#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n9c s ASP 23 N 0.00 5.30 0.14 4.52 1.01 -1.26 -4.72 116.67 121.65 1n9c s ASP 23 Ca 0.00 0.05 -0.23 0.00 0.71 0.00 0.00 52.55 53.08 1n9c s ASP 23 Cb 0.00 -2.54 -0.01 0.00 1.01 0.00 0.00 42.92 41.38 1n9c s ASP 23 CO 0.00 -2.42 1.64 0.00 0.21 0.00 0.00 175.17 174.60 1n9c h ALA 24 N 13.85 -0.17 -0.51 5.23 0.00 -1.89 0.12 119.26 135.89 1n9c h ALA 24 Ca -0.18 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1n9c h ALA 24 Cb 1.12 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 1n9c h ALA 24 CO 1.22 -0.67 0.22 1.05 0.00 0.00 0.00 179.25 181.07 1n9c h GLU 25 N -0.27 0.76 -0.17 0.00 4.11 -1.92 -0.77 114.58 116.32 1n9c h GLU 25 Ca 0.10 -0.13 0.03 0.00 0.07 0.00 0.00 59.36 59.43 1n9c h GLU 25 Cb 0.42 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 1n9c h GLU 25 CO -0.30 0.66 0.00 0.00 0.07 0.00 0.00 179.01 179.45 1n9c h ALA 26 N 1.06 0.15 -0.26 1.06 0.00 -1.60 0.40 119.26 120.08 1n9c h ALA 26 Ca 0.17 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.16 1n9c h ALA 26 Cb 0.17 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 1n9c h ALA 26 CO -0.02 -0.44 -0.44 0.28 0.00 0.00 0.00 179.25 178.64 1n9c h VAL 27 N 0.06 0.00 -0.10 0.00 2.07 -0.94 -2.73 116.25 114.60 1n9c h VAL 27 Ca 0.08 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.47 1n9c h VAL 27 Cb 0.10 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.85 1n9c h VAL 27 CO -0.13 0.00 -0.53 0.58 0.02 0.00 0.00 177.57 177.51 1n9c h VAL 28 N -0.36 1.35 0.00 2.57 2.07 0.56 0.47 116.25 122.91 1n9c h VAL 28 Ca 0.05 -1.80 0.00 0.00 0.82 0.00 0.00 66.70 65.77 1n9c h VAL 28 Cb 0.49 1.86 0.00 0.00 -1.52 0.00 0.00 31.29 32.12 1n9c h VAL 28 CO -0.43 0.54 0.00 0.00 0.02 0.00 0.00 177.57 177.70 1n9c n GLN 29 N -3.94 0.14 0.00 1.57 1.13 0.12 -1.53 117.38 114.88 1n9c n GLN 29 Ca -0.02 0.03 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 1n9c n GLN 29 Cb 0.57 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.42 1n9c n GLN 29 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 1n9c n GLN 30 N -1.04 4.24 -0.03 -1.09 7.27 0.35 -4.81 117.38 122.27 1n9c n GLN 30 Ca 0.04 0.00 0.02 0.00 0.07 0.00 0.00 57.00 57.13 1n9c n GLN 30 Cb 0.02 -0.52 -0.13 0.00 2.41 0.00 0.00 30.24 32.02 1n9c n GLN 30 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1n9c n LYS 31 N -0.19 0.85 -0.02 3.69 4.76 0.14 -4.64 118.16 122.75 1n9c n LYS 31 Ca 0.00 -0.10 -0.02 0.00 -2.87 0.00 0.00 58.31 55.32 1n9c n LYS 31 Cb 0.01 -1.40 -0.01 0.00 -1.84 0.00 0.00 35.03 31.78 1n9c n LYS 31 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1n9c h ILE 33 N -0.00 0.50 -0.86 0.00 3.07 -1.55 0.11 117.51 118.78 1n9c h ILE 33 Ca -0.07 -0.03 0.30 0.00 1.55 0.00 0.00 64.86 66.61 1n9c h ILE 33 Cb 1.11 0.42 -0.16 0.00 -0.27 0.00 0.00 36.82 37.92 1n9c h ILE 33 CO -0.01 0.01 0.23 -0.24 -1.05 0.00 0.00 178.15 177.09 1n9c n SER 34 N -4.29 0.09 -0.04 2.16 2.88 -1.26 -0.30 113.62 112.86 1n9c n SER 34 Ca 0.22 1.44 -0.07 0.00 -1.33 0.00 0.00 58.87 59.13 1n9c n SER 34 Cb 1.04 -0.61 -0.03 0.00 -0.75 0.00 0.00 64.21 63.86 1n9c n SER 34 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n9c n HIS 36 N -2.98 0.85 0.00 0.00 8.25 0.14 0.01 115.22 121.49 1n9c n HIS 36 Ca -0.14 0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 1n9c n HIS 36 Cb 0.63 -0.98 0.00 0.00 1.12 0.00 0.00 29.99 30.76 1n9c n HIS 36 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1n9c n GLY 37 N 0.48 -1.01 0.25 -1.41 0.00 0.59 -0.34 105.19 103.76 1n9c n GLY 37 Ca 0.03 -1.50 -0.07 0.00 0.00 0.00 0.00 46.02 44.49 1n9c n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n9c n GLY 38 N -0.37 -2.53 0.00 -0.02 0.00 -1.26 -0.22 105.19 100.79 1n9c n GLY 38 Ca 0.00 0.89 0.11 0.00 0.00 0.00 0.00 46.02 47.02 1n9c n GLY 38 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1n9c n ASP 39 N -4.36 0.00 -0.76 1.61 9.92 -1.26 -4.87 116.55 116.82 1n9c n ASP 39 Ca 0.01 0.24 -0.08 0.00 -0.53 0.00 0.00 54.79 54.43 1n9c n ASP 39 Cb 0.15 -0.39 -0.02 0.00 -0.64 0.00 0.00 41.12 40.22 1n9c n ASP 39 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1n9c n LEU 40 N -1.39 -0.98 0.00 0.64 4.77 0.70 -4.66 117.00 116.08 1n9c n LEU 40 Ca 0.08 0.09 0.14 0.00 -0.03 0.00 0.00 56.01 56.29 1n9c n LEU 40 Cb 0.22 -1.42 0.70 0.00 -2.33 0.00 0.00 43.42 40.59 1n9c n LEU 40 CO 0.19 -0.25 0.98 0.35 -1.33 0.00 0.00 177.39 177.33 1n9c n THR 41 N -3.40 0.08 -0.35 -5.08 -2.24 -1.23 -0.77 114.28 101.29 1n9c n THR 41 Ca -0.09 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1n9c n THR 41 Cb 0.42 -0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 1n9c n THR 41 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n9c n GLY 42 N 1.12 0.30 0.00 3.38 0.00 0.54 -3.96 105.19 106.57 1n9c n GLY 42 Ca 0.13 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1n9c n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n9c n ALA 43 N -0.11 0.00 1.05 4.61 0.00 -0.63 -4.65 120.51 120.78 1n9c n ALA 43 Ca 0.00 -0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1n9c n ALA 43 Cb 0.00 0.00 0.31 0.00 0.00 0.00 0.00 19.45 19.76 1n9c n ALA 43 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1n9c n SER 44 N -0.76 2.37 -3.97 0.00 2.88 0.10 -4.90 113.62 109.33 1n9c n SER 44 Ca 0.00 -1.79 -0.09 0.00 -1.33 0.00 0.00 58.87 55.66 1n9c n SER 44 Cb 0.00 -0.08 -0.08 0.00 -0.75 0.00 0.00 64.21 63.30 1n9c n SER 44 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n9c s ALA 45 N -1.85 0.13 1.01 -1.46 0.00 -1.14 -4.92 121.76 113.54 1n9c s ALA 45 Ca 0.34 -0.93 -0.12 0.00 0.00 0.00 0.00 51.96 51.25 1n9c s ALA 45 Cb 0.20 0.66 0.20 0.00 0.00 0.00 0.00 23.12 24.18 1n9c s ALA 45 CO 0.30 -0.54 1.08 -1.25 0.00 0.00 0.00 175.76 175.35 1n9c s PRO 46 N -3.94 0.32 -0.21 0.00 0.04 -1.26 -4.22 135.00 125.72 1n9c s PRO 46 Ca 0.13 0.92 -0.29 0.00 0.04 0.00 0.00 61.00 61.80 1n9c s PRO 46 Cb 0.05 -1.69 -0.03 0.00 0.04 0.00 0.00 34.50 32.87 1n9c s PRO 46 CO -0.05 -2.92 1.71 0.00 0.04 0.00 0.00 177.00 175.79 1n9c s ALA 47 N -2.71 3.21 -1.08 8.56 0.00 -1.25 -4.07 121.76 124.41 1n9c s ALA 47 Ca 0.66 0.54 0.13 0.00 0.00 0.00 0.00 51.96 53.28 1n9c s ALA 47 Cb -0.21 -3.89 -0.02 0.00 0.00 0.00 0.00 23.12 19.00 1n9c s ALA 47 CO 0.60 -2.06 0.70 0.44 0.00 0.00 0.00 175.76 175.44 1n9c n ILE 48 N 6.56 0.00 -0.30 0.00 -6.64 -0.24 -4.51 119.36 114.23 1n9c n ILE 48 Ca 0.20 -0.35 0.09 0.00 -1.77 0.00 0.00 62.75 60.92 1n9c n ILE 48 Cb 0.45 1.13 0.19 0.00 -1.44 0.00 0.00 39.64 39.97 1n9c n ILE 48 CO 0.00 0.00 0.00 -0.90 -1.77 0.00 0.00 176.55 173.88 1n9c n ASP 49 N -0.34 -0.21 -1.03 7.28 5.75 0.05 -0.47 116.55 127.58 1n9c n ASP 49 Ca 0.05 1.47 0.12 0.00 -0.01 0.00 0.00 54.79 56.41 1n9c n ASP 49 Cb 0.25 -0.49 0.24 0.00 -1.03 0.00 0.00 41.12 40.10 1n9c n ASP 49 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1n9c n LYS 50 N -5.32 2.35 -0.22 0.11 5.02 -1.26 -4.17 118.16 114.67 1n9c n LYS 50 Ca 0.17 -2.03 0.24 0.00 -2.02 0.00 0.00 58.31 54.66 1n9c n LYS 50 Cb 0.54 -1.49 0.61 0.00 -0.02 0.00 0.00 35.03 34.68 1n9c n LYS 50 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n9c h ALA 51 N 4.43 2.51 0.00 7.82 0.00 -1.00 0.33 119.26 133.35 1n9c h ALA 51 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1n9c h ALA 51 Cb 0.89 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1n9c h ALA 51 CO 0.00 -0.80 -0.19 0.78 0.00 0.00 0.00 179.25 179.05 1n9c h GLY 52 N 0.21 0.00 0.41 0.00 0.00 -1.74 0.32 103.07 102.27 1n9c h GLY 52 Ca 0.46 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.70 1n9c h GLY 52 CO -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 176.54 176.06 1n9c h ALA 53 N 1.81 -0.01 -0.08 3.60 0.00 -0.71 -3.40 119.26 120.46 1n9c h ALA 53 Ca -0.00 -0.55 -0.17 0.00 0.00 0.00 0.00 54.91 54.19 1n9c h ALA 53 Cb 0.42 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.26 1n9c h ALA 53 CO 0.02 0.16 -0.60 -0.91 0.00 0.00 0.00 179.25 177.93 1n9c h ASN 54 N -0.59 0.67 -5.04 0.00 2.35 -0.71 -3.46 115.58 108.80 1n9c h ASN 54 Ca -0.06 -0.67 -0.64 0.00 -0.55 0.00 0.00 56.30 54.38 1n9c h ASN 54 Cb 1.22 -0.20 -0.13 0.00 0.05 0.00 0.00 38.32 39.26 1n9c h ASN 54 CO 0.07 1.23 -0.49 -1.22 -1.65 0.00 0.00 177.43 175.38 1n9c n TYR 55 N -4.16 0.78 -4.56 1.19 4.01 0.11 -5.07 117.16 109.46 1n9c n TYR 55 Ca -0.09 -2.63 -0.28 0.00 -0.16 0.00 0.00 57.90 54.75 1n9c n TYR 55 Cb 0.65 -0.21 -0.10 0.00 -0.31 0.00 0.00 39.34 39.37 1n9c n TYR 55 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1n9c s SER 56 N -3.76 3.95 0.26 7.72 0.01 -1.26 -4.24 113.70 116.38 1n9c s SER 56 Ca 0.09 -1.34 -0.02 0.00 1.31 0.00 0.00 55.95 55.99 1n9c s SER 56 Cb 0.00 -0.39 0.46 0.00 0.21 0.00 0.00 66.02 66.30 1n9c s SER 56 CO 0.06 -0.47 1.84 1.05 0.41 0.00 0.00 173.24 176.13 1n9c h GLU 57 N 1.72 0.96 -0.06 12.44 -0.00 -1.93 -1.58 114.58 126.13 1n9c h GLU 57 Ca -0.44 -0.06 0.04 0.00 -0.00 0.00 0.00 59.36 58.90 1n9c h GLU 57 Cb 1.24 -0.22 -0.05 0.00 -0.00 0.00 0.00 28.75 29.73 1n9c h GLU 57 CO 0.79 0.63 -0.25 1.05 -0.00 0.00 0.00 179.01 181.24 1n9c h GLU 58 N 0.98 -0.34 -0.08 1.06 9.09 -1.96 0.19 114.58 123.52 1n9c h GLU 58 Ca 0.45 0.02 0.01 0.00 0.05 0.00 0.00 59.36 59.89 1n9c h GLU 58 Cb 0.35 0.08 -0.01 0.00 -1.65 0.00 0.00 28.75 27.52 1n9c h GLU 58 CO -0.23 -0.23 0.02 0.93 0.05 0.00 0.00 179.01 179.55 1n9c h GLU 59 N -0.35 0.05 0.20 1.06 4.39 -1.76 -0.43 114.58 117.74 1n9c h GLU 59 Ca 0.08 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1n9c h GLU 59 Cb 0.47 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1n9c h GLU 59 CO -0.27 0.03 -0.10 0.82 -1.16 0.00 0.00 179.01 178.34 1n9c h ILE 60 N 0.05 0.85 -0.26 3.13 2.04 -0.96 0.56 117.51 122.92 1n9c h ILE 60 Ca 0.04 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.71 1n9c h ILE 60 Cb 0.03 0.99 -0.08 0.00 -0.74 0.00 0.00 36.82 37.02 1n9c h ILE 60 CO -0.05 0.05 -0.43 0.25 0.00 0.00 0.00 178.15 177.98 1n9c h LEU 61 N -0.39 -1.37 -0.72 1.44 5.85 -0.53 0.58 115.31 120.17 1n9c h LEU 61 Ca -0.03 0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 1n9c h LEU 61 Cb 0.30 0.58 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 1n9c h LEU 61 CO 0.05 -0.40 0.37 -0.78 -0.34 0.00 0.00 178.44 177.34 1n9c h ASP 62 N -0.41 0.92 -0.83 1.25 3.58 -0.86 -0.77 116.42 119.30 1n9c h ASP 62 Ca 0.10 -0.11 0.01 0.00 0.42 0.00 0.00 57.03 57.45 1n9c h ASP 62 Cb 0.60 -0.24 -0.04 0.00 1.72 0.00 0.00 39.33 41.38 1n9c h ASP 62 CO -0.48 0.77 0.55 0.40 -2.88 0.00 0.00 179.24 177.60 1n9c h ILE 63 N 1.00 1.21 0.09 2.25 2.04 -0.17 0.30 117.51 124.24 1n9c h ILE 63 Ca 0.25 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1n9c h ILE 63 Cb 0.07 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.15 1n9c h ILE 63 CO -0.04 0.20 -0.04 0.40 0.00 0.00 0.00 178.15 178.67 1n9c h ILE 64 N 1.12 0.96 -0.65 -0.67 2.04 -0.11 0.38 117.51 120.57 1n9c h ILE 64 Ca 0.30 -0.15 -0.05 0.00 1.00 0.00 0.00 64.86 65.96 1n9c h ILE 64 Cb -0.13 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 1n9c h ILE 64 CO -0.07 0.04 0.20 -0.07 0.00 0.00 0.00 178.15 178.25 1n9c h LEU 65 N -0.19 0.93 0.00 1.44 3.38 -0.67 0.82 115.31 121.03 1n9c h LEU 65 Ca -0.01 -0.16 -0.17 0.00 0.09 0.00 0.00 57.88 57.62 1n9c h LEU 65 Cb 0.16 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 1n9c h LEU 65 CO 0.02 0.88 -1.16 0.59 0.09 0.00 0.00 178.44 178.86 1n9c n ASN 66 N -4.27 1.86 0.00 -0.43 3.02 0.10 -2.09 115.26 113.45 1n9c n ASN 66 Ca 0.05 0.48 0.00 0.00 -0.03 0.00 0.00 54.58 55.08 1n9c n ASN 66 Cb 0.22 -0.91 0.00 0.00 -0.61 0.00 0.00 39.78 38.48 1n9c n ASN 66 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1n9c n GLY 67 N 1.47 1.46 3.55 7.41 0.00 0.13 -4.33 105.19 114.88 1n9c n GLY 67 Ca -0.26 -0.97 -0.37 0.00 0.00 0.00 0.00 46.02 44.42 1n9c n GLY 67 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1n9c n GLN 68 N 1.82 0.57 -0.34 1.61 -0.06 -1.23 -4.85 117.38 114.91 1n9c n GLN 68 Ca 0.00 0.24 -0.07 0.00 -2.00 0.00 0.00 57.00 55.17 1n9c n GLN 68 Cb 0.00 -2.01 -0.05 0.00 -4.06 0.00 0.00 30.24 24.12 1n9c n GLN 68 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1n9c n GLY 69 N 1.43 -2.03 0.66 1.69 0.00 -1.26 -0.19 105.19 105.49 1n9c n GLY 69 Ca 0.12 0.96 0.04 0.00 0.00 0.00 0.00 46.02 47.15 1n9c n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n9c n GLY 70 N -1.25 0.78 3.23 -0.02 0.00 -1.26 -4.83 105.19 101.84 1n9c n GLY 70 Ca 0.03 -0.32 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 1n9c n GLY 70 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1n9c s MET 71 N -1.64 2.78 0.27 1.61 0.00 0.73 -5.05 119.30 118.00 1n9c s MET 71 Ca 0.19 -0.87 -0.01 0.00 0.00 0.00 0.00 55.69 55.01 1n9c s MET 71 Cb 0.11 -2.19 0.38 0.00 0.00 0.00 0.00 34.83 33.13 1n9c s MET 71 CO 0.11 0.25 1.80 -1.00 0.00 0.00 0.00 175.02 176.18 1n9c h PRO 72 N 6.46 0.79 0.00 4.11 0.13 -1.88 -3.36 132.00 138.24 1n9c h PRO 72 Ca -0.25 -0.18 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1n9c h PRO 72 Cb 1.21 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1n9c h PRO 72 CO 0.47 0.76 0.00 0.41 -0.23 0.00 0.00 178.00 179.41 1n9c n GLY 73 N -0.76 -2.38 2.56 1.56 0.00 -1.26 -4.55 105.19 100.35 1n9c n GLY 73 Ca 0.03 -1.47 -0.13 0.00 0.00 0.00 0.00 46.02 44.45 1n9c n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n9c n GLY 74 N -2.14 1.33 0.35 -0.02 0.00 0.28 -4.83 105.19 100.16 1n9c n GLY 74 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 46.02 45.84 1n9c n GLY 74 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1n9c h ILE 75 N 0.00 1.22 -3.96 -0.61 2.04 -1.87 -3.42 117.51 110.92 1n9c h ILE 75 Ca -0.27 -0.50 -0.30 0.00 1.00 0.00 0.00 64.86 64.79 1n9c h ILE 75 Cb 1.03 0.14 -0.23 0.00 -0.74 0.00 0.00 36.82 37.01 1n9c h ILE 75 CO 0.39 0.23 -0.74 0.00 0.00 0.00 0.00 178.15 178.03 1n9c s ALA 76 N -5.77 0.60 0.02 1.87 0.00 -1.26 -5.08 121.76 112.14 1n9c s ALA 76 Ca -0.11 -0.65 -0.02 0.00 0.00 0.00 0.00 51.96 51.18 1n9c s ALA 76 Cb 0.17 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.26 1n9c s ALA 76 CO 0.80 0.03 0.02 0.15 0.00 0.00 0.00 175.76 176.76 1n9c s LYS 77 N -1.20 0.42 5.34 0.00 -0.14 -1.26 -4.35 119.74 118.55 1n9c s LYS 77 Ca -0.06 -0.69 0.00 0.00 -1.36 0.00 0.00 55.97 53.86 1n9c s LYS 77 Cb -0.08 0.16 0.00 0.00 -1.68 0.00 0.00 37.83 36.23 1n9c s LYS 77 CO 0.00 -0.08 0.00 0.41 -0.76 0.00 0.00 175.35 174.92 1n9c n GLY 78 N 1.23 2.47 0.53 -3.33 0.00 -1.26 -2.76 105.19 102.07 1n9c n GLY 78 Ca -0.22 -0.42 0.39 0.00 0.00 0.00 0.00 46.02 45.77 1n9c n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n9c h ALA 79 N -0.97 3.03 0.13 4.61 0.00 -1.99 0.28 119.26 124.34 1n9c h ALA 79 Ca 0.00 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1n9c h ALA 79 Cb 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1n9c h ALA 79 CO 0.00 -1.55 -0.17 1.49 0.00 0.00 0.00 179.25 179.02 1n9c h GLU 80 N 0.09 -0.30 -0.55 0.00 4.81 -1.86 -0.33 114.58 116.44 1n9c h GLU 80 Ca 0.77 0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.91 1n9c h GLU 80 Cb 2.67 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 32.09 1n9c h GLU 80 CO -0.22 -0.20 -0.07 0.00 -0.73 0.00 0.00 179.01 177.79 1n9c h ALA 81 N -1.41 0.82 -0.19 2.92 0.00 -0.66 -1.97 119.26 118.77 1n9c h ALA 81 Ca -0.02 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 54.60 1n9c h ALA 81 Cb 0.28 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1n9c h ALA 81 CO -0.04 0.66 -0.06 0.93 0.00 0.00 0.00 179.25 180.75 1n9c h GLU 82 N 0.91 -0.02 -0.44 0.00 5.08 -0.98 0.11 114.58 119.24 1n9c h GLU 82 Ca 0.15 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.54 1n9c h GLU 82 Cb 0.63 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.84 1n9c h GLU 82 CO 0.04 -0.01 0.23 0.00 -1.00 0.00 0.00 179.01 178.27 1n9c h ALA 83 N 1.16 0.55 -0.03 3.43 0.00 -0.84 -2.20 119.26 121.34 1n9c h ALA 83 Ca 0.09 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1n9c h ALA 83 Cb 0.16 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 1n9c h ALA 83 CO -0.20 -0.12 -0.46 0.28 0.00 0.00 0.00 179.25 178.74 1n9c h VAL 84 N 0.45 0.10 -0.67 0.00 2.07 -0.57 -1.46 116.25 116.17 1n9c h VAL 84 Ca 0.19 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.79 1n9c h VAL 84 Cb 0.09 0.10 -0.11 0.00 -1.52 0.00 0.00 31.29 29.85 1n9c h VAL 84 CO -0.13 0.00 -0.53 0.00 0.02 0.00 0.00 177.57 176.94 1n9c h ALA 85 N -0.13 -0.53 0.45 1.67 0.00 -0.20 0.35 119.26 120.87 1n9c h ALA 85 Ca 0.04 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1n9c h ALA 85 Cb 0.67 1.15 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1n9c h ALA 85 CO -0.35 -0.94 -0.22 0.00 0.00 0.00 0.00 179.25 177.74 1n9c h ALA 86 N 0.39 -0.61 -0.52 0.00 0.00 -1.40 -0.58 119.26 116.54 1n9c h ALA 86 Ca 0.15 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.97 1n9c h ALA 86 Cb 0.53 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1n9c h ALA 86 CO -0.75 -0.84 0.25 2.35 0.00 0.00 0.00 179.25 180.26 1n9c h TRP 87 N -0.61 0.46 -0.30 0.00 7.01 -0.54 0.28 115.95 122.25 1n9c h TRP 87 Ca -0.06 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 60.92 1n9c h TRP 87 Cb 0.47 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.38 1n9c h TRP 87 CO -0.04 0.21 0.05 1.25 -2.79 0.00 0.00 178.44 177.12 1n9c h LEU 88 N 0.49 0.47 -0.98 0.65 7.12 -0.26 0.56 115.31 123.37 1n9c h LEU 88 Ca 0.23 -0.26 0.16 0.00 0.13 0.00 0.00 57.88 58.14 1n9c h LEU 88 Cb 0.16 -0.13 -0.10 0.00 -0.53 0.00 0.00 40.66 40.07 1n9c h LEU 88 CO -0.17 0.62 0.59 0.00 -0.13 0.00 0.00 178.44 179.34 1n9c h ALA 89 N 0.88 1.54 0.00 1.25 0.00 -0.70 -0.25 119.26 121.97 1n9c h ALA 89 Ca 0.09 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1n9c h ALA 89 Cb 0.34 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1n9c h ALA 89 CO 0.01 0.05 0.00 1.49 0.00 0.00 0.00 179.25 180.80 1n9c h GLU 90 N 0.83 0.00 -0.00 0.00 4.22 -0.02 -3.35 114.58 116.26 1n9c h GLU 90 Ca 0.53 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.97 1n9c h GLU 90 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1n9c h GLU 90 CO -0.33 0.00 -0.07 1.17 -2.18 0.00 0.00 179.01 177.60 1n9c n LYS 91 N -2.58 0.61 0.00 1.92 0.00 0.10 -5.07 118.16 113.15 1n9c n LYS 91 Ca 0.03 -0.14 0.11 0.00 0.00 0.00 0.00 58.31 58.32 1n9c n LYS 91 Cb 0.36 -1.50 0.65 0.00 0.00 0.00 0.00 35.03 34.55 1n9c n LYS 91 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76