#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 5.40 0.16 4.52 1.11 -1.26 -4.83 116.67 121.77 1n9c s ASP 23 Ca 0.00 0.05 -0.22 0.00 0.18 0.00 0.00 52.55 52.56 1n9c s ASP 23 Cb 0.00 -2.54 0.06 0.00 1.07 0.00 0.00 42.92 41.51 1n9c s ASP 23 CO 0.00 -2.34 1.62 0.00 1.18 0.00 0.00 175.17 175.63 1n9c h ALA 24 N 13.68 -0.09 -0.67 5.23 0.00 -1.92 0.33 119.26 135.83 1n9c h ALA 24 Ca -0.20 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1n9c h ALA 24 Cb 1.12 0.57 -0.03 0.00 0.00 0.00 0.00 17.79 19.45 1n9c h ALA 24 CO 1.23 -0.66 0.41 1.05 0.00 0.00 0.00 179.25 181.28 1n9c h GLU 25 N -0.22 0.90 -0.44 0.00 4.11 -1.90 -0.65 114.58 116.38 1n9c h GLU 25 Ca 0.17 -0.08 0.08 0.00 0.07 0.00 0.00 59.36 59.60 1n9c h GLU 25 Cb 0.49 -0.19 -0.07 0.00 0.50 0.00 0.00 28.75 29.48 1n9c h GLU 25 CO -0.47 0.64 0.01 0.00 0.07 0.00 0.00 179.01 179.26 1n9c h ALA 26 N 1.21 0.42 0.03 1.06 0.00 -1.40 0.83 119.26 121.41 1n9c h ALA 26 Ca 0.24 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.30 1n9c h ALA 26 Cb -0.04 0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1n9c h ALA 26 CO -0.05 -0.38 -0.42 0.28 0.00 0.00 0.00 179.25 178.68 1n9c h VAL 27 N 0.13 0.15 0.00 0.00 2.07 -0.42 -0.84 116.25 117.33 1n9c h VAL 27 Ca 0.22 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.74 1n9c h VAL 27 Cb 0.31 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1n9c h VAL 27 CO -0.35 0.00 0.00 0.52 0.02 0.00 0.00 177.57 177.76 1n9c n VAL 28 N -5.45 0.03 0.78 2.57 0.31 -0.13 -0.26 118.33 116.18 1n9c n VAL 28 Ca -0.06 0.01 0.12 0.00 -0.01 0.00 0.00 64.34 64.40 1n9c n VAL 28 Cb 0.37 -0.57 0.14 0.00 -0.91 0.00 0.00 33.84 32.87 1n9c n VAL 28 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1n9c n GLN 29 N -1.07 2.39 0.00 5.55 1.13 0.27 -3.28 117.38 122.37 1n9c n GLN 29 Ca 0.19 -2.04 0.00 0.00 -1.94 0.00 0.00 57.00 53.21 1n9c n GLN 29 Cb 0.12 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 28.99 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 1.39 2.01 -0.00 -1.09 7.27 -0.41 -4.81 117.38 121.74 1n9c n GLN 30 Ca 0.16 0.00 0.07 0.00 0.07 0.00 0.00 57.00 57.30 1n9c n GLN 30 Cb 0.60 -0.49 -0.10 0.00 2.41 0.00 0.00 30.24 32.66 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 -0.33 1.36 0.00 3.69 5.02 0.64 -4.68 118.16 123.86 1n9c n LYS 31 Ca 0.00 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1n9c n LYS 31 Cb 0.00 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 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 0.00 0.46 -1.02 0.00 3.07 -1.77 -0.24 117.51 118.02 1n9c h ILE 33 Ca 0.00 -0.02 0.42 0.00 1.55 0.00 0.00 64.86 66.80 1n9c h ILE 33 Cb 0.88 0.39 -0.18 0.00 -0.27 0.00 0.00 36.82 37.65 1n9c h ILE 33 CO 0.00 0.01 0.56 -1.28 -1.05 0.00 0.00 178.15 176.39 1n9c h SER 34 N 0.07 0.32 0.00 2.16 0.87 -1.83 0.18 113.55 115.32 1n9c h SER 34 Ca 0.53 0.25 -0.06 0.00 -1.23 0.00 0.00 61.79 61.29 1n9c h SER 34 Cb 1.99 0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 64.20 1n9c h SER 34 CO -0.06 -0.41 -1.21 0.00 -0.53 0.00 0.00 176.83 174.62 1n9c h HIS 36 N -0.03 0.00 0.00 0.00 3.86 -1.00 0.27 115.15 118.26 1n9c h HIS 36 Ca -0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1n9c h HIS 36 Cb 1.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.59 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 0.28 -0.23 0.39 2.45 0.00 0.63 -0.38 105.19 108.33 1n9c n GLY 37 Ca 0.03 -1.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.36 0.52 -0.02 0.00 -1.95 0.14 103.07 101.39 1n9c h GLY 38 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 47.33 47.91 1n9c h GLY 38 CO 0.00 -0.14 0.00 1.22 0.00 0.00 0.00 176.54 177.62 1n9c n ASP 39 N -5.40 0.44 -1.45 0.19 8.00 -1.26 -4.89 116.55 112.18 1n9c n ASP 39 Ca 0.04 -1.20 -0.16 0.00 0.71 0.00 0.00 54.79 54.18 1n9c n ASP 39 Cb 0.35 -0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.40 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 -0.63 -1.38 -0.02 0.64 4.77 0.50 -4.64 117.00 116.23 1n9c n LEU 40 Ca 0.21 0.23 0.15 0.00 -0.03 0.00 0.00 56.01 56.57 1n9c n LEU 40 Cb 0.17 -2.32 0.72 0.00 -2.33 0.00 0.00 43.42 39.66 1n9c n LEU 40 CO 0.17 -0.57 0.98 0.35 -1.33 0.00 0.00 177.39 176.99 1n9c n THR 41 N -3.12 0.00 -0.25 -5.08 -2.24 -1.22 -0.80 114.28 101.56 1n9c n THR 41 Ca -0.17 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1n9c n THR 41 Cb 0.57 -0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 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 0.53 0.00 3.38 0.00 0.48 -3.92 105.19 106.97 1n9c n GLY 42 Ca 0.13 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.01 0.96 4.61 0.00 -0.51 -4.56 120.51 120.90 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 0.03 0.00 0.24 0.00 0.00 0.00 0.00 19.45 19.72 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 -1.13 2.67 -3.99 0.00 2.88 0.95 -4.93 113.62 110.07 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 -0.07 -0.08 0.00 -0.75 0.00 0.00 64.21 63.31 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 -1.86 0.18 0.94 -1.46 0.00 -1.17 -4.93 121.76 113.46 1n9c s ALA 45 Ca 0.33 -0.98 -0.11 0.00 0.00 0.00 0.00 51.96 51.20 1n9c s ALA 45 Cb 0.21 0.71 0.16 0.00 0.00 0.00 0.00 23.12 24.19 1n9c s ALA 45 CO 0.31 -0.55 1.11 -1.25 0.00 0.00 0.00 175.76 175.38 1n9c s PRO 46 N -3.95 0.85 0.08 0.00 0.04 -1.26 -4.21 135.00 126.55 1n9c s PRO 46 Ca 0.15 1.28 -0.31 0.00 0.04 0.00 0.00 61.00 62.16 1n9c s PRO 46 Cb 0.05 -1.73 -0.09 0.00 0.04 0.00 0.00 34.50 32.78 1n9c s PRO 46 CO -0.03 -2.66 1.70 0.00 0.04 0.00 0.00 177.00 176.05 1n9c s ALA 47 N -2.68 3.70 -0.03 8.56 0.00 -1.25 -4.17 121.76 125.88 1n9c s ALA 47 Ca 0.66 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.89 1n9c s ALA 47 Cb -0.22 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.19 1n9c s ALA 47 CO 0.59 -1.13 0.35 0.44 0.00 0.00 0.00 175.76 176.01 1n9c n ILE 48 N 4.73 0.00 -0.32 0.00 -6.64 0.01 -4.61 119.36 112.53 1n9c n ILE 48 Ca 0.16 -0.50 0.16 0.00 -1.77 0.00 0.00 62.75 60.80 1n9c n ILE 48 Cb 0.40 1.00 0.31 0.00 -1.44 0.00 0.00 39.64 39.91 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 -0.31 -0.06 -0.90 7.28 5.75 -0.17 -0.60 116.55 127.54 1n9c n ASP 49 Ca 0.00 1.58 0.12 0.00 -0.01 0.00 0.00 54.79 56.48 1n9c n ASP 49 Cb 0.01 -0.60 0.25 0.00 -1.03 0.00 0.00 41.12 39.74 1n9c n ASP 49 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1n9c n LYS 50 N -5.35 2.21 0.08 0.11 3.00 -1.26 -4.37 118.16 112.58 1n9c n LYS 50 Ca 0.24 -1.79 0.18 0.00 -0.00 0.00 0.00 58.31 56.94 1n9c n LYS 50 Cb 0.78 -1.47 0.72 0.00 0.00 0.00 0.00 35.03 35.05 1n9c n LYS 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1n9c h ALA 51 N 4.48 2.26 0.00 3.14 0.00 -1.11 0.23 119.26 128.27 1n9c h ALA 51 Ca 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1n9c h ALA 51 Cb 0.84 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1n9c h ALA 51 CO 0.00 -0.50 -0.25 0.78 0.00 0.00 0.00 179.25 179.28 1n9c h GLY 52 N 0.00 0.00 0.77 0.00 0.00 -1.70 0.37 103.07 102.51 1n9c h GLY 52 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.35 1n9c h GLY 52 CO -0.00 0.00 -0.67 0.00 0.00 0.00 0.00 176.54 175.87 1n9c h ALA 53 N 1.75 0.03 -0.05 3.60 0.00 -0.85 -3.39 119.26 120.36 1n9c h ALA 53 Ca -0.00 -0.60 -0.15 0.00 0.00 0.00 0.00 54.91 54.16 1n9c h ALA 53 Cb 0.50 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.35 1n9c h ALA 53 CO 0.03 0.36 -0.55 -0.91 0.00 0.00 0.00 179.25 178.19 1n9c h ASN 54 N -0.16 0.57 -3.08 0.00 2.35 -1.07 -3.47 115.58 110.72 1n9c h ASN 54 Ca -0.09 -0.70 -0.47 0.00 -0.55 0.00 0.00 56.30 54.48 1n9c h ASN 54 Cb 1.41 -0.17 -0.14 0.00 0.05 0.00 0.00 38.32 39.47 1n9c h ASN 54 CO 0.13 1.18 -0.68 -0.31 -1.65 0.00 0.00 177.43 176.10 1n9c s TYR 55 N -3.45 1.87 0.32 1.19 2.02 0.13 -5.09 117.35 114.36 1n9c s TYR 55 Ca -0.13 -0.71 0.06 0.00 -0.37 0.00 0.00 57.07 55.91 1n9c s TYR 55 Cb 0.04 -1.05 -0.01 0.00 -0.40 0.00 0.00 41.96 40.54 1n9c s TYR 55 CO 0.82 0.25 0.47 -1.12 -1.57 0.00 0.00 175.55 174.40 1n9c s SER 56 N -3.41 6.04 0.23 2.29 0.01 -1.26 -4.09 113.70 113.51 1n9c s SER 56 Ca 0.28 -0.08 -0.09 0.00 1.31 0.00 0.00 55.95 57.38 1n9c s SER 56 Cb 0.03 -1.41 0.36 0.00 0.21 0.00 0.00 66.02 65.21 1n9c s SER 56 CO 0.11 -0.37 1.65 1.05 0.41 0.00 0.00 173.24 176.08 1n9c h GLU 57 N 0.91 0.10 -0.65 12.44 9.09 -1.92 -0.08 114.58 134.47 1n9c h GLU 57 Ca -0.47 -0.01 0.14 0.00 0.05 0.00 0.00 59.36 59.07 1n9c h GLU 57 Cb 1.25 -0.02 -0.11 0.00 -1.65 0.00 0.00 28.75 28.21 1n9c h GLU 57 CO 0.55 0.07 -0.04 1.05 0.05 0.00 0.00 179.01 180.69 1n9c h GLU 58 N 0.11 0.08 0.19 1.06 4.11 -1.95 0.23 114.58 118.41 1n9c h GLU 58 Ca 0.36 -0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.78 1n9c h GLU 58 Cb 0.61 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1n9c h GLU 58 CO -0.60 0.05 -0.09 0.93 0.07 0.00 0.00 179.01 179.37 1n9c h GLU 59 N 0.08 -0.25 -0.29 1.06 5.08 -1.44 -0.78 114.58 118.04 1n9c h GLU 59 Ca 0.34 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1n9c h GLU 59 Cb 0.55 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1n9c h GLU 59 CO -0.59 0.06 0.19 0.82 -1.00 0.00 0.00 179.01 178.49 1n9c h ILE 60 N -0.56 1.07 -0.33 3.13 2.04 -0.85 0.46 117.51 122.47 1n9c h ILE 60 Ca -0.03 -0.13 0.06 0.00 1.00 0.00 0.00 64.86 65.76 1n9c h ILE 60 Cb 0.42 0.64 -0.08 0.00 -0.74 0.00 0.00 36.82 37.06 1n9c h ILE 60 CO 0.04 0.07 -0.40 0.25 0.00 0.00 0.00 178.15 178.11 1n9c h LEU 61 N 0.39 -1.31 -0.28 1.44 5.85 -0.56 0.65 115.31 121.50 1n9c h LEU 61 Ca 0.11 0.20 0.06 0.00 0.84 0.00 0.00 57.88 59.08 1n9c h LEU 61 Cb -0.04 0.57 -0.05 0.00 0.37 0.00 0.00 40.66 41.51 1n9c h LEU 61 CO -0.03 -0.37 -0.07 -0.78 -0.34 0.00 0.00 178.44 176.85 1n9c h ASP 62 N -0.35 -0.26 -0.64 1.25 3.58 -0.20 -0.12 116.42 119.67 1n9c h ASP 62 Ca 0.13 0.08 0.05 0.00 0.42 0.00 0.00 57.03 57.71 1n9c h ASP 62 Cb 0.58 0.17 -0.05 0.00 1.72 0.00 0.00 39.33 41.76 1n9c h ASP 62 CO -0.52 -0.09 0.36 0.40 -2.88 0.00 0.00 179.24 176.51 1n9c h ILE 63 N -0.00 1.00 -0.32 2.25 5.03 -0.12 0.23 117.51 125.58 1n9c h ILE 63 Ca 0.13 -0.24 -0.02 0.00 -0.12 0.00 0.00 64.86 64.62 1n9c h ILE 63 Cb 0.21 0.25 -0.01 0.00 -3.03 0.00 0.00 36.82 34.23 1n9c h ILE 63 CO -0.29 0.13 0.12 0.40 -0.68 0.00 0.00 178.15 177.83 1n9c h ILE 64 N 0.69 1.19 -0.37 -0.67 2.04 -0.03 0.45 117.51 120.79 1n9c h ILE 64 Ca 0.28 -0.58 -0.11 0.00 1.00 0.00 0.00 64.86 65.45 1n9c h ILE 64 Cb 0.13 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 1n9c h ILE 64 CO -0.16 0.20 -0.23 -0.07 0.00 0.00 0.00 178.15 177.89 1n9c h LEU 65 N 0.36 0.76 0.06 1.44 3.38 -0.32 -0.77 115.31 120.22 1n9c h LEU 65 Ca 0.10 -0.27 -0.35 0.00 0.09 0.00 0.00 57.88 57.45 1n9c h LEU 65 Cb 0.20 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1n9c h LEU 65 CO -0.01 0.97 -2.08 0.59 0.09 0.00 0.00 178.44 178.00 1n9c n ASN 66 N -4.11 1.58 0.00 -0.43 3.02 0.75 -2.24 115.26 113.83 1n9c n ASN 66 Ca 0.00 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.71 1n9c n ASN 66 Cb 0.43 -0.39 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 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 1.93 -3.68 3.18 7.41 0.00 0.16 -4.05 105.19 110.13 1n9c n GLY 67 Ca -0.32 -2.13 -0.11 0.00 0.00 0.00 0.00 46.02 43.46 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 -0.87 0.97 0.00 1.61 2.00 -0.63 -4.52 119.66 118.21 1n9c s GLN 68 Ca 0.00 -1.45 -0.00 0.00 -2.00 0.00 0.00 55.36 51.90 1n9c s GLN 68 Cb 0.00 0.02 -0.00 0.00 0.80 0.00 0.00 33.01 33.83 1n9c s GLN 68 CO 0.00 -0.19 0.54 0.41 -0.50 0.00 0.00 175.29 175.56 1n9c n GLY 69 N -0.13 -1.69 1.81 2.59 0.00 -1.26 -0.11 105.19 106.40 1n9c n GLY 69 Ca -0.07 0.32 -0.16 0.00 0.00 0.00 0.00 46.02 46.11 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 -1.00 3.74 2.69 -0.02 0.00 -1.26 -4.87 105.19 104.47 1n9c n GLY 70 Ca 0.00 -0.81 -0.20 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.13 -0.01 0.79 1.61 0.00 0.84 -5.09 119.30 115.31 1n9c s MET 71 Ca 0.37 0.33 -0.12 0.00 0.00 0.00 0.00 55.69 56.27 1n9c s MET 71 Cb 0.30 -0.52 0.07 0.00 0.00 0.00 0.00 34.83 34.68 1n9c s MET 71 CO 0.06 -0.31 1.14 -1.25 0.00 0.00 0.00 175.02 174.66 1n9c s PRO 72 N 2.03 1.95 0.08 4.11 0.04 -1.26 -1.60 135.00 140.34 1n9c s PRO 72 Ca 0.03 1.45 0.07 0.00 0.04 0.00 0.00 61.00 62.59 1n9c s PRO 72 Cb -0.12 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 1n9c s PRO 72 CO -0.03 -1.92 -0.12 0.20 0.04 0.00 0.00 177.00 175.17 1n9c s GLY 73 N -2.74 1.73 0.00 0.56 0.00 -1.26 -4.25 107.32 101.36 1n9c s GLY 73 Ca 0.67 -1.22 0.00 0.00 0.00 0.00 0.00 44.72 44.16 1n9c s GLY 73 CO 0.52 -1.17 0.00 0.61 0.00 0.00 0.00 173.10 173.06 1n9c n GLY 74 N 0.99 0.56 0.33 0.20 0.00 -0.30 -4.79 105.19 102.18 1n9c n GLY 74 Ca -0.15 -0.53 0.10 0.00 0.00 0.00 0.00 46.02 45.44 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 0.71 -4.13 -0.61 2.04 -1.80 -3.39 117.51 110.34 1n9c h ILE 75 Ca 0.00 -0.24 -0.48 0.00 1.00 0.00 0.00 64.86 65.14 1n9c h ILE 75 Cb 0.00 -0.05 -0.27 0.00 -0.74 0.00 0.00 36.82 35.77 1n9c h ILE 75 CO 0.00 0.13 -0.81 0.00 0.00 0.00 0.00 178.15 177.47 1n9c s ALA 76 N -5.91 1.26 0.05 1.87 0.00 -1.26 -5.04 121.76 112.72 1n9c s ALA 76 Ca -0.12 -0.77 -0.02 0.00 0.00 0.00 0.00 51.96 51.06 1n9c s ALA 76 Cb 0.23 -0.25 -0.03 0.00 0.00 0.00 0.00 23.12 23.07 1n9c s ALA 76 CO 0.79 0.27 -0.01 0.15 0.00 0.00 0.00 175.76 176.97 1n9c s LYS 77 N -0.81 0.59 3.69 0.00 -0.14 -1.26 -4.27 119.74 117.55 1n9c s LYS 77 Ca 0.04 -1.12 0.00 0.00 -1.36 0.00 0.00 55.97 53.53 1n9c s LYS 77 Cb -0.07 0.21 0.00 0.00 -1.68 0.00 0.00 37.83 36.29 1n9c s LYS 77 CO 0.01 -0.12 0.00 0.41 -0.76 0.00 0.00 175.35 174.89 1n9c n GLY 78 N 0.28 2.36 0.43 -3.33 0.00 -1.26 -2.23 105.19 101.44 1n9c n GLY 78 Ca -0.15 -0.31 0.34 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.60 2.52 0.88 4.61 0.00 -1.99 0.21 119.26 124.90 1n9c h ALA 79 Ca 0.00 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1n9c h ALA 79 Cb 0.00 0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.00 1n9c h ALA 79 CO 0.00 -1.16 -0.44 1.49 0.00 0.00 0.00 179.25 179.13 1n9c h GLU 80 N 0.13 -1.16 -0.48 0.00 4.81 -1.81 0.14 114.58 116.20 1n9c h GLU 80 Ca 0.80 0.08 -0.11 0.00 -0.13 0.00 0.00 59.36 60.00 1n9c h GLU 80 Cb 2.35 0.26 -0.02 0.00 0.63 0.00 0.00 28.75 31.97 1n9c h GLU 80 CO -0.48 -0.78 -0.13 0.00 -0.73 0.00 0.00 179.01 176.89 1n9c h ALA 81 N -1.10 0.87 0.23 2.92 0.00 -0.72 -1.03 119.26 120.42 1n9c h ALA 81 Ca -0.12 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1n9c h ALA 81 Cb 0.94 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1n9c h ALA 81 CO 0.18 0.64 -0.14 0.93 0.00 0.00 0.00 179.25 180.87 1n9c h GLU 82 N 0.80 -0.34 -0.13 0.00 5.08 -0.94 0.16 114.58 119.21 1n9c h GLU 82 Ca 0.12 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.54 1n9c h GLU 82 Cb 0.66 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.95 1n9c h GLU 82 CO 0.05 -0.23 -0.09 0.00 -1.00 0.00 0.00 179.01 177.74 1n9c h ALA 83 N 0.41 0.02 -0.10 3.43 0.00 -0.59 -0.61 119.26 121.82 1n9c h ALA 83 Ca -0.02 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1n9c h ALA 83 Cb 0.29 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1n9c h ALA 83 CO 0.03 -0.54 -0.37 0.28 0.00 0.00 0.00 179.25 178.65 1n9c h VAL 84 N -0.09 0.00 -0.43 0.00 2.07 -1.01 -1.03 116.25 115.76 1n9c h VAL 84 Ca 0.08 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.69 1n9c h VAL 84 Cb 0.21 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.90 1n9c h VAL 84 CO -0.19 0.00 -0.15 0.00 0.02 0.00 0.00 177.57 177.25 1n9c h ALA 85 N -0.65 0.21 0.38 1.67 0.00 -0.12 0.40 119.26 121.15 1n9c h ALA 85 Ca 0.02 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1n9c h ALA 85 Cb 0.46 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1n9c h ALA 85 CO -0.30 -0.50 -0.27 0.00 0.00 0.00 0.00 179.25 178.18 1n9c h ALA 86 N 1.32 -0.64 -0.89 0.00 0.00 -1.03 0.14 119.26 118.16 1n9c h ALA 86 Ca 0.21 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.06 1n9c h ALA 86 Cb 0.38 0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.47 1n9c h ALA 86 CO -0.48 -0.88 0.58 2.35 0.00 0.00 0.00 179.25 180.82 1n9c h TRP 87 N -0.65 1.03 -0.10 0.00 7.01 -0.28 0.12 115.95 123.08 1n9c h TRP 87 Ca -0.04 0.03 -0.10 0.00 2.11 0.00 0.00 58.89 60.89 1n9c h TRP 87 Cb 0.55 -0.34 0.00 0.00 -2.10 0.00 0.00 29.16 27.27 1n9c h TRP 87 CO -0.12 0.55 -0.31 1.25 -2.79 0.00 0.00 178.44 177.02 1n9c h LEU 88 N 1.03 0.45 -1.70 0.65 7.12 -0.01 -1.65 115.31 121.21 1n9c h LEU 88 Ca 0.38 -0.60 0.08 0.00 0.13 0.00 0.00 57.88 57.86 1n9c h LEU 88 Cb 0.16 -0.13 -0.03 0.00 -0.53 0.00 0.00 40.66 40.13 1n9c h LEU 88 CO -0.13 0.98 0.35 0.00 -0.13 0.00 0.00 178.44 179.50 1n9c h ALA 89 N 0.49 2.01 0.00 1.25 0.00 -0.35 0.13 119.26 122.80 1n9c h ALA 89 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1n9c h ALA 89 Cb 0.93 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1n9c h ALA 89 CO 0.07 -0.12 -0.12 1.49 0.00 0.00 0.00 179.25 180.57 1n9c h GLU 90 N 0.36 0.00 0.00 0.00 4.22 -0.45 -3.40 114.58 115.31 1n9c h GLU 90 Ca 0.23 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.67 1n9c h GLU 90 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1n9c h GLU 90 CO -0.06 0.12 0.00 1.17 -2.18 0.00 0.00 179.01 178.06 1n9c n LYS 91 N -3.21 0.35 0.00 1.92 3.00 0.47 -5.06 118.16 115.62 1n9c n LYS 91 Ca 0.01 0.00 0.03 0.00 -0.00 0.00 0.00 58.31 58.35 1n9c n LYS 91 Cb 0.42 -1.06 0.02 0.00 0.00 0.00 0.00 35.03 34.41 1n9c n LYS 91 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76