#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 2.55 -1.69 1.09 3.00 -1.26 -4.96 116.66 115.39 1x93 n ARG 32 Ca 0.00 -2.55 -0.43 0.00 -0.00 0.00 0.00 57.85 54.87 1x93 n ARG 32 Cb 0.00 -3.27 -0.03 0.00 0.00 0.00 0.00 32.46 29.15 1x93 n ARG 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1x93 n ALA 33 N 7.26 2.17 -3.64 5.13 0.00 -1.26 -5.01 120.51 125.16 1x93 n ALA 33 Ca 0.51 0.35 -0.16 0.00 0.00 0.00 0.00 53.44 54.14 1x93 n ALA 33 Cb 0.41 -2.53 -0.15 0.00 0.00 0.00 0.00 19.45 17.18 1x93 n ALA 33 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1x93 s VAL 34 N 2.13 -0.32 -0.04 0.00 1.01 -1.26 -5.16 120.40 116.77 1x93 s VAL 34 Ca 0.80 0.27 0.05 0.00 0.00 0.00 0.00 61.98 63.10 1x93 s VAL 34 Cb -0.53 -0.39 -0.01 0.00 0.00 0.00 0.00 36.38 35.45 1x93 s VAL 34 CO 0.37 0.09 -0.19 -0.55 0.00 0.00 0.00 175.10 174.82 1x93 s SER 35 N 2.34 2.31 0.14 3.32 0.15 -1.26 -5.14 113.70 115.55 1x93 s SER 35 Ca 0.03 -0.37 0.01 0.00 0.70 0.00 0.00 55.95 56.32 1x93 s SER 35 Cb -0.12 -0.52 -0.04 0.00 -1.71 0.00 0.00 66.02 63.63 1x93 s SER 35 CO -0.07 0.19 -0.00 -0.76 1.20 0.00 0.00 173.24 173.80 1x93 s LEU 36 N -0.15 2.14 -0.50 3.45 1.02 -1.26 -5.13 118.68 118.25 1x93 s LEU 36 Ca -0.00 -1.14 0.04 0.00 0.02 0.00 0.00 54.13 53.05 1x93 s LEU 36 Cb -0.10 0.05 0.13 0.00 0.02 0.00 0.00 46.19 46.28 1x93 s LEU 36 CO 0.01 -0.59 0.26 -0.31 0.02 0.00 0.00 176.35 175.74 1x93 s TYR 37 N -3.76 2.91 0.86 0.29 2.02 -1.26 -5.10 117.35 113.30 1x93 s TYR 37 Ca 0.20 -3.01 -0.11 0.00 -0.37 0.00 0.00 57.07 53.79 1x93 s TYR 37 Cb 0.06 -2.61 0.15 0.00 -0.40 0.00 0.00 41.96 39.17 1x93 s TYR 37 CO 0.01 -0.75 1.19 -0.06 -1.57 0.00 0.00 175.55 174.37 1x93 s PHE 38 N -0.16 1.87 0.30 2.71 0.40 -1.26 -5.15 117.98 116.69 1x93 s PHE 38 Ca 0.17 0.22 0.04 0.00 -0.60 0.00 0.00 56.93 56.76 1x93 s PHE 38 Cb -0.25 -3.67 -0.06 0.00 0.51 0.00 0.00 43.02 39.54 1x93 s PHE 38 CO -0.00 -2.19 0.04 -1.54 0.70 0.00 0.00 175.22 172.23 1x93 s SER 39 N -4.78 2.28 0.18 1.36 1.04 -1.26 -4.99 113.70 107.52 1x93 s SER 39 Ca 0.69 -1.33 -0.20 0.00 0.48 0.00 0.00 55.95 55.59 1x93 s SER 39 Cb -0.06 -0.07 0.11 0.00 0.10 0.00 0.00 66.02 66.10 1x93 s SER 39 CO 0.49 -0.57 1.61 0.44 0.98 0.00 0.00 173.24 176.20 1x93 h ASP 40 N 2.20 -0.91 -0.15 7.02 3.32 -2.01 0.67 116.42 126.56 1x93 h ASP 40 Ca -0.40 0.19 0.03 0.00 0.02 0.00 0.00 57.03 56.87 1x93 h ASP 40 Cb 1.24 0.46 -0.03 0.00 0.22 0.00 0.00 39.33 41.22 1x93 h ASP 40 CO 0.68 -0.28 -0.04 -0.33 -1.72 0.00 0.00 179.24 177.56 1x93 h GLU 41 N -0.17 0.00 -0.74 3.56 4.39 -1.98 0.80 114.58 120.45 1x93 h GLU 41 Ca 0.21 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.88 1x93 h GLU 41 Cb 0.50 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 1x93 h GLU 41 CO -0.56 0.00 0.36 1.96 -1.16 0.00 0.00 179.01 179.62 1x93 h GLN 42 N 0.00 1.04 0.05 2.33 4.20 -1.78 -0.35 115.11 120.61 1x93 h GLN 42 Ca 0.07 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 1x93 h GLN 42 Cb 0.11 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 27.69 1x93 h GLN 42 CO -0.16 0.80 -0.02 -0.92 -0.67 0.00 0.00 178.83 177.86 1x93 h TYR 43 N 1.04 -0.06 -0.51 2.96 3.20 -0.62 -3.18 116.97 119.80 1x93 h TYR 43 Ca 0.26 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 62.06 1x93 h TYR 43 Cb 0.09 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.36 1x93 h TYR 43 CO 0.01 0.44 0.05 1.96 -1.64 0.00 0.00 178.16 178.98 1x93 h GLN 44 N -0.60 0.83 0.00 1.82 7.50 -0.72 0.15 115.11 124.08 1x93 h GLN 44 Ca -0.01 -0.21 -0.04 0.00 0.50 0.00 0.00 58.65 58.89 1x93 h GLN 44 Cb 0.53 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.95 1x93 h GLN 44 CO 0.01 0.80 -0.21 0.87 -1.50 0.00 0.00 178.83 178.80 1x93 h LYS 45 N 0.78 0.00 0.13 1.46 1.57 -1.18 0.23 116.57 119.56 1x93 h LYS 45 Ca 0.16 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.66 1x93 h LYS 45 Cb 0.40 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.73 1x93 h LYS 45 CO 0.01 0.21 -1.23 -0.07 -0.57 0.00 0.00 179.45 177.80 1x93 h LEU 46 N 0.00 0.62 -0.61 2.94 3.38 -1.35 -3.14 115.31 117.16 1x93 h LEU 46 Ca -0.00 -0.61 -0.01 0.00 0.09 0.00 0.00 57.88 57.34 1x93 h LEU 46 Cb 0.39 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1x93 h LEU 46 CO 0.03 1.45 0.33 -0.08 0.09 0.00 0.00 178.44 180.26 1x93 h GLU 47 N 0.16 0.86 0.00 1.13 4.81 -0.66 -0.50 114.58 120.38 1x93 h GLU 47 Ca -0.16 -0.11 -0.10 0.00 -0.13 0.00 0.00 59.36 58.87 1x93 h GLU 47 Cb 1.92 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 31.12 1x93 h GLU 47 CO 0.22 0.66 -0.46 1.57 -0.73 0.00 0.00 179.01 180.26 1x93 h LYS 48 N 0.83 0.00 -0.29 1.92 2.10 -1.08 -2.32 116.57 117.73 1x93 h LYS 48 Ca 0.21 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.76 1x93 h LYS 48 Cb 0.06 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.38 1x93 h LYS 48 CO -0.03 0.46 -0.22 0.52 -2.00 0.00 0.00 179.45 178.18 1x93 h MET 49 N 0.00 0.66 0.00 0.07 2.86 -1.47 -3.29 114.93 113.76 1x93 h MET 49 Ca -0.00 -0.32 -0.01 0.00 -2.06 0.00 0.00 59.70 57.31 1x93 h MET 49 Cb 0.92 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.58 1x93 h MET 49 CO 0.06 0.92 -0.03 0.00 1.06 0.00 0.00 176.91 178.92 1x93 h ALA 50 N 0.72 1.78 -0.07 6.32 0.00 -0.57 -0.61 119.26 126.83 1x93 h ALA 50 Ca 0.05 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1x93 h ALA 50 Cb 0.77 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1x93 h ALA 50 CO 0.06 0.04 0.10 -0.97 0.00 0.00 0.00 179.25 178.48 1x93 h ASN 51 N 0.00 0.00 0.20 0.00 -0.73 -1.50 0.13 115.58 113.68 1x93 h ASN 51 Ca -0.00 0.00 -0.11 0.00 1.87 0.00 0.00 56.30 58.06 1x93 h ASN 51 Cb 0.07 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.65 1x93 h ASN 51 CO 0.00 0.00 -0.42 -0.08 -0.37 0.00 0.00 177.43 176.56 1x93 h GLU 52 N 0.00 0.29 -0.01 6.67 4.57 -1.28 -2.44 114.58 122.38 1x93 h GLU 52 Ca 0.04 -0.14 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 1x93 h GLU 52 Cb 0.23 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1x93 h GLU 52 CO -0.00 0.66 -0.03 0.39 -1.18 0.00 0.00 179.01 178.85 1x93 n GLU 53 N -4.02 1.26 -2.64 1.92 1.02 -0.52 -4.95 120.64 112.71 1x93 n GLU 53 Ca -0.02 -0.52 -0.05 0.00 -0.02 0.00 0.00 57.16 56.55 1x93 n GLU 53 Cb 0.49 -1.49 0.02 0.00 -0.02 0.00 0.00 31.44 30.44 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 -0.42 -1.88 -1.65 3.49 2.13 -0.56 -4.77 120.64 116.98 1x93 n GLU 54 Ca 0.19 0.21 0.00 0.00 0.66 0.00 0.00 57.16 58.22 1x93 n GLU 54 Cb 0.27 -3.34 0.00 0.00 0.27 0.00 0.00 31.44 28.64 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 -1.67 -2.82 -0.87 5.31 1.02 0.36 -4.94 120.64 117.03 1x93 n GLU 55 Ca -0.02 2.27 -0.01 0.00 -0.02 0.00 0.00 57.16 59.37 1x93 n GLU 55 Cb 0.52 -2.67 -0.02 0.00 -0.02 0.00 0.00 31.44 29.26 1x93 n GLU 55 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1x93 n SER 56 N 0.99 -0.11 -4.63 1.62 3.41 -1.26 -4.99 113.62 108.66 1x93 n SER 56 Ca 0.00 -1.72 -0.47 0.00 -0.26 0.00 0.00 58.87 56.42 1x93 n SER 56 Cb 0.00 -0.01 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 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 0.11 0.51 0.00 -3.33 0.31 -1.26 -0.98 118.33 113.68 1x93 n VAL 57 Ca -0.08 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1x93 n VAL 57 Cb 0.74 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 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 4.96 3.34 0.22 2.92 0.00 -1.26 -4.84 105.19 110.52 1x93 n GLY 58 Ca 0.26 -0.95 -0.16 0.00 0.00 0.00 0.00 46.02 45.18 1x93 n GLY 58 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1x93 h SER 59 N 0.00 0.86 -0.98 1.61 0.87 -1.51 -3.20 113.55 111.20 1x93 h SER 59 Ca 0.00 -0.58 0.05 0.00 -1.23 0.00 0.00 61.79 60.03 1x93 h SER 59 Cb 0.00 -0.25 -0.06 0.00 -0.44 0.00 0.00 62.40 61.65 1x93 h SER 59 CO 0.00 1.29 0.64 0.22 -0.53 0.00 0.00 176.83 178.44 1x93 h TYR 60 N 0.48 1.18 -0.16 2.24 5.03 -1.71 -0.10 116.97 123.92 1x93 h TYR 60 Ca -0.01 0.03 0.05 0.00 2.58 0.00 0.00 58.73 61.37 1x93 h TYR 60 Cb 1.19 -0.39 -0.05 0.00 1.55 0.00 0.00 36.73 39.03 1x93 h TYR 60 CO 0.09 0.64 -0.17 0.82 -1.32 0.00 0.00 178.16 178.22 1x93 h ILE 61 N 1.18 0.55 -0.16 1.81 2.04 -1.84 0.89 117.51 121.98 1x93 h ILE 61 Ca 0.41 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.26 1x93 h ILE 61 Cb 0.10 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1x93 h ILE 61 CO -0.15 0.00 0.05 0.50 0.00 0.00 0.00 178.15 178.56 1x93 h LYS 62 N -0.20 0.24 -0.94 2.37 3.64 -1.39 -2.95 116.57 117.34 1x93 h LYS 62 Ca 0.11 -0.05 0.16 0.00 -1.27 0.00 0.00 60.65 59.60 1x93 h LYS 62 Cb 0.36 -0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 32.06 1x93 h LYS 62 CO -0.28 0.36 0.60 0.00 -2.27 0.00 0.00 179.45 177.86 1x93 h ARG 63 N 0.08 0.69 -0.31 1.90 -0.00 -0.55 -0.04 114.38 116.14 1x93 h ARG 63 Ca 0.05 -0.04 -0.14 0.00 -0.50 0.00 0.00 59.98 59.35 1x93 h ARG 63 Cb 0.22 -0.15 -0.01 0.00 0.00 0.00 0.00 29.97 30.02 1x93 h ARG 63 CO -0.00 0.45 -0.38 -0.92 0.00 0.00 0.00 179.97 179.12 1x93 h TYR 64 N 0.71 0.88 -0.34 3.04 3.20 -0.67 0.15 116.97 123.93 1x93 h TYR 64 Ca 0.49 -0.25 -0.09 0.00 3.14 0.00 0.00 58.73 62.02 1x93 h TYR 64 Cb 0.81 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 1x93 h TYR 64 CO -0.00 1.01 -0.13 0.82 -1.64 0.00 0.00 178.16 178.21 1x93 h ILE 65 N 0.61 1.29 -0.37 1.81 1.08 -1.30 -1.91 117.51 118.72 1x93 h ILE 65 Ca 0.05 -1.23 -0.11 0.00 -0.39 0.00 0.00 64.86 63.18 1x93 h ILE 65 Cb 0.92 1.38 -0.01 0.00 -3.07 0.00 0.00 36.82 36.04 1x93 h ILE 65 CO 0.08 0.40 -0.23 -0.07 -0.69 0.00 0.00 178.15 177.65 1x93 h LEU 66 N 0.46 0.75 -0.74 1.44 4.07 -0.75 0.31 115.31 120.85 1x93 h LEU 66 Ca 0.08 -0.27 -0.08 0.00 0.08 0.00 0.00 57.88 57.69 1x93 h LEU 66 Cb 0.66 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 42.17 1x93 h LEU 66 CO 0.04 0.95 0.09 0.50 -1.08 0.00 0.00 178.44 178.95 1x93 h LYS 67 N 0.64 1.05 -0.45 1.13 3.64 -0.73 -2.72 116.57 119.13 1x93 h LYS 67 Ca 0.09 -0.28 -0.11 0.00 -1.27 0.00 0.00 60.65 59.08 1x93 h LYS 67 Cb 0.73 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 1x93 h LYS 67 CO 0.06 0.97 -0.14 0.00 -2.27 0.00 0.00 179.45 178.07 1x93 h ALA 68 N 1.10 0.63 0.00 5.00 0.00 -0.89 -3.27 119.26 121.83 1x93 h ALA 68 Ca 0.19 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1x93 h ALA 68 Cb 0.44 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1x93 h ALA 68 CO 0.01 0.55 -0.22 -0.07 0.00 0.00 0.00 179.25 179.52 1x93 h LEU 69 N 0.73 0.00 -2.16 0.00 3.38 -0.80 -0.83 115.31 115.63 1x93 h LEU 69 Ca 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1x93 h LEU 69 Cb 0.69 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 1x93 h LEU 69 CO 0.05 0.22 -0.04 0.03 0.09 0.00 0.00 178.44 178.79 1x93 h ARG 70 N 0.00 0.00 -0.32 1.13 3.08 -1.53 -3.37 114.38 113.38 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 0.56 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 30.37 1x93 h ARG 70 CO 0.03 0.04 -0.64 1.17 -1.07 0.00 0.00 179.97 179.50 1x93 n LYS 71 N -3.27 1.24 -0.34 0.04 4.81 -0.47 -4.99 118.16 115.19 1x93 n LYS 71 Ca -0.01 -2.27 0.21 0.00 -0.87 0.00 0.00 58.31 55.37 1x93 n LYS 71 Cb 0.20 -0.43 0.47 0.00 0.02 0.00 0.00 35.03 35.28 1x93 n LYS 71 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 1x93 h ILE 72 N 2.79 0.51 0.00 3.15 2.04 -1.37 -3.48 117.51 121.15 1x93 h ILE 72 Ca -0.24 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.46 1x93 h ILE 72 Cb 1.26 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1x93 h ILE 72 CO 0.10 0.08 0.00 1.21 0.00 0.00 0.00 178.15 179.54