#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x93 n ARG 32 N 0.00 2.92 -1.94 1.09 3.00 -1.26 -4.96 116.66 115.51 1x93 n ARG 32 Ca 0.00 -2.84 -0.42 0.00 -0.01 0.00 0.00 57.85 54.57 1x93 n ARG 32 Cb 0.00 -3.37 -0.03 0.00 0.00 0.00 0.00 32.46 29.06 1x93 n ARG 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1x93 s ALA 33 N 3.84 3.66 -0.29 7.54 0.00 -1.26 -5.01 121.76 130.23 1x93 s ALA 33 Ca 0.51 1.14 -0.03 0.00 0.00 0.00 0.00 51.96 53.57 1x93 s ALA 33 Cb 0.10 -3.71 0.10 0.00 0.00 0.00 0.00 23.12 19.60 1x93 s ALA 33 CO -0.01 -1.19 0.13 0.08 0.00 0.00 0.00 175.76 174.76 1x93 s VAL 34 N 3.07 0.07 -0.30 0.00 1.01 -1.26 -5.11 120.40 117.88 1x93 s VAL 34 Ca 0.74 -0.87 -0.06 0.00 0.00 0.00 0.00 61.98 61.79 1x93 s VAL 34 Cb -0.38 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 34.93 1x93 s VAL 34 CO 0.32 -0.73 0.08 -0.55 0.00 0.00 0.00 175.10 174.22 1x93 s SER 35 N 2.02 5.11 0.44 3.32 0.15 -1.26 -5.11 113.70 118.37 1x93 s SER 35 Ca 0.09 -0.77 0.06 0.00 0.70 0.00 0.00 55.95 56.03 1x93 s SER 35 Cb -0.16 -1.87 -0.04 0.00 -1.71 0.00 0.00 66.02 62.24 1x93 s SER 35 CO -0.35 -0.21 0.17 -0.76 1.20 0.00 0.00 173.24 173.29 1x93 s LEU 36 N 1.48 2.94 -0.57 3.45 2.01 -1.26 -5.11 118.68 121.62 1x93 s LEU 36 Ca 0.02 -1.20 0.06 0.00 0.01 0.00 0.00 54.13 53.01 1x93 s LEU 36 Cb -0.17 -1.26 0.21 0.00 0.01 0.00 0.00 46.19 44.97 1x93 s LEU 36 CO 0.02 -0.64 0.54 -1.22 1.01 0.00 0.00 176.35 176.06 1x93 n TYR 37 N -1.28 1.85 -1.40 0.29 4.01 -1.26 -5.10 117.16 114.28 1x93 n TYR 37 Ca -0.04 -3.92 -0.30 0.00 -0.16 0.00 0.00 57.90 53.48 1x93 n TYR 37 Cb 0.65 -0.37 0.21 0.00 -0.31 0.00 0.00 39.34 39.52 1x93 n TYR 37 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1x93 s PHE 38 N -1.40 1.00 0.29 -0.72 0.40 -1.26 -5.12 117.98 111.16 1x93 s PHE 38 Ca 0.33 0.46 0.02 0.00 -0.60 0.00 0.00 56.93 57.14 1x93 s PHE 38 Cb 0.07 -3.68 -0.06 0.00 0.51 0.00 0.00 43.02 39.87 1x93 s PHE 38 CO -0.12 -3.37 0.08 0.45 0.70 0.00 0.00 175.22 172.97 1x93 s SER 39 N -4.24 1.77 0.16 1.36 0.15 -1.26 -5.00 113.70 106.64 1x93 s SER 39 Ca 0.71 -1.40 -0.22 0.00 0.70 0.00 0.00 55.95 55.75 1x93 s SER 39 Cb -0.08 0.07 0.06 0.00 -1.71 0.00 0.00 66.02 64.36 1x93 s SER 39 CO 0.55 -0.69 1.61 0.44 1.20 0.00 0.00 173.24 176.35 1x93 h ASP 40 N 2.24 -0.92 -0.20 5.45 3.32 -2.00 -0.15 116.42 124.15 1x93 h ASP 40 Ca -0.39 0.17 0.03 0.00 0.02 0.00 0.00 57.03 56.86 1x93 h ASP 40 Cb 1.25 0.44 -0.03 0.00 0.22 0.00 0.00 39.33 41.21 1x93 h ASP 40 CO 0.64 -0.30 0.02 -0.33 -1.72 0.00 0.00 179.24 177.55 1x93 h GLU 41 N -0.23 0.09 -0.48 3.56 4.39 -1.98 0.14 114.58 120.07 1x93 h GLU 41 Ca 0.17 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.89 1x93 h GLU 41 Cb 0.50 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.10 1x93 h GLU 41 CO -0.49 0.06 0.26 1.96 -1.16 0.00 0.00 179.01 179.64 1x93 h GLN 42 N 0.09 0.50 -0.26 2.33 1.08 -1.84 -1.63 115.11 115.38 1x93 h GLN 42 Ca 0.09 -0.03 -0.08 0.00 -1.45 0.00 0.00 58.65 57.18 1x93 h GLN 42 Cb 0.10 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1x93 h GLN 42 CO -0.14 0.33 -0.15 -0.92 -0.95 0.00 0.00 178.83 177.00 1x93 h TYR 43 N 0.52 0.65 -0.56 2.96 3.20 -0.64 -2.70 116.97 120.40 1x93 h TYR 43 Ca 0.20 -0.17 -0.04 0.00 3.14 0.00 0.00 58.73 61.86 1x93 h TYR 43 Cb 0.07 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.17 1x93 h TYR 43 CO -0.08 0.83 0.18 1.96 -1.64 0.00 0.00 178.16 179.40 1x93 h GLN 44 N 0.28 0.83 -0.15 1.82 7.50 -0.68 0.50 115.11 125.21 1x93 h GLN 44 Ca 0.05 -0.15 0.03 0.00 0.50 0.00 0.00 58.65 59.09 1x93 h GLN 44 Cb 0.67 -0.14 -0.03 0.00 0.05 0.00 0.00 27.48 28.04 1x93 h GLN 44 CO 0.04 0.71 -0.05 -0.22 -1.50 0.00 0.00 178.83 177.82 1x93 h LYS 45 N 0.81 -0.01 -0.76 1.46 1.63 -1.24 -0.19 116.57 118.27 1x93 h LYS 45 Ca 0.19 0.00 0.01 0.00 -0.85 0.00 0.00 60.65 59.99 1x93 h LYS 45 Cb 0.23 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 31.82 1x93 h LYS 45 CO -0.01 -0.01 0.50 -0.07 -3.45 0.00 0.00 179.45 176.41 1x93 h LEU 46 N -0.01 0.87 -0.92 5.20 -0.00 -1.03 -0.66 115.31 118.76 1x93 h LEU 46 Ca 0.08 -0.03 -0.05 0.00 -0.00 0.00 0.00 57.88 57.88 1x93 h LEU 46 Cb 0.13 -0.22 -0.03 0.00 -0.00 0.00 0.00 40.66 40.54 1x93 h LEU 46 CO -0.17 0.64 0.20 -0.08 -0.00 0.00 0.00 178.44 179.03 1x93 h GLU 47 N 1.03 0.99 -0.68 1.13 4.81 -0.78 0.31 114.58 121.39 1x93 h GLU 47 Ca 0.28 -0.20 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 1x93 h GLU 47 Cb -0.12 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.09 1x93 h GLU 47 CO -0.06 0.85 0.14 -0.22 -0.73 0.00 0.00 179.01 178.99 1x93 h LYS 48 N 0.96 1.12 -0.43 1.92 3.11 -0.46 -3.05 116.57 119.74 1x93 h LYS 48 Ca 0.21 -0.29 -0.12 0.00 -2.81 0.00 0.00 60.65 57.65 1x93 h LYS 48 Cb 0.27 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.35 1x93 h LYS 48 CO -0.01 1.01 -0.20 0.52 -2.81 0.00 0.00 179.45 177.96 1x93 h MET 49 N 1.05 0.89 -0.61 1.90 2.86 -0.95 -3.28 114.93 116.78 1x93 h MET 49 Ca 0.21 -0.38 0.11 0.00 -2.06 0.00 0.00 59.70 57.58 1x93 h MET 49 Cb 0.41 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 1x93 h MET 49 CO 0.01 1.03 0.41 0.00 1.06 0.00 0.00 176.91 179.42 1x93 h ALA 50 N 0.83 2.08 0.00 6.32 0.00 -0.82 -0.77 119.26 126.90 1x93 h ALA 50 Ca 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1x93 h ALA 50 Cb 0.76 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1x93 h ALA 50 CO 0.06 -0.23 -0.07 -0.97 0.00 0.00 0.00 179.25 178.04 1x93 h ASN 51 N 0.36 0.00 1.00 0.00 -0.73 -1.62 0.42 115.58 115.02 1x93 h ASN 51 Ca 0.29 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.46 1x93 h ASN 51 Cb 0.64 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.23 1x93 h ASN 51 CO -0.08 0.07 0.00 1.21 -0.37 0.00 0.00 177.43 178.26 1x93 n GLU 52 N -3.43 0.18 -0.03 6.67 0.00 -0.30 -2.72 120.64 121.01 1x93 n GLU 52 Ca -0.02 0.29 0.02 0.00 0.00 0.00 0.00 57.16 57.45 1x93 n GLU 52 Cb 0.21 -1.77 0.04 0.00 0.00 0.00 0.00 31.44 29.92 1x93 n GLU 52 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1x93 n GLU 53 N -2.09 1.20 -2.63 5.31 2.13 -0.61 -5.04 120.64 118.91 1x93 n GLU 53 Ca 0.04 -1.20 -0.08 0.00 0.66 0.00 0.00 57.16 56.58 1x93 n GLU 53 Cb 0.31 -1.09 0.04 0.00 0.27 0.00 0.00 31.44 30.97 1x93 n GLU 53 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1x93 n GLU 54 N 0.05 -1.35 -2.17 5.31 2.13 -0.16 -4.81 120.64 119.65 1x93 n GLU 54 Ca 0.03 0.72 -0.03 0.00 0.66 0.00 0.00 57.16 58.54 1x93 n GLU 54 Cb 0.20 -4.37 -0.02 0.00 0.27 0.00 0.00 31.44 27.52 1x93 n GLU 54 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1x93 n GLU 55 N -2.38 -2.67 -1.16 5.31 -0.58 -0.04 -4.96 120.64 114.15 1x93 n GLU 55 Ca -0.04 2.22 -0.04 0.00 -0.42 0.00 0.00 57.16 58.89 1x93 n GLU 55 Cb 0.56 -3.49 -0.04 0.00 -0.57 0.00 0.00 31.44 27.90 1x93 n GLU 55 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1x93 n SER 56 N 0.92 -0.44 -4.68 1.62 3.41 -1.26 -5.03 113.62 108.16 1x93 n SER 56 Ca -0.22 -2.00 -0.45 0.00 -0.26 0.00 0.00 58.87 55.95 1x93 n SER 56 Cb 0.33 0.13 -0.04 0.00 -0.26 0.00 0.00 64.21 64.38 1x93 n SER 56 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1x93 n VAL 57 N 0.12 0.35 0.00 -3.33 0.31 -1.26 -0.98 118.33 113.54 1x93 n VAL 57 Ca -0.18 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1x93 n VAL 57 Cb 0.83 -1.94 0.00 0.00 -0.91 0.00 0.00 33.84 31.81 1x93 n VAL 57 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1x93 n GLY 58 N 4.11 2.51 0.28 2.92 0.00 -1.26 -4.72 105.19 109.03 1x93 n GLY 58 Ca 0.19 -0.58 -0.00 0.00 0.00 0.00 0.00 46.02 45.63 1x93 n GLY 58 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1x93 h SER 59 N 0.00 0.52 -0.94 1.61 0.02 -1.77 -2.20 113.55 110.80 1x93 h SER 59 Ca 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1x93 h SER 59 Cb 0.00 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.36 1x93 h SER 59 CO 0.00 0.56 0.60 0.22 -1.14 0.00 0.00 176.83 177.07 1x93 h TYR 60 N 0.55 1.20 0.03 3.45 5.03 -1.34 0.13 116.97 126.02 1x93 h TYR 60 Ca 0.12 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.48 1x93 h TYR 60 Cb 0.28 -0.40 -0.05 0.00 1.55 0.00 0.00 36.73 38.11 1x93 h TYR 60 CO 0.01 0.77 -0.31 0.82 -1.32 0.00 0.00 178.16 178.13 1x93 h ILE 61 N 1.28 0.32 0.34 1.81 2.04 -1.71 -1.31 117.51 120.28 1x93 h ILE 61 Ca 0.34 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.19 1x93 h ILE 61 Cb -0.12 0.32 -0.00 0.00 -0.74 0.00 0.00 36.82 36.28 1x93 h ILE 61 CO -0.07 0.00 -0.20 0.50 0.00 0.00 0.00 178.15 178.38 1x93 h LYS 62 N -0.49 -0.50 -1.00 2.37 3.64 -0.88 -2.32 116.57 117.39 1x93 h LYS 62 Ca 0.05 0.03 0.22 0.00 -1.27 0.00 0.00 60.65 59.68 1x93 h LYS 62 Cb 0.56 0.11 -0.11 0.00 -0.41 0.00 0.00 32.23 32.38 1x93 h LYS 62 CO -0.24 -0.33 0.61 -0.09 -2.27 0.00 0.00 179.45 177.13 1x93 h ARG 63 N -0.52 0.63 -0.41 1.90 9.65 -0.91 -0.87 114.38 123.86 1x93 h ARG 63 Ca -0.04 -0.04 -0.12 0.00 -1.10 0.00 0.00 59.98 58.69 1x93 h ARG 63 Cb 0.42 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.85 1x93 h ARG 63 CO 0.04 0.42 -0.21 -0.92 2.80 0.00 0.00 179.97 182.10 1x93 h TYR 64 N 0.65 0.91 -0.68 2.20 5.03 -0.69 0.35 116.97 124.73 1x93 h TYR 64 Ca 0.60 -0.20 -0.05 0.00 2.58 0.00 0.00 58.73 61.66 1x93 h TYR 64 Cb 1.09 -0.22 -0.03 0.00 1.55 0.00 0.00 36.73 39.12 1x93 h TYR 64 CO -0.00 0.94 0.24 0.82 -1.32 0.00 0.00 178.16 178.84 1x93 h ILE 65 N 0.70 1.25 -0.32 1.81 2.04 -0.86 -0.25 117.51 121.88 1x93 h ILE 65 Ca 0.10 -0.82 -0.16 0.00 1.00 0.00 0.00 64.86 64.98 1x93 h ILE 65 Cb 0.73 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1x93 h ILE 65 CO 0.06 0.32 -0.43 -0.07 0.00 0.00 0.00 178.15 178.03 1x93 h LEU 66 N 0.99 0.87 -0.15 1.44 3.38 -0.96 -1.33 115.31 119.54 1x93 h LEU 66 Ca 0.22 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 1x93 h LEU 66 Cb 0.25 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1x93 h LEU 66 CO -0.01 1.17 0.08 0.50 0.09 0.00 0.00 178.44 180.27 1x93 h LYS 67 N 0.65 0.22 0.00 1.13 3.64 -0.81 -2.96 116.57 118.44 1x93 h LYS 67 Ca 0.04 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.33 1x93 h LYS 67 Cb 1.00 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.77 1x93 h LYS 67 CO 0.10 0.23 -0.31 0.00 -2.27 0.00 0.00 179.45 177.20 1x93 h ALA 68 N 0.97 1.32 0.00 5.00 0.00 -0.95 -3.07 119.26 122.54 1x93 h ALA 68 Ca 0.05 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1x93 h ALA 68 Cb 0.08 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1x93 h ALA 68 CO -0.01 0.39 -0.06 1.25 0.00 0.00 0.00 179.25 180.82 1x93 h LEU 69 N 0.00 0.00 -0.87 0.00 5.85 -1.06 -2.17 115.31 117.05 1x93 h LEU 69 Ca -0.00 0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.79 1x93 h LEU 69 Cb 0.61 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.57 1x93 h LEU 69 CO 0.04 0.06 0.54 0.03 -0.34 0.00 0.00 178.44 178.77 1x93 h ARG 70 N 0.00 0.92 -2.21 1.25 3.08 -1.58 -3.32 114.38 112.52 1x93 h ARG 70 Ca -0.00 -0.06 -0.55 0.00 0.07 0.00 0.00 59.98 59.44 1x93 h ARG 70 Cb 0.15 -0.21 -0.36 0.00 0.08 0.00 0.00 29.97 29.63 1x93 h ARG 70 CO 0.01 0.61 -0.95 1.63 -1.07 0.00 0.00 179.97 180.19 1x93 n LYS 71 N -4.64 0.26 -0.34 0.04 4.01 -1.02 -5.01 118.16 111.47 1x93 n LYS 71 Ca 0.13 -3.08 0.11 0.00 -0.51 0.00 0.00 58.31 54.97 1x93 n LYS 71 Cb 0.21 -1.61 0.30 0.00 -0.51 0.00 0.00 35.03 33.42 1x93 n LYS 71 CO 0.00 0.00 0.00 0.82 -1.11 0.00 0.00 177.40 177.11 1x93 h ILE 72 N 4.40 0.71 0.00 -0.18 2.04 -1.52 -3.48 117.51 119.49 1x93 h ILE 72 Ca 0.23 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1x93 h ILE 72 Cb 0.92 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 1x93 h ILE 72 CO 0.35 0.13 0.00 1.21 0.00 0.00 0.00 178.15 179.85