#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 3.01 0.33 1.09 6.06 -1.26 -5.01 118.95 123.18 1x93 s ARG 32 Ca 0.00 0.19 -0.29 0.00 -2.50 0.00 0.00 55.73 53.13 1x93 s ARG 32 Cb 0.00 -4.24 -0.11 0.00 0.06 0.00 0.00 34.95 30.66 1x93 s ARG 32 CO 0.00 -2.31 1.50 0.00 -2.50 0.00 0.00 175.30 171.99 1x93 s ALA 33 N 6.96 3.63 -0.47 6.12 0.00 -1.26 -5.01 121.76 131.73 1x93 s ALA 33 Ca 0.49 1.51 0.03 0.00 0.00 0.00 0.00 51.96 54.00 1x93 s ALA 33 Cb -0.10 -3.60 0.15 0.00 0.00 0.00 0.00 23.12 19.56 1x93 s ALA 33 CO 0.19 -0.95 0.30 0.08 0.00 0.00 0.00 175.76 175.38 1x93 s VAL 34 N -0.60 1.35 -0.41 0.00 1.01 -1.26 -5.09 120.40 115.40 1x93 s VAL 34 Ca 0.57 -2.82 -0.10 0.00 0.00 0.00 0.00 61.98 59.63 1x93 s VAL 34 Cb -0.46 -1.93 0.07 0.00 0.00 0.00 0.00 36.38 34.06 1x93 s VAL 34 CO 0.54 -0.99 0.24 -0.55 0.00 0.00 0.00 175.10 174.34 1x93 s SER 35 N 0.02 5.65 0.21 3.32 0.15 -1.26 -5.07 113.70 116.73 1x93 s SER 35 Ca 0.22 -1.37 0.03 0.00 0.70 0.00 0.00 55.95 55.53 1x93 s SER 35 Cb -0.15 -1.99 -0.05 0.00 -1.71 0.00 0.00 66.02 62.12 1x93 s SER 35 CO -0.07 -0.50 -0.00 -0.76 1.20 0.00 0.00 173.24 173.11 1x93 s LEU 36 N 1.46 2.16 -0.44 3.45 1.43 -1.26 -5.13 118.68 120.34 1x93 s LEU 36 Ca 0.02 -1.21 0.03 0.00 -1.03 0.00 0.00 54.13 51.95 1x93 s LEU 36 Cb -0.22 -0.21 0.16 0.00 0.03 0.00 0.00 46.19 45.95 1x93 s LEU 36 CO 0.03 -0.53 0.31 -0.31 0.23 0.00 0.00 176.35 176.09 1x93 s TYR 37 N -3.49 1.45 0.93 0.29 2.02 -1.26 -5.12 117.35 112.17 1x93 s TYR 37 Ca 0.27 -2.30 -0.14 0.00 -0.37 0.00 0.00 57.07 54.54 1x93 s TYR 37 Cb 0.06 -1.29 0.16 0.00 -0.40 0.00 0.00 41.96 40.48 1x93 s TYR 37 CO 0.07 -0.79 1.19 -0.06 -1.57 0.00 0.00 175.55 174.40 1x93 s PHE 38 N 0.17 2.17 0.27 2.71 0.40 -1.26 -5.11 117.98 117.33 1x93 s PHE 38 Ca 0.26 0.66 0.08 0.00 -0.60 0.00 0.00 56.93 57.32 1x93 s PHE 38 Cb -0.08 -3.60 -0.04 0.00 0.51 0.00 0.00 43.02 39.81 1x93 s PHE 38 CO -0.11 -2.46 0.14 -1.12 0.70 0.00 0.00 175.22 172.37 1x93 s SER 39 N -4.36 5.17 0.16 1.36 0.01 -1.26 -4.97 113.70 109.80 1x93 s SER 39 Ca 0.67 -0.42 -0.18 0.00 1.31 0.00 0.00 55.95 57.32 1x93 s SER 39 Cb -0.11 -1.16 0.06 0.00 0.21 0.00 0.00 66.02 65.03 1x93 s SER 39 CO 0.52 -0.07 1.67 0.44 0.41 0.00 0.00 173.24 176.21 1x93 h ASP 40 N 1.59 -0.41 -0.15 2.44 3.32 -1.99 0.32 116.42 121.54 1x93 h ASP 40 Ca -0.47 0.11 0.02 0.00 0.02 0.00 0.00 57.03 56.71 1x93 h ASP 40 Cb 1.24 0.25 -0.02 0.00 0.22 0.00 0.00 39.33 41.02 1x93 h ASP 40 CO 0.61 -0.15 0.03 -0.33 -1.72 0.00 0.00 179.24 177.68 1x93 h GLU 41 N -0.05 0.09 -0.38 3.56 4.39 -1.98 0.13 114.58 120.33 1x93 h GLU 41 Ca 0.17 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.90 1x93 h GLU 41 Cb 0.30 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.89 1x93 h GLU 41 CO -0.37 0.06 0.17 1.96 -1.16 0.00 0.00 179.01 179.67 1x93 h GLN 42 N 0.09 0.35 -0.07 2.33 4.20 -1.85 -1.11 115.11 119.05 1x93 h GLN 42 Ca 0.06 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 1x93 h GLN 42 Cb 0.06 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 1x93 h GLN 42 CO -0.09 0.23 -0.03 -0.92 -0.67 0.00 0.00 178.83 177.35 1x93 h TYR 43 N 0.36 0.17 -0.76 2.96 3.20 -0.70 -3.04 116.97 119.15 1x93 h TYR 43 Ca 0.17 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.99 1x93 h TYR 43 Cb 0.10 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.29 1x93 h TYR 43 CO -0.11 0.52 0.45 1.96 -1.64 0.00 0.00 178.16 179.34 1x93 h GLN 44 N -0.23 1.04 -0.62 1.82 7.50 -0.68 0.15 115.11 124.08 1x93 h GLN 44 Ca 0.02 -0.10 0.04 0.00 0.50 0.00 0.00 58.65 59.11 1x93 h GLN 44 Cb 0.48 -0.22 -0.05 0.00 0.05 0.00 0.00 27.48 27.74 1x93 h GLN 44 CO 0.01 0.73 0.36 -0.22 -1.50 0.00 0.00 178.83 178.21 1x93 h LYS 45 N 1.05 0.66 -0.27 1.46 1.63 -1.23 -0.08 116.57 119.79 1x93 h LYS 45 Ca 0.27 -0.04 -0.16 0.00 -0.85 0.00 0.00 60.65 59.88 1x93 h LYS 45 Cb -0.03 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.45 1x93 h LYS 45 CO -0.05 0.44 -0.46 -0.07 -3.45 0.00 0.00 179.45 175.85 1x93 h LEU 46 N 0.68 0.78 -0.74 5.20 3.38 -1.14 -2.78 115.31 120.69 1x93 h LEU 46 Ca 0.27 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 1x93 h LEU 46 Cb 0.11 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 1x93 h LEU 46 CO -0.14 1.12 0.40 -0.08 0.09 0.00 0.00 178.44 179.82 1x93 h GLU 47 N 0.57 1.04 -0.58 1.13 4.81 -0.56 0.53 114.58 121.51 1x93 h GLU 47 Ca 0.03 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 1x93 h GLU 47 Cb 1.02 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 30.17 1x93 h GLU 47 CO 0.10 0.78 0.26 -0.22 -0.73 0.00 0.00 179.01 179.19 1x93 h LYS 48 N 1.02 0.83 -0.18 1.92 3.64 -0.95 -2.13 116.57 120.73 1x93 h LYS 48 Ca 0.26 -0.12 -0.17 0.00 -1.27 0.00 0.00 60.65 59.35 1x93 h LYS 48 Cb 0.05 -0.15 0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1x93 h LYS 48 CO -0.04 0.67 -0.57 0.52 -2.27 0.00 0.00 179.45 177.76 1x93 h MET 49 N 0.83 0.71 0.00 1.90 2.86 -1.27 -3.30 114.93 116.65 1x93 h MET 49 Ca 0.20 -0.52 -0.01 0.00 -2.06 0.00 0.00 59.70 57.32 1x93 h MET 49 Cb 0.12 0.09 -0.00 0.00 0.06 0.00 0.00 31.60 31.87 1x93 h MET 49 CO -0.02 1.14 -0.04 0.00 1.06 0.00 0.00 176.91 179.05 1x93 h ALA 50 N 0.57 1.38 -0.22 6.32 0.00 -0.36 -1.10 119.26 125.85 1x93 h ALA 50 Ca -0.02 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1x93 h ALA 50 Cb 1.19 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1x93 h ALA 50 CO 0.12 0.05 0.21 -0.97 0.00 0.00 0.00 179.25 178.66 1x93 h ASN 51 N 0.00 0.00 0.47 0.00 -1.24 -1.49 0.21 115.58 113.53 1x93 h ASN 51 Ca -0.00 0.00 -0.13 0.00 0.71 0.00 0.00 56.30 56.88 1x93 h ASN 51 Cb 0.11 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.15 1x93 h ASN 51 CO 0.00 0.00 -0.56 -0.33 -1.29 0.00 0.00 177.43 175.25 1x93 h GLU 52 N 0.00 0.09 -0.09 6.67 5.08 -1.41 -2.50 114.58 122.43 1x93 h GLU 52 Ca 0.10 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1x93 h GLU 52 Cb 0.53 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1x93 h GLU 52 CO -0.00 0.63 0.00 0.39 -1.00 0.00 0.00 179.01 179.03 1x93 n GLU 53 N -3.88 1.62 -2.64 2.33 -0.58 -0.43 -4.96 120.64 112.10 1x93 n GLU 53 Ca -0.02 -0.91 -0.07 0.00 -0.42 0.00 0.00 57.16 55.74 1x93 n GLU 53 Cb 0.57 -1.43 0.03 0.00 -0.57 0.00 0.00 31.44 30.05 1x93 n GLU 53 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1x93 n GLU 54 N 0.12 -2.53 -2.95 3.49 2.13 -0.45 -4.65 120.64 115.80 1x93 n GLU 54 Ca 0.17 0.30 -0.10 0.00 0.66 0.00 0.00 57.16 58.19 1x93 n GLU 54 Cb 0.31 -3.70 0.01 0.00 0.27 0.00 0.00 31.44 28.33 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 -2.12 -2.43 -3.17 5.31 1.02 0.59 -4.93 120.64 114.91 1x93 n GLU 55 Ca -0.07 2.08 -0.21 0.00 -0.02 0.00 0.00 57.16 58.94 1x93 n GLU 55 Cb 0.55 -4.65 -0.04 0.00 -0.02 0.00 0.00 31.44 27.27 1x93 n GLU 55 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1x93 n SER 56 N 0.10 1.20 -0.30 1.62 2.88 -1.26 -5.00 113.62 112.85 1x93 n SER 56 Ca 0.05 -3.02 -0.01 0.00 -1.33 0.00 0.00 58.87 54.56 1x93 n SER 56 Cb 0.38 -0.62 0.12 0.00 -0.75 0.00 0.00 64.21 63.35 1x93 n SER 56 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1x93 h VAL 57 N 1.57 1.08 -0.71 2.46 2.07 -1.91 -0.09 116.25 120.72 1x93 h VAL 57 Ca 0.10 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 1x93 h VAL 57 Cb 0.88 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1x93 h VAL 57 CO 0.54 0.18 0.36 1.23 0.02 0.00 0.00 177.57 179.90 1x93 h GLY 58 N 0.99 1.08 1.10 2.17 0.00 -1.98 -0.56 103.07 105.87 1x93 h GLY 58 Ca 0.35 -0.52 -0.13 0.00 0.00 0.00 0.00 47.33 47.03 1x93 h GLY 58 CO -0.15 0.49 -0.23 0.23 0.00 0.00 0.00 176.54 176.89 1x93 h SER 59 N 0.98 1.01 -0.96 0.19 0.87 -1.84 -3.04 113.55 110.77 1x93 h SER 59 Ca 0.24 -0.40 0.02 0.00 -1.23 0.00 0.00 61.79 60.42 1x93 h SER 59 Cb 0.09 -0.28 -0.05 0.00 -0.44 0.00 0.00 62.40 61.72 1x93 h SER 59 CO -0.03 1.19 0.63 0.22 -0.53 0.00 0.00 176.83 178.31 1x93 h TYR 60 N 0.83 1.19 0.16 2.24 5.03 -0.51 0.99 116.97 126.91 1x93 h TYR 60 Ca 0.10 0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.45 1x93 h TYR 60 Cb 0.81 -0.40 -0.04 0.00 1.55 0.00 0.00 36.73 38.65 1x93 h TYR 60 CO 0.05 0.73 -0.50 0.82 -1.32 0.00 0.00 178.16 177.95 1x93 h ILE 61 N 1.27 0.00 -0.43 1.81 2.04 -1.10 -0.51 117.51 120.59 1x93 h ILE 61 Ca 0.36 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.20 1x93 h ILE 61 Cb -0.10 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 35.96 1x93 h ILE 61 CO -0.09 0.00 0.21 0.50 0.00 0.00 0.00 178.15 178.77 1x93 h LYS 62 N -0.74 0.62 -0.84 2.37 3.64 -1.31 -2.17 116.57 118.14 1x93 h LYS 62 Ca -0.01 -0.09 0.18 0.00 -1.27 0.00 0.00 60.65 59.45 1x93 h LYS 62 Cb 0.73 -0.11 -0.11 0.00 -0.41 0.00 0.00 32.23 32.33 1x93 h LYS 62 CO -0.24 0.53 0.37 -0.09 -2.27 0.00 0.00 179.45 177.74 1x93 h ARG 63 N 0.55 0.45 -0.19 1.90 9.65 -0.71 -0.39 114.38 125.65 1x93 h ARG 63 Ca 0.15 -0.03 -0.16 0.00 -1.10 0.00 0.00 59.98 58.84 1x93 h ARG 63 Cb 0.11 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.58 1x93 h ARG 63 CO -0.02 0.30 -0.56 -0.92 2.80 0.00 0.00 179.97 181.57 1x93 h TYR 64 N 0.47 0.71 -0.13 2.20 3.20 -0.45 0.22 116.97 123.18 1x93 h TYR 64 Ca 0.49 -0.25 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 1x93 h TYR 64 Cb 0.81 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 1x93 h TYR 64 CO -0.14 0.99 0.07 0.82 -1.64 0.00 0.00 178.16 178.25 1x93 h ILE 65 N 0.43 1.11 -0.38 1.81 1.08 -1.10 -1.59 117.51 118.86 1x93 h ILE 65 Ca 0.01 -0.30 -0.12 0.00 -0.39 0.00 0.00 64.86 64.06 1x93 h ILE 65 Cb 1.10 1.07 -0.01 0.00 -3.07 0.00 0.00 36.82 35.91 1x93 h ILE 65 CO 0.11 0.10 -0.24 -0.07 -0.69 0.00 0.00 178.15 177.35 1x93 h LEU 66 N 0.10 0.80 -0.25 1.44 4.07 -0.80 -0.46 115.31 120.20 1x93 h LEU 66 Ca 0.04 -0.30 -0.01 0.00 0.08 0.00 0.00 57.88 57.70 1x93 h LEU 66 Cb 0.10 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.60 1x93 h LEU 66 CO -0.01 1.01 0.13 0.50 -1.08 0.00 0.00 178.44 178.99 1x93 h LYS 67 N 0.68 0.35 -0.35 1.13 3.64 -0.57 -2.82 116.57 118.63 1x93 h LYS 67 Ca 0.09 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.35 1x93 h LYS 67 Cb 0.76 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 1x93 h LYS 67 CO 0.06 0.33 -0.09 0.00 -2.27 0.00 0.00 179.45 177.48 1x93 h ALA 68 N 1.01 1.20 0.00 5.00 0.00 -1.06 -3.08 119.26 122.33 1x93 h ALA 68 Ca 0.09 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1x93 h ALA 68 Cb 0.08 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1x93 h ALA 68 CO -0.01 0.52 -0.02 1.25 0.00 0.00 0.00 179.25 180.98 1x93 h LEU 69 N 0.54 0.00 -1.60 0.00 5.85 -0.83 -1.92 115.31 117.35 1x93 h LEU 69 Ca 0.10 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.89 1x93 h LEU 69 Cb 0.48 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 1x93 h LEU 69 CO 0.03 0.02 0.36 0.03 -0.34 0.00 0.00 178.44 178.54 1x93 h ARG 70 N 0.00 0.47 -0.52 1.25 3.08 -1.43 -3.36 114.38 113.87 1x93 h ARG 70 Ca -0.00 -0.03 -0.30 0.00 0.07 0.00 0.00 59.98 59.72 1x93 h ARG 70 Cb 0.06 -0.11 -0.23 0.00 0.08 0.00 0.00 29.97 29.77 1x93 h ARG 70 CO 0.00 0.31 -0.66 1.17 -1.07 0.00 0.00 179.97 179.73 1x93 n LYS 71 N -4.47 1.07 0.01 0.04 0.00 -0.76 -5.03 118.16 109.01 1x93 n LYS 71 Ca 0.07 -2.34 -0.11 0.00 0.00 0.00 0.00 58.31 55.93 1x93 n LYS 71 Cb 0.25 -0.95 -0.04 0.00 0.00 0.00 0.00 35.03 34.29 1x93 n LYS 71 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 1x93 h ILE 72 N 2.35 0.28 -0.00 3.15 2.04 -1.63 -3.49 117.51 120.21 1x93 h ILE 72 Ca -0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1x93 h ILE 72 Cb 1.13 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1x93 h ILE 72 CO 0.20 0.00 0.00 1.21 0.00 0.00 0.00 178.15 179.56