.15 0.00 0.00 0.00 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 2.43 0.00 112 Y 8.14 4.18 0.00 3.10 3.12 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 0.00 0.00 0.00 0.00 113 D 7.89 4.25 0.00 2.90 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 0.00 114 N 7.98 4.51 0.00 2.88 2.83 0.00 0.00 7.03 7.05 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 0.00 115 I 7.48 3.72 1.79 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.64 0.91 0.00 0.00 116 A 7.66 3.48 1.21 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 0.00 0.00 0.00 0.00 0.00 117 K 7.36 4.12 0.00 1.74 1.84 0.00 1.82 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.40 7.81