#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 6.25 0.14 4.52 1.11 -1.26 -4.86 116.67 122.57 1n9c s ASP 23 Ca 0.00 0.96 -0.19 0.00 0.18 0.00 0.00 52.55 53.50 1n9c s ASP 23 Cb 0.00 -2.54 -0.00 0.00 1.07 0.00 0.00 42.92 41.45 1n9c s ASP 23 CO 0.00 -1.48 1.71 0.00 1.18 0.00 0.00 175.17 176.59 1n9c h ALA 24 N 11.11 0.20 -0.82 5.23 0.00 -1.93 0.95 119.26 134.00 1n9c h ALA 24 Ca -0.29 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1n9c h ALA 24 Cb 1.12 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 1n9c h ALA 24 CO 1.07 -0.44 0.53 1.05 0.00 0.00 0.00 179.25 181.46 1n9c h GLU 25 N 0.05 1.09 -0.28 0.00 4.11 -1.92 -1.24 114.58 116.40 1n9c h GLU 25 Ca 0.12 -0.08 -0.01 0.00 0.07 0.00 0.00 59.36 59.46 1n9c h GLU 25 Cb 0.16 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1n9c h GLU 25 CO -0.21 0.74 0.15 0.00 0.07 0.00 0.00 179.01 179.77 1n9c h ALA 26 N 1.29 0.36 -0.26 1.06 0.00 -1.30 0.34 119.26 120.75 1n9c h ALA 26 Ca 0.30 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1n9c h ALA 26 Cb -0.10 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.52 1n9c h ALA 26 CO -0.06 -0.11 -0.43 0.28 0.00 0.00 0.00 179.25 178.93 1n9c h VAL 27 N 0.34 0.00 -0.69 0.00 2.07 -0.85 -2.24 116.25 114.88 1n9c h VAL 27 Ca 0.10 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.59 1n9c h VAL 27 Cb 0.06 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.80 1n9c h VAL 27 CO -0.02 0.00 0.32 0.58 0.02 0.00 0.00 177.57 178.48 1n9c h VAL 28 N -0.35 1.23 0.00 2.57 2.07 -0.03 0.42 116.25 122.16 1n9c h VAL 28 Ca 0.05 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1n9c h VAL 28 Cb 0.48 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1n9c h VAL 28 CO -0.43 0.27 0.00 0.00 0.02 0.00 0.00 177.57 177.43 1n9c n GLN 29 N -4.44 0.29 0.00 1.57 1.13 0.11 -0.88 117.38 115.15 1n9c n GLN 29 Ca 0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.11 1n9c n GLN 29 Cb 0.13 -1.43 0.00 0.00 0.11 0.00 0.00 30.24 29.06 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 -0.93 2.70 -0.00 -1.09 0.00 0.22 -4.85 117.38 113.42 1n9c n GLN 30 Ca 0.06 0.00 0.02 0.00 -0.00 0.00 0.00 57.00 57.08 1n9c n GLN 30 Cb 0.03 -0.74 -0.03 0.00 0.00 0.00 0.00 30.24 29.50 1n9c n GLN 30 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1n9c n LYS 31 N -0.90 0.80 -0.04 3.69 5.02 0.12 -4.65 118.16 122.20 1n9c n LYS 31 Ca 0.00 -0.03 -0.07 0.00 -2.02 0.00 0.00 58.31 56.19 1n9c n LYS 31 Cb 0.08 -1.03 -0.04 0.00 -0.02 0.00 0.00 35.03 34.02 1n9c n LYS 31 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n9c h ILE 33 N -0.11 0.60 -0.85 0.00 3.07 -1.61 0.37 117.51 118.98 1n9c h ILE 33 Ca -0.21 -0.00 0.35 0.00 1.55 0.00 0.00 64.86 66.55 1n9c h ILE 33 Cb 1.27 0.60 -0.15 0.00 -0.27 0.00 0.00 36.82 38.26 1n9c h ILE 33 CO -0.07 0.00 0.43 -1.20 -1.05 0.00 0.00 178.15 176.26 1n9c n SER 34 N -4.30 0.27 -0.03 2.16 7.64 -1.26 -0.29 113.62 117.81 1n9c n SER 34 Ca 0.16 1.42 -0.04 0.00 1.01 0.00 0.00 58.87 61.42 1n9c n SER 34 Cb 0.87 -0.68 -0.02 0.00 -1.01 0.00 0.00 64.21 63.37 1n9c n SER 34 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1n9c h HIS 36 N -0.04 0.00 0.00 0.00 3.86 -0.87 0.19 115.15 118.29 1n9c h HIS 36 Ca -0.13 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.08 1n9c h HIS 36 Cb 1.18 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.65 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 0.10 1.71 2.01 2.45 0.00 0.60 -0.67 105.19 111.39 1n9c n GLY 37 Ca 0.02 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.44 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 0.00 -1.83 0.00 -0.02 0.00 -1.26 -4.57 105.19 97.52 1n9c n GLY 38 Ca 0.00 0.42 0.10 0.00 0.00 0.00 0.00 46.02 46.54 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 -2.93 0.00 -0.72 1.61 9.92 -1.26 -4.86 116.55 118.31 1n9c n ASP 39 Ca 0.00 -1.03 -0.09 0.00 -0.53 0.00 0.00 54.79 53.13 1n9c n ASP 39 Cb 0.00 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 40.44 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 -0.88 -0.71 0.00 0.64 4.77 -1.26 -4.45 117.00 115.12 1n9c n LEU 40 Ca 0.15 0.22 0.12 0.00 -0.03 0.00 0.00 56.01 56.46 1n9c n LEU 40 Cb 0.07 -1.55 0.55 0.00 -2.33 0.00 0.00 43.42 40.16 1n9c n LEU 40 CO 0.11 -0.47 0.89 0.35 -1.33 0.00 0.00 177.39 176.95 1n9c n THR 41 N -2.79 0.30 0.00 -5.08 -2.24 -1.24 -0.36 114.28 102.87 1n9c n THR 41 Ca -0.09 0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1n9c n THR 41 Cb 0.32 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 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 0.92 0.77 0.00 3.38 0.00 0.15 -4.00 105.19 106.41 1n9c n GLY 42 Ca 0.08 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 0.00 -0.01 0.90 4.61 0.00 -0.27 -4.57 120.51 121.17 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 0.25 0.00 0.00 0.00 0.00 19.45 19.70 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 -0.89 2.69 -3.95 0.00 2.88 0.65 -4.92 113.62 110.08 1n9c n SER 44 Ca 0.00 -1.87 -0.09 0.00 -1.33 0.00 0.00 58.87 55.58 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 0.06 0.96 -1.46 0.00 -1.18 -4.92 121.76 113.42 1n9c s ALA 45 Ca 0.34 -0.87 -0.11 0.00 0.00 0.00 0.00 51.96 51.31 1n9c s ALA 45 Cb 0.21 0.60 0.17 0.00 0.00 0.00 0.00 23.12 24.09 1n9c s ALA 45 CO 0.30 -0.52 1.09 -1.25 0.00 0.00 0.00 175.76 175.38 1n9c s PRO 46 N -3.92 0.69 -0.22 0.00 0.04 -1.26 -4.21 135.00 126.12 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 0.05 -1.73 -0.03 0.00 0.04 0.00 0.00 34.50 32.83 1n9c s PRO 46 CO -0.06 -2.69 1.71 0.00 0.04 0.00 0.00 177.00 175.99 1n9c s ALA 47 N -2.74 3.20 -1.71 8.56 0.00 -1.26 -4.27 121.76 123.54 1n9c s ALA 47 Ca 0.65 0.52 0.16 0.00 0.00 0.00 0.00 51.96 53.29 1n9c s ALA 47 Cb -0.21 -3.89 0.06 0.00 0.00 0.00 0.00 23.12 19.08 1n9c s ALA 47 CO 0.59 -2.08 0.92 0.44 0.00 0.00 0.00 175.76 175.63 1n9c n ILE 48 N 6.59 0.00 -0.23 0.00 -6.64 0.51 -4.50 119.36 115.09 1n9c n ILE 48 Ca 0.20 -0.42 0.07 0.00 -1.77 0.00 0.00 62.75 60.83 1n9c n ILE 48 Cb 0.45 1.26 0.15 0.00 -1.44 0.00 0.00 39.64 40.06 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 0.40 -0.15 -0.79 7.28 5.75 0.41 -0.67 116.55 128.78 1n9c n ASP 49 Ca 0.08 1.13 0.08 0.00 -0.01 0.00 0.00 54.79 56.07 1n9c n ASP 49 Cb 0.36 -0.38 0.14 0.00 -1.03 0.00 0.00 41.12 40.22 1n9c n ASP 49 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1n9c n LYS 50 N -4.97 2.01 -0.34 0.11 2.85 -1.26 -4.60 118.16 111.96 1n9c n LYS 50 Ca 0.13 -1.87 0.22 0.00 -1.05 0.00 0.00 58.31 55.74 1n9c n LYS 50 Cb 0.43 -1.35 0.48 0.00 -0.65 0.00 0.00 35.03 33.94 1n9c n LYS 50 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1n9c h ALA 51 N 3.08 2.12 -0.55 0.58 0.00 -1.13 0.35 119.26 123.71 1n9c h ALA 51 Ca 0.00 0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.11 1n9c h ALA 51 Cb 0.75 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1n9c h ALA 51 CO 0.00 -0.56 0.37 0.78 0.00 0.00 0.00 179.25 179.84 1n9c h GLY 52 N 0.43 0.40 0.68 0.00 0.00 -1.70 0.37 103.07 103.26 1n9c h GLY 52 Ca 0.63 -0.11 -0.09 0.00 0.00 0.00 0.00 47.33 47.76 1n9c h GLY 52 CO -0.37 0.06 -0.29 0.00 0.00 0.00 0.00 176.54 175.94 1n9c h ALA 53 N 1.73 0.14 -0.06 3.60 0.00 -0.58 -3.36 119.26 120.72 1n9c h ALA 53 Ca 0.26 -0.43 -0.20 0.00 0.00 0.00 0.00 54.91 54.54 1n9c h ALA 53 Cb 0.64 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1n9c h ALA 53 CO -0.06 0.17 -0.81 -0.91 0.00 0.00 0.00 179.25 177.64 1n9c h ASN 54 N -0.16 0.57 -4.91 0.00 4.21 -1.00 -3.46 115.58 110.83 1n9c h ASN 54 Ca -0.02 -0.40 -0.21 0.00 1.21 0.00 0.00 56.30 56.89 1n9c h ASN 54 Cb 0.93 -0.17 -0.21 0.00 -1.12 0.00 0.00 38.32 37.75 1n9c h ASN 54 CO 0.06 1.17 -0.71 -0.31 -1.29 0.00 0.00 177.43 176.35 1n9c s TYR 55 N -3.52 0.42 0.46 1.19 2.02 0.12 -5.10 117.35 112.96 1n9c s TYR 55 Ca -0.06 -0.54 -0.07 0.00 -0.37 0.00 0.00 57.07 56.03 1n9c s TYR 55 Cb 0.10 -0.28 -0.04 0.00 -0.40 0.00 0.00 41.96 41.34 1n9c s TYR 55 CO 0.86 -0.16 0.79 -1.12 -1.57 0.00 0.00 175.55 174.35 1n9c s SER 56 N -1.57 6.33 0.24 2.29 0.01 -1.26 -4.05 113.70 115.69 1n9c s SER 56 Ca -0.13 1.00 -0.04 0.00 1.31 0.00 0.00 55.95 58.09 1n9c s SER 56 Cb -0.09 -2.27 0.46 0.00 0.21 0.00 0.00 66.02 64.32 1n9c s SER 56 CO -0.01 -0.54 1.72 1.05 0.41 0.00 0.00 173.24 175.87 1n9c h GLU 57 N 0.50 0.39 -0.57 12.44 -0.00 -1.91 0.42 114.58 125.85 1n9c h GLU 57 Ca -0.47 -0.02 0.11 0.00 -0.00 0.00 0.00 59.36 58.98 1n9c h GLU 57 Cb 1.20 -0.09 -0.09 0.00 -0.00 0.00 0.00 28.75 29.77 1n9c h GLU 57 CO 0.62 0.26 0.02 1.05 -0.00 0.00 0.00 179.01 180.96 1n9c h GLU 58 N 0.40 0.13 -0.20 1.06 4.11 -1.94 0.22 114.58 118.37 1n9c h GLU 58 Ca 0.41 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.82 1n9c h GLU 58 Cb 0.65 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1n9c h GLU 58 CO -0.43 0.09 0.08 0.93 0.07 0.00 0.00 179.01 179.75 1n9c h GLU 59 N 0.14 0.30 -0.00 1.06 5.08 -1.32 -0.53 114.58 119.31 1n9c h GLU 59 Ca 0.29 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.60 1n9c h GLU 59 Cb 0.46 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1n9c h GLU 59 CO -0.47 0.37 0.00 0.82 -1.00 0.00 0.00 179.01 178.74 1n9c h ILE 60 N 0.16 1.09 -0.32 3.13 2.04 -0.71 0.11 117.51 123.02 1n9c h ILE 60 Ca 0.07 -0.26 0.06 0.00 1.00 0.00 0.00 64.86 65.72 1n9c h ILE 60 Cb 0.19 1.26 -0.08 0.00 -0.74 0.00 0.00 36.82 37.45 1n9c h ILE 60 CO -0.00 0.07 -0.45 0.25 0.00 0.00 0.00 178.15 178.01 1n9c h LEU 61 N -0.10 -1.48 -0.45 1.44 5.85 -0.51 0.13 115.31 120.18 1n9c h LEU 61 Ca 0.00 0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.97 1n9c h LEU 61 Cb 0.11 0.63 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 1n9c h LEU 61 CO -0.00 -0.40 0.22 -0.78 -0.34 0.00 0.00 178.44 177.15 1n9c h ASP 62 N -0.40 0.32 -0.72 1.25 3.58 -0.84 -1.03 116.42 118.58 1n9c h ASP 62 Ca 0.11 0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.57 1n9c h ASP 62 Cb 0.60 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.59 1n9c h ASP 62 CO -0.53 0.22 0.40 0.40 -2.88 0.00 0.00 179.24 176.86 1n9c h ILE 63 N 0.44 1.22 -0.04 2.25 2.04 -0.07 0.34 117.51 123.69 1n9c h ILE 63 Ca 0.20 -0.53 0.01 0.00 1.00 0.00 0.00 64.86 65.54 1n9c h ILE 63 Cb 0.11 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1n9c h ILE 63 CO -0.14 0.24 -0.04 0.40 0.00 0.00 0.00 178.15 178.60 1n9c h ILE 64 N 0.99 0.88 -0.63 -0.67 2.04 -0.26 0.41 117.51 120.28 1n9c h ILE 64 Ca 0.26 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.07 1n9c h ILE 64 Cb 0.02 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 36.95 1n9c h ILE 64 CO -0.04 0.00 0.21 -0.07 0.00 0.00 0.00 178.15 178.25 1n9c h LEU 65 N -0.06 0.87 0.00 1.44 3.38 -0.36 0.31 115.31 120.89 1n9c h LEU 65 Ca 0.03 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 57.73 1n9c h LEU 65 Cb 0.10 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1n9c h LEU 65 CO -0.07 0.81 -1.28 0.59 0.09 0.00 0.00 178.44 178.58 1n9c n ASN 66 N -4.29 1.91 0.00 -0.43 3.02 0.11 -1.85 115.26 113.73 1n9c n ASN 66 Ca 0.05 0.41 0.00 0.00 -0.03 0.00 0.00 54.58 55.01 1n9c n ASN 66 Cb 0.20 -0.81 0.00 0.00 -0.61 0.00 0.00 39.78 38.56 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 1.44 0.80 3.57 7.41 0.00 0.14 -4.28 105.19 114.26 1n9c n GLY 67 Ca -0.24 -2.07 -0.01 0.00 0.00 0.00 0.00 46.02 43.70 1n9c n GLY 67 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1n9c s GLN 68 N -1.19 0.47 2.06 1.61 2.00 -1.18 -4.60 119.66 118.83 1n9c s GLN 68 Ca 0.00 1.03 0.00 0.00 -2.00 0.00 0.00 55.36 54.39 1n9c s GLN 68 Cb 0.00 0.47 0.00 0.00 0.80 0.00 0.00 33.01 34.28 1n9c s GLN 68 CO 0.00 -0.14 0.00 0.41 -0.50 0.00 0.00 175.29 175.06 1n9c n GLY 69 N 4.78 2.08 0.15 2.59 0.00 -1.26 -0.01 105.19 113.52 1n9c n GLY 69 Ca -0.14 0.45 0.13 0.00 0.00 0.00 0.00 46.02 46.46 1n9c n GLY 69 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1n9c h GLY 70 N 0.00 0.00 -5.12 -0.02 0.00 -2.01 -3.45 103.07 92.47 1n9c h GLY 70 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1n9c h GLY 70 CO 0.00 0.00 1.05 -0.29 0.00 0.00 0.00 176.54 177.30 1n9c s MET 71 N -3.20 4.19 0.33 4.80 0.00 0.98 -4.90 119.30 121.50 1n9c s MET 71 Ca 0.08 2.26 0.04 0.00 0.00 0.00 0.00 55.69 58.07 1n9c s MET 71 Cb 0.10 -3.83 0.58 0.00 0.00 0.00 0.00 34.83 31.68 1n9c s MET 71 CO 0.59 -0.79 1.86 -1.00 0.00 0.00 0.00 175.02 175.68 1n9c h PRO 72 N 9.05 0.53 -0.01 4.11 0.13 -1.87 -3.12 132.00 140.82 1n9c h PRO 72 Ca -0.41 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1n9c h PRO 72 Cb 1.19 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 1n9c h PRO 72 CO 0.94 0.57 -0.00 0.41 -0.23 0.00 0.00 178.00 179.69 1n9c n GLY 73 N -0.85 -2.07 2.44 1.56 0.00 -1.26 -4.57 105.19 100.45 1n9c n GLY 73 Ca 0.01 -1.49 -0.17 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.41 1.14 0.21 -0.02 0.00 0.11 -4.85 105.19 99.36 1n9c n GLY 74 Ca -0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 46.02 45.81 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 1.27 -3.85 -0.61 2.04 -1.86 -3.43 117.51 111.08 1n9c h ILE 75 Ca -0.36 -1.30 -0.32 0.00 1.00 0.00 0.00 64.86 63.89 1n9c h ILE 75 Cb 1.15 1.53 -0.19 0.00 -0.74 0.00 0.00 36.82 38.57 1n9c h ILE 75 CO 0.50 0.39 -0.74 0.00 0.00 0.00 0.00 178.15 178.30 1n9c s ALA 76 N -4.33 0.95 0.14 1.87 0.00 -1.26 -5.09 121.76 114.04 1n9c s ALA 76 Ca -0.05 -1.04 -0.08 0.00 0.00 0.00 0.00 51.96 50.79 1n9c s ALA 76 Cb 0.14 0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.27 1n9c s ALA 76 CO 0.76 -0.01 0.24 -1.59 0.00 0.00 0.00 175.76 175.16 1n9c s LYS 77 N -2.31 1.06 3.26 0.00 0.00 -1.26 -4.34 119.74 116.15 1n9c s LYS 77 Ca -0.00 -1.16 0.00 0.00 0.00 0.00 0.00 55.97 54.81 1n9c s LYS 77 Cb -0.06 0.35 0.00 0.00 0.00 0.00 0.00 37.83 38.13 1n9c s LYS 77 CO 0.00 -0.37 0.00 0.41 0.00 0.00 0.00 175.35 175.39 1n9c n GLY 78 N -0.17 2.34 0.39 0.59 0.00 -1.26 -1.73 105.19 105.34 1n9c n GLY 78 Ca -0.09 -0.26 0.34 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.51 2.40 0.79 4.61 0.00 -1.99 0.16 119.26 124.72 1n9c h ALA 79 Ca 0.00 0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1n9c h ALA 79 Cb 0.00 0.27 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1n9c h ALA 79 CO 0.00 -1.12 -0.38 1.49 0.00 0.00 0.00 179.25 179.24 1n9c h GLU 80 N 0.06 -1.03 -0.45 0.00 4.81 -1.69 0.11 114.58 116.40 1n9c h GLU 80 Ca 0.84 0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 60.06 1n9c h GLU 80 Cb 2.37 0.23 -0.02 0.00 0.63 0.00 0.00 28.75 31.96 1n9c h GLU 80 CO -0.61 -0.67 -0.05 0.00 -0.73 0.00 0.00 179.01 176.95 1n9c h ALA 81 N -1.04 1.07 0.15 2.92 0.00 -0.76 -0.36 119.26 121.25 1n9c h ALA 81 Ca -0.11 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1n9c h ALA 81 Cb 0.83 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1n9c h ALA 81 CO 0.18 0.58 -0.15 0.93 0.00 0.00 0.00 179.25 180.78 1n9c h GLU 82 N 0.71 -0.32 -0.27 0.00 5.08 -0.88 0.19 114.58 119.09 1n9c h GLU 82 Ca 0.13 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.57 1n9c h GLU 82 Cb 0.50 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.77 1n9c h GLU 82 CO 0.03 -0.21 -0.08 0.00 -1.00 0.00 0.00 179.01 177.74 1n9c h ALA 83 N 0.49 0.16 -0.02 3.43 0.00 -0.45 -1.09 119.26 121.78 1n9c h ALA 83 Ca 0.00 0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1n9c h ALA 83 Cb 0.31 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 1n9c h ALA 83 CO -0.04 -0.48 -0.32 0.28 0.00 0.00 0.00 179.25 178.69 1n9c h VAL 84 N -0.02 0.30 -0.20 0.00 2.07 -0.80 -1.08 116.25 116.52 1n9c h VAL 84 Ca 0.13 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.71 1n9c h VAL 84 Cb 0.22 0.30 -0.07 0.00 -1.52 0.00 0.00 31.29 30.23 1n9c h VAL 84 CO -0.29 0.00 -0.30 0.00 0.02 0.00 0.00 177.57 177.00 1n9c h ALA 85 N 0.28 -0.28 0.60 1.67 0.00 0.23 0.30 119.26 122.07 1n9c h ALA 85 Ca 0.07 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1n9c h ALA 85 Cb 0.55 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1n9c h ALA 85 CO -0.28 -0.75 -0.41 0.00 0.00 0.00 0.00 179.25 177.81 1n9c h ALA 86 N 0.57 -1.01 -0.20 0.00 0.00 -1.13 -0.30 119.26 117.19 1n9c h ALA 86 Ca 0.12 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1n9c h ALA 86 Cb 0.52 0.53 -0.05 0.00 0.00 0.00 0.00 17.79 18.79 1n9c h ALA 86 CO -0.39 -1.09 -0.10 2.35 0.00 0.00 0.00 179.25 180.02 1n9c h TRP 87 N -0.97 -0.23 -0.58 0.00 7.01 -0.85 0.41 115.95 120.74 1n9c h TRP 87 Ca -0.07 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 60.90 1n9c h TRP 87 Cb 0.80 0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 27.97 1n9c h TRP 87 CO -0.13 -0.15 0.19 1.25 -2.79 0.00 0.00 178.44 176.81 1n9c h LEU 88 N -0.08 0.84 -1.11 0.65 6.46 -0.34 0.75 115.31 122.48 1n9c h LEU 88 Ca 0.11 -0.20 0.11 0.00 -0.12 0.00 0.00 57.88 57.78 1n9c h LEU 88 Cb 0.24 -0.22 -0.07 0.00 -0.73 0.00 0.00 40.66 39.87 1n9c h LEU 88 CO -0.25 0.82 0.61 0.00 -0.62 0.00 0.00 178.44 179.00 1n9c h ALA 89 N 1.06 1.59 0.00 1.25 0.00 -0.62 -0.15 119.26 122.39 1n9c h ALA 89 Ca 0.19 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1n9c h ALA 89 Cb 0.27 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1n9c h ALA 89 CO -0.01 0.20 -0.13 1.05 0.00 0.00 0.00 179.25 180.36 1n9c h GLU 90 N 0.94 0.00 0.00 0.00 4.11 0.10 -3.33 114.58 116.41 1n9c h GLU 90 Ca 0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.89 1n9c h GLU 90 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1n9c h GLU 90 CO -0.22 0.13 0.00 1.17 0.07 0.00 0.00 179.01 180.16 1n9c n LYS 91 N -3.23 0.57 0.00 1.06 0.00 0.06 -5.08 118.16 111.53 1n9c n LYS 91 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 58.31 58.45 1n9c n LYS 91 Cb 0.42 -1.01 0.26 0.00 0.00 0.00 0.00 35.03 34.70 1n9c n LYS 91 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76