#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x93 s ARG 32 N 0.00 1.31 0.11 -2.82 1.81 -1.26 -5.11 118.95 113.00 1x93 s ARG 32 Ca 0.00 -1.66 -0.31 0.00 -1.72 0.00 0.00 55.73 52.04 1x93 s ARG 32 Cb 0.00 -2.90 -0.10 0.00 -0.45 0.00 0.00 34.95 31.50 1x93 s ARG 32 CO 0.00 -0.94 1.75 0.00 -0.68 0.00 0.00 175.30 175.43 1x93 s ALA 33 N 1.09 3.75 -0.18 2.13 0.00 -1.26 -5.00 121.76 122.28 1x93 s ALA 33 Ca 0.10 1.37 -0.05 0.00 0.00 0.00 0.00 51.96 53.39 1x93 s ALA 33 Cb -0.19 -3.73 0.09 0.00 0.00 0.00 0.00 23.12 19.30 1x93 s ALA 33 CO -0.12 -1.14 0.32 0.08 0.00 0.00 0.00 175.76 174.90 1x93 s VAL 34 N 2.52 -0.51 0.01 0.00 1.01 -1.26 -5.16 120.40 117.02 1x93 s VAL 34 Ca 0.78 0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.91 1x93 s VAL 34 Cb -0.44 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.31 1x93 s VAL 34 CO 0.34 0.01 -0.10 -0.55 0.00 0.00 0.00 175.10 174.80 1x93 s SER 35 N 2.49 1.17 0.33 3.32 0.15 -1.26 -5.15 113.70 114.75 1x93 s SER 35 Ca 0.04 -0.31 0.01 0.00 0.70 0.00 0.00 55.95 56.39 1x93 s SER 35 Cb -0.13 -0.09 -0.00 0.00 -1.71 0.00 0.00 66.02 64.09 1x93 s SER 35 CO -0.12 0.03 0.42 0.00 1.20 0.00 0.00 173.24 174.78 1x93 n LEU 36 N 2.36 0.00 -3.56 3.45 -0.00 -1.26 -5.16 117.00 112.83 1x93 n LEU 36 Ca -0.16 -2.82 -0.29 0.00 -0.00 0.00 0.00 56.01 52.74 1x93 n LEU 36 Cb 0.56 2.23 -0.14 0.00 -0.00 0.00 0.00 43.42 46.08 1x93 n LEU 36 CO 0.24 -0.60 -0.32 -0.31 -0.00 0.00 0.00 177.39 176.40 1x93 s TYR 37 N -3.07 0.86 0.00 1.47 2.02 -1.26 -5.14 117.35 112.24 1x93 s TYR 37 Ca 0.31 -1.46 0.00 0.00 -0.37 0.00 0.00 57.07 55.55 1x93 s TYR 37 Cb -0.00 -1.14 0.00 0.00 -0.40 0.00 0.00 41.96 40.42 1x93 s TYR 37 CO 0.22 -0.83 0.00 1.19 -1.57 0.00 0.00 175.55 174.56 1x93 n PHE 38 N 4.54 -2.21 -4.11 2.71 3.01 -1.26 -5.13 117.46 115.02 1x93 n PHE 38 Ca 0.03 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.41 1x93 n PHE 38 Cb 0.39 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.76 1x93 n PHE 38 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1x93 s SER 39 N -1.43 0.54 0.18 4.37 0.01 -1.26 -5.04 113.70 111.07 1x93 s SER 39 Ca 0.00 -1.03 -0.17 0.00 1.31 0.00 0.00 55.95 56.06 1x93 s SER 39 Cb 0.00 0.20 0.14 0.00 0.21 0.00 0.00 66.02 66.57 1x93 s SER 39 CO 0.00 -0.60 1.64 0.44 0.41 0.00 0.00 173.24 175.12 1x93 h ASP 40 N 3.09 -0.60 -0.14 2.44 3.32 -2.00 -0.43 116.42 122.10 1x93 h ASP 40 Ca -0.34 0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.87 1x93 h ASP 40 Cb 1.15 0.36 -0.01 0.00 0.22 0.00 0.00 39.33 41.05 1x93 h ASP 40 CO 0.65 -0.21 0.08 -0.33 -1.72 0.00 0.00 179.24 177.71 1x93 h GLU 41 N -0.06 0.16 -0.75 3.56 4.39 -1.98 0.87 114.58 120.77 1x93 h GLU 41 Ca 0.23 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.87 1x93 h GLU 41 Cb 0.42 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 1x93 h GLU 41 CO -0.53 0.11 0.27 1.96 -1.16 0.00 0.00 179.01 179.66 1x93 h GLN 42 N 0.17 1.14 -0.03 2.33 7.50 -1.82 -1.46 115.11 122.93 1x93 h GLN 42 Ca 0.05 -0.22 -0.01 0.00 0.50 0.00 0.00 58.65 58.97 1x93 h GLN 42 Cb -0.01 -0.18 -0.00 0.00 0.05 0.00 0.00 27.48 27.34 1x93 h GLN 42 CO -0.02 0.95 -0.02 -0.92 -1.50 0.00 0.00 178.83 177.31 1x93 h TYR 43 N 1.11 0.09 -0.49 2.96 3.20 -0.89 -3.18 116.97 119.78 1x93 h TYR 43 Ca 0.25 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 1x93 h TYR 43 Cb 0.26 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.48 1x93 h TYR 43 CO 0.02 0.50 0.25 1.96 -1.64 0.00 0.00 178.16 179.25 1x93 h GLN 44 N -0.35 0.67 -0.81 1.82 7.50 -0.73 0.14 115.11 123.36 1x93 h GLN 44 Ca 0.01 -0.07 -0.02 0.00 0.50 0.00 0.00 58.65 59.07 1x93 h GLN 44 Cb 0.48 -0.14 -0.04 0.00 0.05 0.00 0.00 27.48 27.84 1x93 h GLN 44 CO 0.01 0.51 0.44 -0.22 -1.50 0.00 0.00 178.83 178.07 1x93 h LYS 45 N 0.68 1.13 -0.07 1.46 3.11 -1.34 0.87 116.57 122.41 1x93 h LYS 45 Ca 0.17 -0.13 -0.17 0.00 -2.81 0.00 0.00 60.65 57.71 1x93 h LYS 45 Cb 0.05 -0.22 -0.01 0.00 -1.00 0.00 0.00 32.23 31.05 1x93 h LYS 45 CO -0.03 0.83 -0.69 -0.07 -2.81 0.00 0.00 179.45 176.69 1x93 h LEU 46 N 1.12 0.36 -0.59 5.20 3.38 -1.16 -2.81 115.31 120.81 1x93 h LEU 46 Ca 0.28 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1x93 h LEU 46 Cb 0.04 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1x93 h LEU 46 CO -0.05 0.94 0.12 -0.08 0.09 0.00 0.00 178.44 179.47 1x93 h GLU 47 N 0.21 0.97 -0.13 1.13 4.81 -0.56 0.12 114.58 121.12 1x93 h GLU 47 Ca -0.02 -0.25 -0.09 0.00 -0.13 0.00 0.00 59.36 58.88 1x93 h GLU 47 Cb 1.24 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1x93 h GLU 47 CO 0.11 0.90 -0.30 0.87 -0.73 0.00 0.00 179.01 179.87 1x93 h LYS 48 N 0.87 0.25 0.01 1.92 1.57 -0.85 -2.70 116.57 117.64 1x93 h LYS 48 Ca 0.18 -0.09 -0.22 0.00 -1.87 0.00 0.00 60.65 58.66 1x93 h LYS 48 Cb 0.39 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 1x93 h LYS 48 CO 0.01 0.53 -0.93 0.52 -0.57 0.00 0.00 179.45 179.01 1x93 h MET 49 N 0.22 0.30 -0.02 3.15 2.86 -1.34 -3.34 114.93 116.77 1x93 h MET 49 Ca 0.03 -0.34 0.00 0.00 -2.06 0.00 0.00 59.70 57.34 1x93 h MET 49 Cb 0.65 0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.41 1x93 h MET 49 CO 0.05 1.04 0.01 0.00 1.06 0.00 0.00 176.91 179.07 1x93 h ALA 50 N 0.84 1.96 -0.06 6.32 0.00 -0.43 -0.20 119.26 127.68 1x93 h ALA 50 Ca -0.07 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1x93 h ALA 50 Cb 1.57 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.36 1x93 h ALA 50 CO 0.15 -0.02 0.10 -0.97 0.00 0.00 0.00 179.25 178.52 1x93 h ASN 51 N 0.00 0.00 0.46 0.00 -1.24 -1.67 0.13 115.58 113.26 1x93 h ASN 51 Ca 0.01 0.00 -0.13 0.00 0.71 0.00 0.00 56.30 56.88 1x93 h ASN 51 Cb 0.03 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.07 1x93 h ASN 51 CO -0.00 0.00 -0.58 -0.08 -1.29 0.00 0.00 177.43 175.48 1x93 h GLU 52 N 0.00 0.13 -0.01 6.67 4.57 -1.25 -2.66 114.58 122.04 1x93 h GLU 52 Ca 0.03 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1x93 h GLU 52 Cb 0.24 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.84 1x93 h GLU 52 CO -0.00 0.68 -0.15 0.39 -1.18 0.00 0.00 179.01 178.74 1x93 n GLU 53 N -3.87 0.74 -2.39 1.92 1.02 -0.49 -4.96 120.64 112.60 1x93 n GLU 53 Ca -0.02 -0.32 0.00 0.00 -0.02 0.00 0.00 57.16 56.80 1x93 n GLU 53 Cb 0.60 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.52 1x93 n GLU 53 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1x93 n GLU 54 N -0.85 0.00 -2.29 3.49 2.13 -0.38 -4.74 120.64 117.99 1x93 n GLU 54 Ca 0.14 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.91 1x93 n GLU 54 Cb 0.30 -2.48 -0.04 0.00 0.27 0.00 0.00 31.44 29.50 1x93 n GLU 54 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1x93 n GLU 55 N -0.58 -3.45 -2.15 5.31 0.00 0.31 -4.93 120.64 115.16 1x93 n GLU 55 Ca 0.00 2.72 -0.02 0.00 0.00 0.00 0.00 57.16 59.86 1x93 n GLU 55 Cb 0.50 -4.01 0.05 0.00 0.00 0.00 0.00 31.44 27.97 1x93 n GLU 55 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1x93 n SER 56 N 1.27 -0.34 -0.27 4.31 7.64 -1.26 -5.01 113.62 119.97 1x93 n SER 56 Ca -0.31 -2.09 0.07 0.00 1.01 0.00 0.00 58.87 57.55 1x93 n SER 56 Cb 0.48 0.20 0.20 0.00 -1.01 0.00 0.00 64.21 64.08 1x93 n SER 56 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 1x93 h VAL 57 N 5.01 0.36 -0.58 0.44 -1.51 -1.90 0.22 116.25 118.29 1x93 h VAL 57 Ca -0.38 -0.05 -0.01 0.00 -1.23 0.00 0.00 66.70 65.03 1x93 h VAL 57 Cb 1.40 0.19 -0.03 0.00 -2.13 0.00 0.00 31.29 30.72 1x93 h VAL 57 CO -0.09 0.03 0.34 1.23 -1.23 0.00 0.00 177.57 177.85 1x93 h GLY 58 N 0.16 0.85 1.31 5.19 0.00 -1.98 0.00 103.07 108.60 1x93 h GLY 58 Ca 0.45 -0.36 -0.13 0.00 0.00 0.00 0.00 47.33 47.29 1x93 h GLY 58 CO -0.64 0.35 -0.32 1.76 0.00 0.00 0.00 176.54 177.69 1x93 h SER 59 N 0.78 0.80 -0.39 0.19 0.02 -1.70 -1.88 113.55 111.38 1x93 h SER 59 Ca 0.21 -0.33 -0.02 0.00 -0.84 0.00 0.00 61.79 60.81 1x93 h SER 59 Cb 0.00 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 1x93 h SER 59 CO -0.04 1.06 0.16 0.22 -1.14 0.00 0.00 176.83 177.10 1x93 h TYR 60 N 0.65 0.58 0.10 3.45 5.03 -0.51 0.15 116.97 126.42 1x93 h TYR 60 Ca 0.07 -0.04 0.02 0.00 2.58 0.00 0.00 58.73 61.36 1x93 h TYR 60 Cb 0.86 -0.17 -0.03 0.00 1.55 0.00 0.00 36.73 38.93 1x93 h TYR 60 CO 0.05 0.51 -0.20 0.82 -1.32 0.00 0.00 178.16 178.01 1x93 h ILE 61 N 0.48 0.54 -0.38 1.81 2.04 -0.97 -1.43 117.51 119.60 1x93 h ILE 61 Ca 0.13 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.98 1x93 h ILE 61 Cb 0.16 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 1x93 h ILE 61 CO -0.01 0.00 0.20 0.50 0.00 0.00 0.00 178.15 178.84 1x93 h LYS 62 N -0.38 0.54 -0.93 2.37 3.11 -1.08 -2.55 116.57 117.65 1x93 h LYS 62 Ca 0.03 -0.07 0.06 0.00 -2.81 0.00 0.00 60.65 57.86 1x93 h LYS 62 Cb 0.40 -0.10 -0.06 0.00 -1.00 0.00 0.00 32.23 31.47 1x93 h LYS 62 CO -0.12 0.45 0.60 -0.09 -2.81 0.00 0.00 179.45 177.48 1x93 h ARG 63 N 0.48 1.05 -0.10 1.90 2.43 -0.61 -3.08 114.38 116.46 1x93 h ARG 63 Ca 0.13 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.14 1x93 h ARG 63 Cb 0.08 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1x93 h ARG 63 CO -0.02 0.70 -0.39 -0.92 -1.51 0.00 0.00 179.97 177.83 1x93 h TYR 64 N 1.08 0.25 -0.48 2.20 5.03 -0.82 0.94 116.97 125.17 1x93 h TYR 64 Ca 0.39 -0.06 0.01 0.00 2.58 0.00 0.00 58.73 61.65 1x93 h TYR 64 Cb 0.15 -0.06 -0.03 0.00 1.55 0.00 0.00 36.73 38.34 1x93 h TYR 64 CO -0.00 0.58 0.31 0.82 -1.32 0.00 0.00 178.16 178.54 1x93 h ILE 65 N 0.18 1.09 -0.22 1.81 1.08 -1.48 -1.35 117.51 118.63 1x93 h ILE 65 Ca 0.02 -0.21 -0.17 0.00 -0.39 0.00 0.00 64.86 64.10 1x93 h ILE 65 Cb 0.77 0.42 -0.00 0.00 -3.07 0.00 0.00 36.82 34.93 1x93 h ILE 65 CO 0.06 0.11 -0.57 -0.07 -0.69 0.00 0.00 178.15 176.99 1x93 h LEU 66 N 0.62 0.76 -1.01 1.44 3.38 -1.18 0.52 115.31 119.85 1x93 h LEU 66 Ca 0.18 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 1x93 h LEU 66 Cb -0.04 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 1x93 h LEU 66 CO -0.06 1.17 0.59 0.50 0.09 0.00 0.00 178.44 180.73 1x93 h LYS 67 N 0.51 1.27 0.01 1.13 3.64 -0.79 -2.85 116.57 119.49 1x93 h LYS 67 Ca 0.01 -0.10 -0.25 0.00 -1.27 0.00 0.00 60.65 59.03 1x93 h LYS 67 Cb 1.14 -0.27 0.01 0.00 -0.41 0.00 0.00 32.23 32.71 1x93 h LYS 67 CO 0.11 0.87 -1.02 0.00 -2.27 0.00 0.00 179.45 177.14 1x93 h ALA 68 N 1.36 0.21 0.00 5.00 0.00 -0.97 -3.35 119.26 121.51 1x93 h ALA 68 Ca 0.34 -0.71 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 1x93 h ALA 68 Cb -0.09 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1x93 h ALA 68 CO -0.07 0.74 -0.17 -0.07 0.00 0.00 0.00 179.25 179.69 1x93 h LEU 69 N 0.32 0.00 -2.59 0.00 3.38 -0.69 -0.68 115.31 115.05 1x93 h LEU 69 Ca -0.11 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.87 1x93 h LEU 69 Cb 1.67 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.42 1x93 h LEU 69 CO 0.19 0.17 0.09 0.03 0.09 0.00 0.00 178.44 179.00 1x93 h ARG 70 N 0.00 0.00 -0.26 1.13 3.08 -1.65 -3.34 114.38 113.34 1x93 h ARG 70 Ca -0.00 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.79 1x93 h ARG 70 Cb 0.36 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 30.21 1x93 h ARG 70 CO 0.02 0.00 -0.54 0.36 -1.07 0.00 0.00 179.97 178.74 1x93 n LYS 71 N -3.37 1.15 -0.33 0.04 2.85 -0.31 -5.00 118.16 113.18 1x93 n LYS 71 Ca -0.02 -2.14 0.17 0.00 -1.05 0.00 0.00 58.31 55.27 1x93 n LYS 71 Cb 0.17 -0.50 0.37 0.00 -0.65 0.00 0.00 35.03 34.42 1x93 n LYS 71 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 177.40 178.17 1x93 h ILE 72 N 2.30 0.46 -0.02 0.58 2.04 -1.56 -3.49 117.51 117.82 1x93 h ILE 72 Ca -0.20 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.50 1x93 h ILE 72 Cb 1.23 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1x93 h ILE 72 CO 0.09 0.08 0.00 -0.62 0.00 0.00 0.00 178.15 177.70