#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 5.52 0.19 4.52 1.11 -1.26 -4.83 116.67 121.92 1n9c s ASP 23 Ca 0.00 0.19 -0.16 0.00 0.18 0.00 0.00 52.55 52.76 1n9c s ASP 23 Cb 0.00 -2.54 0.16 0.00 1.07 0.00 0.00 42.92 41.62 1n9c s ASP 23 CO 0.00 -2.21 1.64 0.00 1.18 0.00 0.00 175.17 175.77 1n9c h ALA 24 N 13.66 0.27 -0.51 5.23 0.00 -1.93 0.24 119.26 136.22 1n9c h ALA 24 Ca -0.27 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1n9c h ALA 24 Cb 1.13 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1n9c h ALA 24 CO 1.22 -0.48 0.29 1.05 0.00 0.00 0.00 179.25 181.33 1n9c h GLU 25 N -0.04 0.70 -0.93 0.00 4.11 -1.91 -2.16 114.58 114.36 1n9c h GLU 25 Ca 0.25 -0.08 0.06 0.00 0.07 0.00 0.00 59.36 59.66 1n9c h GLU 25 Cb 0.42 -0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.46 1n9c h GLU 25 CO -0.55 0.53 0.59 0.00 0.07 0.00 0.00 179.01 179.65 1n9c h ALA 26 N 1.13 1.28 0.02 1.06 0.00 -1.01 0.35 119.26 122.09 1n9c h ALA 26 Ca 0.18 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1n9c h ALA 26 Cb 0.03 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1n9c h ALA 26 CO -0.03 0.35 -0.28 0.28 0.00 0.00 0.00 179.25 179.58 1n9c h VAL 27 N 1.07 0.00 -0.49 0.00 2.07 -0.74 -2.49 116.25 115.66 1n9c h VAL 27 Ca 0.40 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.80 1n9c h VAL 27 Cb 0.17 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.92 1n9c h VAL 27 CO -0.17 0.00 -0.17 0.58 0.02 0.00 0.00 177.57 177.83 1n9c h VAL 28 N -0.36 1.27 0.00 2.57 2.07 -0.24 0.35 116.25 121.91 1n9c h VAL 28 Ca 0.00 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.20 1n9c h VAL 28 Cb 0.38 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1n9c h VAL 28 CO -0.18 0.46 0.00 0.00 0.02 0.00 0.00 177.57 177.87 1n9c n GLN 29 N -4.12 0.00 0.00 1.57 1.13 1.00 -1.18 117.38 115.77 1n9c n GLN 29 Ca 0.01 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 1n9c n GLN 29 Cb 0.43 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.30 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 -0.92 0.50 -0.02 -1.09 7.27 0.19 -4.85 117.38 118.45 1n9c n GLN 30 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 56.95 1n9c n GLN 30 Cb 0.00 -0.76 -0.14 0.00 2.41 0.00 0.00 30.24 31.75 1n9c n GLN 30 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1n9c n LYS 31 N -1.84 0.66 -0.06 3.69 3.00 0.99 -4.44 118.16 120.16 1n9c n LYS 31 Ca 0.00 0.26 -0.08 0.00 -0.00 0.00 0.00 58.31 58.49 1n9c n LYS 31 Cb 0.26 -1.75 -0.06 0.00 0.00 0.00 0.00 35.03 33.48 1n9c n LYS 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1n9c h ILE 33 N 0.00 0.51 -0.88 0.00 3.07 -1.53 0.54 117.51 119.23 1n9c h ILE 33 Ca -0.27 0.00 0.26 0.00 1.55 0.00 0.00 64.86 66.40 1n9c h ILE 33 Cb 1.43 0.58 -0.16 0.00 -0.27 0.00 0.00 36.82 38.40 1n9c h ILE 33 CO -0.04 0.00 0.08 -0.24 -1.05 0.00 0.00 178.15 176.90 1n9c n SER 34 N -4.12 -0.05 -0.06 2.16 2.88 -1.26 -0.20 113.62 112.97 1n9c n SER 34 Ca 0.15 1.49 -0.10 0.00 -1.33 0.00 0.00 58.87 59.08 1n9c n SER 34 Cb 0.86 -0.57 -0.05 0.00 -0.75 0.00 0.00 64.21 63.70 1n9c n SER 34 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n9c h HIS 36 N -0.14 0.00 0.00 0.00 3.86 -0.97 0.28 115.15 118.18 1n9c h HIS 36 Ca -0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 1n9c h HIS 36 Cb 1.37 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.84 1n9c h HIS 36 CO -0.00 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.20 1n9c n GLY 37 N 0.32 -0.90 0.40 2.45 0.00 0.72 -0.46 105.19 107.72 1n9c n GLY 37 Ca 0.03 -1.51 -0.08 0.00 0.00 0.00 0.00 46.02 44.46 1n9c n GLY 37 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1n9c h GLY 38 N 0.00 -0.45 1.02 -0.02 0.00 -1.96 0.19 103.07 101.86 1n9c h GLY 38 Ca 0.00 0.61 0.00 0.00 0.00 0.00 0.00 47.33 47.94 1n9c h GLY 38 CO 0.00 -0.12 -0.00 1.22 0.00 0.00 0.00 176.54 177.64 1n9c n ASP 39 N -5.39 0.06 -1.30 0.19 8.00 -1.26 -4.87 116.55 111.98 1n9c n ASP 39 Ca 0.03 -0.90 -0.14 0.00 0.71 0.00 0.00 54.79 54.49 1n9c n ASP 39 Cb 0.34 -0.04 -0.04 0.00 -0.02 0.00 0.00 41.12 41.36 1n9c n ASP 39 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1n9c n LEU 40 N -1.00 -1.27 0.00 0.64 4.77 0.67 -4.62 117.00 116.19 1n9c n LEU 40 Ca 0.22 0.22 0.14 0.00 -0.03 0.00 0.00 56.01 56.57 1n9c n LEU 40 Cb 0.14 -2.15 0.71 0.00 -2.33 0.00 0.00 43.42 39.79 1n9c n LEU 40 CO 0.19 -0.53 1.00 0.35 -1.33 0.00 0.00 177.39 177.06 1n9c n THR 41 N -3.10 0.02 -0.12 -5.08 -2.24 -1.23 -0.73 114.28 101.79 1n9c n THR 41 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1n9c n THR 41 Cb 0.53 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.25 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 1.31 0.62 0.00 3.38 0.00 0.39 -3.95 105.19 106.95 1n9c n GLY 42 Ca 0.12 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.05 0.00 0.85 4.61 0.00 -0.52 -4.62 120.51 120.78 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 0.01 0.00 0.22 0.00 0.00 0.00 0.00 19.45 19.68 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 -0.78 2.83 -3.98 0.00 2.88 0.98 -4.92 113.62 110.63 1n9c n SER 44 Ca 0.00 -1.90 -0.09 0.00 -1.33 0.00 0.00 58.87 55.55 1n9c n SER 44 Cb 0.00 -0.10 -0.08 0.00 -0.75 0.00 0.00 64.21 63.28 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 -1.80 0.17 1.00 -1.46 0.00 -1.11 -4.92 121.76 113.65 1n9c s ALA 45 Ca 0.34 -0.96 -0.12 0.00 0.00 0.00 0.00 51.96 51.22 1n9c s ALA 45 Cb 0.21 0.59 0.19 0.00 0.00 0.00 0.00 23.12 24.11 1n9c s ALA 45 CO 0.31 -0.51 1.08 -1.25 0.00 0.00 0.00 175.76 175.39 1n9c s PRO 46 N -3.93 0.38 -0.08 0.00 0.04 -1.26 -4.22 135.00 125.93 1n9c s PRO 46 Ca 0.11 1.03 -0.29 0.00 0.04 0.00 0.00 61.00 61.89 1n9c s PRO 46 Cb 0.06 -1.69 -0.06 0.00 0.04 0.00 0.00 34.50 32.85 1n9c s PRO 46 CO -0.06 -2.90 1.79 0.00 0.04 0.00 0.00 177.00 175.86 1n9c s ALA 47 N -2.68 3.45 -0.88 8.56 0.00 -1.25 -4.15 121.76 124.80 1n9c s ALA 47 Ca 0.66 0.93 0.07 0.00 0.00 0.00 0.00 51.96 53.62 1n9c s ALA 47 Cb -0.22 -3.83 0.06 0.00 0.00 0.00 0.00 23.12 19.13 1n9c s ALA 47 CO 0.60 -1.70 0.74 0.44 0.00 0.00 0.00 175.76 175.84 1n9c n ILE 48 N 5.92 0.03 -0.24 0.00 -6.64 0.08 -4.57 119.36 113.95 1n9c n ILE 48 Ca 0.20 -0.52 0.18 0.00 -1.77 0.00 0.00 62.75 60.84 1n9c n ILE 48 Cb 0.43 1.13 0.50 0.00 -1.44 0.00 0.00 39.64 40.26 1n9c n ILE 48 CO 0.00 0.00 0.00 -2.24 -1.77 0.00 0.00 176.55 172.54 1n9c h ASP 49 N 1.39 0.43 -0.30 7.28 2.03 -1.19 0.74 116.42 126.80 1n9c h ASP 49 Ca 0.00 0.04 0.00 0.00 -0.73 0.00 0.00 57.03 56.34 1n9c h ASP 49 Cb 0.31 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 38.77 1n9c h ASP 49 CO 0.00 0.18 0.00 0.29 -1.03 0.00 0.00 179.24 178.68 1n9c n LYS 50 N -4.52 2.32 -0.22 4.15 4.01 -1.26 -4.38 118.16 118.26 1n9c n LYS 50 Ca 0.19 -1.98 0.16 0.00 -0.51 0.00 0.00 58.31 56.17 1n9c n LYS 50 Cb 0.67 -1.48 0.48 0.00 -0.51 0.00 0.00 35.03 34.19 1n9c n LYS 50 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1n9c h ALA 51 N 4.43 2.10 -0.38 7.82 0.00 -1.09 0.34 119.26 132.49 1n9c h ALA 51 Ca 0.00 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.97 1n9c h ALA 51 Cb 0.87 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1n9c h ALA 51 CO 0.00 -0.35 0.26 0.78 0.00 0.00 0.00 179.25 179.94 1n9c h GLY 52 N 0.46 0.36 0.69 0.00 0.00 -1.67 0.39 103.07 103.30 1n9c h GLY 52 Ca 0.43 -0.12 -0.10 0.00 0.00 0.00 0.00 47.33 47.54 1n9c h GLY 52 CO -0.16 0.09 -0.37 0.00 0.00 0.00 0.00 176.54 176.10 1n9c h ALA 53 N 1.79 0.12 -0.10 3.60 0.00 -0.64 -3.38 119.26 120.66 1n9c h ALA 53 Ca 0.17 -0.47 -0.22 0.00 0.00 0.00 0.00 54.91 54.39 1n9c h ALA 53 Cb 0.29 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.09 1n9c h ALA 53 CO -0.04 0.22 -0.81 -0.91 0.00 0.00 0.00 179.25 177.71 1n9c h ASN 54 N -0.16 0.77 -4.76 0.00 2.35 -0.59 -3.46 115.58 109.73 1n9c h ASN 54 Ca -0.03 -0.53 -0.20 0.00 -0.55 0.00 0.00 56.30 54.98 1n9c h ASN 54 Cb 1.04 -0.23 -0.15 0.00 0.05 0.00 0.00 38.32 39.03 1n9c h ASN 54 CO 0.08 1.31 -0.69 -0.31 -1.65 0.00 0.00 177.43 176.17 1n9c s TYR 55 N -3.62 0.83 0.50 1.19 2.02 0.13 -5.08 117.35 113.32 1n9c s TYR 55 Ca -0.08 -0.96 0.03 0.00 -0.37 0.00 0.00 57.07 55.68 1n9c s TYR 55 Cb 0.09 -0.50 0.02 0.00 -0.40 0.00 0.00 41.96 41.17 1n9c s TYR 55 CO 0.89 -0.21 0.70 -1.12 -1.57 0.00 0.00 175.55 174.23 1n9c s SER 56 N -3.03 5.46 0.27 2.29 0.01 -1.26 -4.01 113.70 113.43 1n9c s SER 56 Ca 0.12 -0.10 -0.02 0.00 1.31 0.00 0.00 55.95 57.26 1n9c s SER 56 Cb 0.06 -0.89 0.41 0.00 0.21 0.00 0.00 66.02 65.81 1n9c s SER 56 CO -0.05 -0.97 1.88 1.05 0.41 0.00 0.00 173.24 175.55 1n9c h GLU 57 N 0.28 1.13 -0.12 12.44 -0.00 -1.91 -2.01 114.58 124.39 1n9c h GLU 57 Ca -0.42 -0.07 0.05 0.00 -0.00 0.00 0.00 59.36 58.92 1n9c h GLU 57 Cb 1.29 -0.25 -0.05 0.00 -0.00 0.00 0.00 28.75 29.73 1n9c h GLU 57 CO 0.51 0.75 -0.22 1.05 -0.00 0.00 0.00 179.01 181.09 1n9c h GLU 58 N 1.16 -0.28 -0.12 1.06 9.09 -1.94 0.20 114.58 123.75 1n9c h GLU 58 Ca 0.43 0.02 0.03 0.00 0.05 0.00 0.00 59.36 59.89 1n9c h GLU 58 Cb 0.18 0.06 -0.03 0.00 -1.65 0.00 0.00 28.75 27.32 1n9c h GLU 58 CO -0.18 -0.18 -0.04 0.93 0.05 0.00 0.00 179.01 179.58 1n9c h GLU 59 N -0.29 -0.02 0.17 1.06 4.39 -1.77 -0.12 114.58 118.00 1n9c h GLU 59 Ca 0.10 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.79 1n9c h GLU 59 Cb 0.43 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 1n9c h GLU 59 CO -0.29 -0.01 -0.08 0.82 -1.16 0.00 0.00 179.01 178.28 1n9c h ILE 60 N -0.02 0.86 -0.30 3.13 2.04 -0.98 0.22 117.51 122.45 1n9c h ILE 60 Ca 0.06 -0.12 0.07 0.00 1.00 0.00 0.00 64.86 65.87 1n9c h ILE 60 Cb 0.12 0.93 -0.08 0.00 -0.74 0.00 0.00 36.82 37.05 1n9c h ILE 60 CO -0.14 0.03 -0.34 0.25 0.00 0.00 0.00 178.15 177.95 1n9c h LEU 61 N -0.28 -1.10 -0.52 1.44 5.85 -0.43 0.70 115.31 120.96 1n9c h LEU 61 Ca -0.02 0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1n9c h LEU 61 Cb 0.22 0.49 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 1n9c h LEU 61 CO 0.04 -0.34 0.27 -0.78 -0.34 0.00 0.00 178.44 177.29 1n9c h ASP 62 N -0.32 0.67 -0.82 1.25 3.58 -0.74 -0.25 116.42 119.78 1n9c h ASP 62 Ca 0.14 -0.11 0.03 0.00 0.42 0.00 0.00 57.03 57.50 1n9c h ASP 62 Cb 0.55 -0.17 -0.05 0.00 1.72 0.00 0.00 39.33 41.38 1n9c h ASP 62 CO -0.47 0.59 0.53 0.40 -2.88 0.00 0.00 179.24 177.41 1n9c h ILE 63 N 0.70 1.15 0.01 2.25 2.04 -0.18 0.28 117.51 123.76 1n9c h ILE 63 Ca 0.18 -0.36 -0.00 0.00 1.00 0.00 0.00 64.86 65.68 1n9c h ILE 63 Cb 0.08 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.17 1n9c h ILE 63 CO -0.03 0.19 -0.00 0.40 0.00 0.00 0.00 178.15 178.71 1n9c h ILE 64 N 1.06 1.13 -0.59 -0.67 2.04 -0.26 0.43 117.51 120.65 1n9c h ILE 64 Ca 0.32 -0.41 -0.07 0.00 1.00 0.00 0.00 64.86 65.70 1n9c h ILE 64 Cb -0.03 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 1n9c h ILE 64 CO -0.10 0.11 0.08 -0.07 0.00 0.00 0.00 178.15 178.17 1n9c h LEU 65 N -0.18 0.91 0.00 1.44 3.38 -0.56 0.12 115.31 120.42 1n9c h LEU 65 Ca -0.00 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1n9c h LEU 65 Cb 0.18 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 1n9c h LEU 65 CO 0.00 0.92 -0.53 0.78 0.09 0.00 0.00 178.44 179.71 1n9c h ASN 66 N 0.90 0.00 0.00 -0.43 2.35 -0.42 -2.36 115.58 115.63 1n9c h ASN 66 Ca 0.18 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1n9c h ASN 66 Cb 0.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 1n9c h ASN 66 CO 0.01 0.79 0.00 0.61 -1.65 0.00 0.00 177.43 177.20 1n9c n GLY 67 N 1.61 2.58 3.61 2.83 0.00 0.15 -3.34 105.19 112.64 1n9c n GLY 67 Ca -0.09 -1.03 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 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 0.71 0.81 -0.06 1.61 -0.06 -1.20 -4.83 117.38 114.36 1n9c n GLN 68 Ca 0.00 0.32 -0.02 0.00 -2.00 0.00 0.00 57.00 55.31 1n9c n GLN 68 Cb 0.00 -2.16 -0.01 0.00 -4.06 0.00 0.00 30.24 24.01 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 1.30 -0.94 1.30 1.69 0.00 -1.26 -0.23 105.19 107.04 1n9c n GLY 69 Ca 0.14 0.28 -0.01 0.00 0.00 0.00 0.00 46.02 46.42 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 -1.04 2.51 2.70 -0.02 0.00 -1.26 -4.83 105.19 103.26 1n9c n GLY 70 Ca 0.00 -0.47 -0.20 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.77 0.04 0.35 1.61 0.00 0.68 -5.14 119.30 115.07 1n9c s MET 71 Ca 0.27 0.31 -0.28 0.00 0.00 0.00 0.00 55.69 55.98 1n9c s MET 71 Cb 0.21 -0.55 -0.10 0.00 0.00 0.00 0.00 34.83 34.39 1n9c s MET 71 CO 0.07 -0.30 1.31 -1.25 0.00 0.00 0.00 175.02 174.85 1n9c s PRO 72 N 1.98 4.25 0.13 4.11 0.04 -1.26 -3.22 135.00 141.03 1n9c s PRO 72 Ca 0.03 2.20 0.01 0.00 0.04 0.00 0.00 61.00 63.28 1n9c s PRO 72 Cb -0.12 -2.98 0.01 0.00 0.04 0.00 0.00 34.50 31.45 1n9c s PRO 72 CO -0.03 -0.27 0.11 0.41 0.04 0.00 0.00 177.00 177.26 1n9c n GLY 73 N 0.75 2.78 2.53 0.56 0.00 -1.21 -4.61 105.19 105.98 1n9c n GLY 73 Ca 0.01 -2.19 -0.03 0.00 0.00 0.00 0.00 46.02 43.81 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 3.43 0.51 0.25 -0.02 0.00 0.42 -4.82 105.19 104.96 1n9c n GLY 74 Ca 0.00 -0.12 0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 1.07 -3.93 -0.61 2.04 -1.82 -3.40 117.51 110.86 1n9c h ILE 75 Ca -0.07 -0.30 -0.28 0.00 1.00 0.00 0.00 64.86 65.21 1n9c h ILE 75 Cb 0.65 1.10 -0.24 0.00 -0.74 0.00 0.00 36.82 37.58 1n9c h ILE 75 CO 0.10 0.09 -0.74 0.00 0.00 0.00 0.00 178.15 177.60 1n9c s ALA 76 N -4.92 0.46 0.10 1.87 0.00 -1.26 -5.04 121.76 112.97 1n9c s ALA 76 Ca -0.05 -0.52 -0.04 0.00 0.00 0.00 0.00 51.96 51.35 1n9c s ALA 76 Cb 0.16 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.25 1n9c s ALA 76 CO 0.69 0.02 0.10 0.15 0.00 0.00 0.00 175.76 176.71 1n9c s LYS 77 N -0.97 0.83 3.46 0.00 1.02 -1.26 -4.39 119.74 118.43 1n9c s LYS 77 Ca -0.06 -1.19 0.00 0.00 0.02 0.00 0.00 55.97 54.74 1n9c s LYS 77 Cb -0.07 0.28 0.00 0.00 -0.52 0.00 0.00 37.83 37.52 1n9c s LYS 77 CO 0.00 -0.23 0.00 0.41 -0.92 0.00 0.00 175.35 174.61 1n9c n GLY 78 N -0.03 2.40 0.41 -3.33 0.00 -1.26 -1.78 105.19 101.60 1n9c n GLY 78 Ca -0.11 -0.26 0.34 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.53 2.47 0.90 4.61 0.00 -1.99 0.14 119.26 124.86 1n9c h ALA 79 Ca 0.00 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1n9c h ALA 79 Cb 0.00 0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1n9c h ALA 79 CO 0.00 -1.14 -0.43 1.49 0.00 0.00 0.00 179.25 179.17 1n9c h GLU 80 N 0.10 -1.17 -0.52 0.00 4.81 -1.70 0.10 114.58 116.20 1n9c h GLU 80 Ca 0.81 0.08 -0.07 0.00 -0.13 0.00 0.00 59.36 60.06 1n9c h GLU 80 Cb 2.35 0.27 -0.02 0.00 0.63 0.00 0.00 28.75 31.98 1n9c h GLU 80 CO -0.54 -0.78 0.07 0.00 -0.73 0.00 0.00 179.01 177.04 1n9c h ALA 81 N -1.17 0.70 -0.15 2.92 0.00 -0.84 -0.38 119.26 120.35 1n9c h ALA 81 Ca -0.12 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.58 1n9c h ALA 81 Cb 0.93 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 1n9c h ALA 81 CO 0.20 0.45 -0.17 0.93 0.00 0.00 0.00 179.25 180.66 1n9c h GLU 82 N 0.76 -0.20 -0.12 0.00 5.08 -0.95 0.12 114.58 119.27 1n9c h GLU 82 Ca 0.16 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.57 1n9c h GLU 82 Cb 0.43 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.68 1n9c h GLU 82 CO 0.01 -0.13 -0.12 0.00 -1.00 0.00 0.00 179.01 177.77 1n9c h ALA 83 N 0.85 -0.03 0.03 3.43 0.00 -0.58 -2.48 119.26 120.47 1n9c h ALA 83 Ca 0.10 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.08 1n9c h ALA 83 Cb 0.36 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 1n9c h ALA 83 CO -0.27 -0.57 -0.50 0.28 0.00 0.00 0.00 179.25 178.19 1n9c h VAL 84 N -0.14 0.00 -0.18 0.00 2.07 -0.33 -1.64 116.25 116.03 1n9c h VAL 84 Ca 0.08 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.66 1n9c h VAL 84 Cb 0.26 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.97 1n9c h VAL 84 CO -0.21 0.00 -0.25 0.00 0.02 0.00 0.00 177.57 177.14 1n9c h ALA 85 N -0.53 -0.19 0.05 1.67 0.00 -0.54 0.45 119.26 120.16 1n9c h ALA 85 Ca 0.01 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1n9c h ALA 85 Cb 0.68 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 1n9c h ALA 85 CO -0.32 -0.69 -0.27 0.00 0.00 0.00 0.00 179.25 177.96 1n9c h ALA 86 N 0.69 -0.41 -0.79 0.00 0.00 -1.40 0.71 119.26 118.06 1n9c h ALA 86 Ca 0.12 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1n9c h ALA 86 Cb 0.46 0.47 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 1n9c h ALA 86 CO -0.35 -0.79 0.36 2.35 0.00 0.00 0.00 179.25 180.83 1n9c h TRP 87 N -0.45 1.15 0.01 0.00 7.01 -0.53 0.40 115.95 123.54 1n9c h TRP 87 Ca 0.05 -0.06 -0.21 0.00 2.11 0.00 0.00 58.89 60.78 1n9c h TRP 87 Cb 0.51 -0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 27.21 1n9c h TRP 87 CO -0.28 0.84 -0.92 1.25 -2.79 0.00 0.00 178.44 176.54 1n9c h LEU 88 N 1.13 0.37 0.02 0.65 7.12 0.15 0.12 115.31 124.87 1n9c h LEU 88 Ca 0.27 -0.30 0.03 0.00 0.13 0.00 0.00 57.88 58.01 1n9c h LEU 88 Cb 0.14 -0.11 -0.04 0.00 -0.53 0.00 0.00 40.66 40.11 1n9c h LEU 88 CO -0.03 1.11 -0.25 0.00 -0.13 0.00 0.00 178.44 179.14 1n9c h ALA 89 N 0.86 -0.35 0.00 1.25 0.00 -0.66 -2.89 119.26 117.46 1n9c h ALA 89 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1n9c h ALA 89 Cb 1.56 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.79 1n9c h ALA 89 CO 0.15 -0.76 0.00 -0.85 0.00 0.00 0.00 179.25 177.79 1n9c n GLU 90 N -5.37 0.10 0.25 0.00 0.28 0.11 -2.21 120.64 113.81 1n9c n GLU 90 Ca -0.05 0.18 0.12 0.00 -0.16 0.00 0.00 57.16 57.25 1n9c n GLU 90 Cb 0.28 -1.50 0.66 0.00 1.43 0.00 0.00 31.44 32.32 1n9c n GLU 90 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 177.13 176.75 1n9c h LYS 91 N 0.00 0.00 0.00 3.44 3.11 -0.60 -3.50 116.57 119.02 1n9c h LYS 91 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1n9c h LYS 91 Cb 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.46 1n9c h LYS 91 CO 0.00 0.14 0.00 0.36 -2.81 0.00 0.00 179.45 177.14