#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 3.65 -1.72 -2.82 3.00 -1.26 -5.03 116.66 112.49 1x93 n ARG 32 Ca 0.00 -4.28 -0.42 0.00 -0.00 0.00 0.00 57.85 53.14 1x93 n ARG 32 Cb 0.00 -2.68 -0.01 0.00 0.00 0.00 0.00 32.46 29.78 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 3.20 1.57 -3.50 5.13 0.00 -1.26 -5.03 120.51 120.63 1x93 n ALA 33 Ca 0.28 0.36 -0.18 0.00 0.00 0.00 0.00 53.44 53.90 1x93 n ALA 33 Cb 0.39 -2.30 -0.13 0.00 0.00 0.00 0.00 19.45 17.41 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 -1.00 -0.32 -0.18 0.00 1.01 -1.26 -5.14 120.40 113.51 1x93 s VAL 34 Ca 0.56 -0.12 -0.01 0.00 0.00 0.00 0.00 61.98 62.41 1x93 s VAL 34 Cb -0.55 -0.68 -0.00 0.00 0.00 0.00 0.00 36.38 35.15 1x93 s VAL 34 CO 0.61 -0.21 -0.12 -0.55 0.00 0.00 0.00 175.10 174.84 1x93 s SER 35 N 2.32 3.88 0.19 3.32 0.15 -1.26 -5.11 113.70 117.18 1x93 s SER 35 Ca 0.07 -0.44 0.02 0.00 0.70 0.00 0.00 55.95 56.30 1x93 s SER 35 Cb -0.16 -1.62 -0.05 0.00 -1.71 0.00 0.00 66.02 62.48 1x93 s SER 35 CO -0.12 0.05 0.01 -0.76 1.20 0.00 0.00 173.24 173.62 1x93 s LEU 36 N 1.03 2.09 -0.53 3.45 1.43 -1.26 -5.13 118.68 119.75 1x93 s LEU 36 Ca -0.01 -1.19 0.04 0.00 -1.03 0.00 0.00 54.13 51.94 1x93 s LEU 36 Cb -0.15 -0.08 0.13 0.00 0.03 0.00 0.00 46.19 46.13 1x93 s LEU 36 CO -0.02 -0.57 0.28 -0.31 0.23 0.00 0.00 176.35 175.96 1x93 s TYR 37 N -3.63 3.21 0.51 0.29 2.02 -1.26 -5.07 117.35 113.42 1x93 s TYR 37 Ca 0.25 -3.19 0.04 0.00 -0.37 0.00 0.00 57.07 53.81 1x93 s TYR 37 Cb 0.06 -2.82 0.09 0.00 -0.40 0.00 0.00 41.96 38.90 1x93 s TYR 37 CO 0.05 -0.73 0.71 1.19 -1.57 0.00 0.00 175.55 175.20 1x93 n PHE 38 N 3.03 -2.70 -4.20 2.71 3.01 -1.26 -5.17 117.46 112.89 1x93 n PHE 38 Ca 0.06 -1.56 -0.12 0.00 1.01 0.00 0.00 57.45 56.84 1x93 n PHE 38 Cb 0.32 -0.50 -0.10 0.00 -0.01 0.00 0.00 39.48 39.19 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 -4.03 0.49 0.17 4.37 0.01 -1.26 -5.04 113.70 108.42 1x93 s SER 39 Ca 0.50 -1.28 -0.20 0.00 1.31 0.00 0.00 55.95 56.28 1x93 s SER 39 Cb -0.03 0.28 0.10 0.00 0.21 0.00 0.00 66.02 66.58 1x93 s SER 39 CO 0.33 -0.74 1.62 0.44 0.41 0.00 0.00 173.24 175.29 1x93 h ASP 40 N 2.70 -0.83 0.02 2.44 5.19 -2.02 -0.83 116.42 123.09 1x93 h ASP 40 Ca -0.36 0.18 0.03 0.00 -0.62 0.00 0.00 57.03 56.25 1x93 h ASP 40 Cb 1.22 0.43 -0.04 0.00 0.18 0.00 0.00 39.33 41.12 1x93 h ASP 40 CO 0.58 -0.27 -0.20 -0.33 -3.12 0.00 0.00 179.24 175.90 1x93 h GLU 41 N -0.16 -0.33 -0.77 3.56 4.39 -1.98 0.11 114.58 119.41 1x93 h GLU 41 Ca 0.20 0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.94 1x93 h GLU 41 Cb 0.48 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.17 1x93 h GLU 41 CO -0.53 -0.22 0.51 1.96 -1.16 0.00 0.00 179.01 179.57 1x93 h GLN 42 N -0.34 0.98 -0.00 2.33 7.50 -1.78 -0.14 115.11 123.66 1x93 h GLN 42 Ca 0.05 -0.06 -0.00 0.00 0.50 0.00 0.00 58.65 59.14 1x93 h GLN 42 Cb 0.40 -0.22 -0.00 0.00 0.05 0.00 0.00 27.48 27.71 1x93 h GLN 42 CO -0.17 0.65 -0.00 -0.92 -1.50 0.00 0.00 178.83 176.88 1x93 h TYR 43 N 1.01 0.01 -0.21 2.96 5.03 -0.90 -3.21 116.97 121.67 1x93 h TYR 43 Ca 0.29 -0.00 -0.08 0.00 2.58 0.00 0.00 58.73 61.51 1x93 h TYR 43 Cb -0.08 -0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.18 1x93 h TYR 43 CO -0.00 0.47 -0.24 1.96 -1.32 0.00 0.00 178.16 179.03 1x93 h GLN 44 N -0.45 0.38 -0.64 1.82 7.50 -0.39 0.35 115.11 123.67 1x93 h GLN 44 Ca 0.00 -0.13 -0.03 0.00 0.50 0.00 0.00 58.65 58.99 1x93 h GLN 44 Cb 0.46 -0.03 -0.03 0.00 0.05 0.00 0.00 27.48 27.94 1x93 h GLN 44 CO 0.00 0.60 0.26 0.87 -1.50 0.00 0.00 178.83 179.06 1x93 h LYS 45 N 0.34 0.94 -0.01 1.46 1.57 -1.15 0.83 116.57 120.55 1x93 h LYS 45 Ca 0.05 -0.15 -0.21 0.00 -1.87 0.00 0.00 60.65 58.48 1x93 h LYS 45 Cb 0.60 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 1x93 h LYS 45 CO 0.04 0.76 -0.89 -0.07 -0.57 0.00 0.00 179.45 178.73 1x93 h LEU 46 N 0.92 0.42 -0.73 2.94 3.38 -1.36 -2.82 115.31 118.06 1x93 h LEU 46 Ca 0.22 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 1x93 h LEU 46 Cb 0.17 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1x93 h LEU 46 CO -0.02 1.12 0.23 -0.08 0.09 0.00 0.00 178.44 179.78 1x93 h GLU 47 N 0.19 1.14 -0.54 1.13 4.81 -0.80 -0.09 114.58 120.42 1x93 h GLU 47 Ca -0.06 -0.24 -0.06 0.00 -0.13 0.00 0.00 59.36 58.86 1x93 h GLU 47 Cb 1.51 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.70 1x93 h GLU 47 CO 0.15 0.97 0.08 -0.22 -0.73 0.00 0.00 179.01 179.26 1x93 h LYS 48 N 1.09 0.86 -0.32 1.92 3.64 -0.87 -0.91 116.57 121.98 1x93 h LYS 48 Ca 0.24 -0.21 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 1x93 h LYS 48 Cb 0.30 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1x93 h LYS 48 CO -0.01 0.81 -0.11 0.52 -2.27 0.00 0.00 179.45 178.39 1x93 h MET 49 N 0.82 0.65 -0.50 1.90 2.86 -1.36 -3.23 114.93 116.08 1x93 h MET 49 Ca 0.17 -0.26 0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1x93 h MET 49 Cb 0.38 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 1x93 h MET 49 CO 0.01 0.84 0.33 0.00 1.06 0.00 0.00 176.91 179.15 1x93 h ALA 50 N 0.79 1.65 0.00 6.32 0.00 -0.57 -1.34 119.26 126.11 1x93 h ALA 50 Ca 0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1x93 h ALA 50 Cb 0.63 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1x93 h ALA 50 CO 0.04 0.33 -0.04 -0.97 0.00 0.00 0.00 179.25 178.61 1x93 h ASN 51 N 0.67 0.00 -0.56 0.00 -1.24 -1.19 0.16 115.58 113.43 1x93 h ASN 51 Ca 0.18 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 57.10 1x93 h ASN 51 Cb -0.08 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 38.95 1x93 h ASN 51 CO -0.04 0.04 0.00 -0.08 -1.29 0.00 0.00 177.43 176.06 1x93 h GLU 52 N 0.00 1.01 0.00 6.67 4.22 -1.32 -2.57 114.58 122.59 1x93 h GLU 52 Ca -0.00 -0.31 0.00 0.00 0.08 0.00 0.00 59.36 59.13 1x93 h GLU 52 Cb 0.14 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1x93 h GLU 52 CO 0.01 0.99 0.00 0.39 -2.18 0.00 0.00 179.01 178.21 1x93 n GLU 53 N -4.18 0.47 -2.61 1.92 1.02 -0.51 -4.92 120.64 111.82 1x93 n GLU 53 Ca 0.03 0.02 -0.04 0.00 -0.02 0.00 0.00 57.16 57.15 1x93 n GLU 53 Cb 0.34 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.27 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 -1.25 -1.18 -1.02 3.49 2.13 -0.52 -4.82 120.64 117.47 1x93 n GLU 54 Ca 0.14 0.14 0.00 0.00 0.66 0.00 0.00 57.16 58.10 1x93 n GLU 54 Cb 0.21 -3.13 0.00 0.00 0.27 0.00 0.00 31.44 28.79 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 -1.24 -0.29 -0.95 5.31 2.13 0.44 -4.93 120.64 121.11 1x93 n GLU 55 Ca -0.00 0.68 -0.03 0.00 0.66 0.00 0.00 57.16 58.47 1x93 n GLU 55 Cb 0.51 -0.68 -0.03 0.00 0.27 0.00 0.00 31.44 31.51 1x93 n GLU 55 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1x93 n SER 56 N 0.10 -0.36 -4.67 4.31 3.41 -1.26 -4.99 113.62 110.17 1x93 n SER 56 Ca 0.00 -1.79 -0.46 0.00 -0.26 0.00 0.00 58.87 56.36 1x93 n SER 56 Cb 0.00 0.10 -0.04 0.00 -0.26 0.00 0.00 64.21 64.01 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 0.09 0.22 0.00 -3.33 0.31 -1.26 -1.45 118.33 112.91 1x93 n VAL 57 Ca -0.14 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 1x93 n VAL 57 Cb 0.74 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.18 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 3.07 3.00 0.16 2.92 0.00 -1.26 -4.77 105.19 108.30 1x93 n GLY 58 Ca 0.16 -0.81 -0.23 0.00 0.00 0.00 0.00 46.02 45.14 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 0.04 0.79 -0.91 1.61 0.87 -1.70 -3.24 113.55 111.01 1x93 h SER 59 Ca 0.00 -0.87 0.09 0.00 -1.23 0.00 0.00 61.79 59.79 1x93 h SER 59 Cb 0.00 -0.25 -0.07 0.00 -0.44 0.00 0.00 62.40 61.64 1x93 h SER 59 CO 0.00 1.59 0.59 0.22 -0.53 0.00 0.00 176.83 178.70 1x93 h TYR 60 N 0.11 1.00 0.28 2.24 5.03 -1.62 0.15 116.97 124.17 1x93 h TYR 60 Ca -0.20 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.14 1x93 h TYR 60 Cb 1.92 -0.32 -0.03 0.00 1.55 0.00 0.00 36.73 39.84 1x93 h TYR 60 CO 0.13 0.47 -0.36 0.82 -1.32 0.00 0.00 178.16 177.90 1x93 h ILE 61 N 0.93 0.26 -0.41 1.81 2.04 -1.85 -0.37 117.51 119.93 1x93 h ILE 61 Ca 0.42 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.26 1x93 h ILE 61 Cb 0.38 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1x93 h ILE 61 CO -0.18 0.00 0.17 0.50 0.00 0.00 0.00 178.15 178.64 1x93 h LYS 62 N -0.69 0.62 -0.90 2.37 3.64 -1.44 -2.78 116.57 117.38 1x93 h LYS 62 Ca -0.01 -0.11 0.11 0.00 -1.27 0.00 0.00 60.65 59.37 1x93 h LYS 62 Cb 0.65 -0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 32.30 1x93 h LYS 62 CO -0.11 0.57 0.58 -0.09 -2.27 0.00 0.00 179.45 178.13 1x93 h ARG 63 N 0.53 0.84 -0.49 1.90 2.43 -0.76 0.08 114.38 118.90 1x93 h ARG 63 Ca 0.14 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.12 1x93 h ARG 63 Cb 0.18 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1x93 h ARG 63 CO -0.01 0.56 -0.21 -0.92 -1.51 0.00 0.00 179.97 177.87 1x93 h TYR 64 N 0.86 1.16 -0.54 2.20 5.03 -0.79 1.00 116.97 125.89 1x93 h TYR 64 Ca 0.42 -0.28 -0.11 0.00 2.58 0.00 0.00 58.73 61.34 1x93 h TYR 64 Cb 0.46 -0.27 -0.02 0.00 1.55 0.00 0.00 36.73 38.45 1x93 h TYR 64 CO -0.00 1.11 -0.09 0.82 -1.32 0.00 0.00 178.16 178.68 1x93 h ILE 65 N 0.87 1.27 -0.13 1.81 1.08 -1.26 -1.22 117.51 119.92 1x93 h ILE 65 Ca 0.11 -1.24 -0.14 0.00 -0.39 0.00 0.00 64.86 63.20 1x93 h ILE 65 Cb 0.80 0.96 -0.01 0.00 -3.07 0.00 0.00 36.82 35.50 1x93 h ILE 65 CO 0.07 0.44 -0.54 -0.07 -0.69 0.00 0.00 178.15 177.36 1x93 h LEU 66 N 0.89 0.41 -0.29 1.44 4.07 -0.78 -0.46 115.31 120.60 1x93 h LEU 66 Ca 0.14 -0.22 -0.02 0.00 0.08 0.00 0.00 57.88 57.87 1x93 h LEU 66 Cb 0.66 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.27 1x93 h LEU 66 CO 0.05 0.87 0.11 0.50 -1.08 0.00 0.00 178.44 178.89 1x93 h LYS 67 N 0.29 0.44 -0.09 1.13 3.64 -0.72 -3.10 116.57 118.16 1x93 h LYS 67 Ca 0.01 -0.08 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 1x93 h LYS 67 Cb 1.04 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 1x93 h LYS 67 CO 0.09 0.47 -0.29 0.00 -2.27 0.00 0.00 179.45 177.45 1x93 h ALA 68 N 0.95 1.35 0.00 5.00 0.00 -0.94 -3.12 119.26 122.50 1x93 h ALA 68 Ca 0.10 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1x93 h ALA 68 Cb 0.20 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1x93 h ALA 68 CO -0.01 0.45 -0.08 -0.07 0.00 0.00 0.00 179.25 179.54 1x93 h LEU 69 N 0.15 0.00 -2.18 0.00 4.07 -1.00 -1.54 115.31 114.81 1x93 h LEU 69 Ca 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.97 1x93 h LEU 69 Cb 0.59 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.33 1x93 h LEU 69 CO 0.04 0.08 -0.06 0.03 -1.08 0.00 0.00 178.44 177.45 1x93 h ARG 70 N 0.00 0.00 -0.11 1.13 3.08 -1.58 -3.37 114.38 113.53 1x93 h ARG 70 Ca -0.00 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.81 1x93 h ARG 70 Cb 0.35 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 30.23 1x93 h ARG 70 CO 0.01 0.06 -0.45 1.17 -1.07 0.00 0.00 179.97 179.70 1x93 n LYS 71 N -3.74 1.19 -0.26 0.04 4.81 -0.65 -5.02 118.16 114.53 1x93 n LYS 71 Ca -0.02 -1.98 0.07 0.00 -0.87 0.00 0.00 58.31 55.51 1x93 n LYS 71 Cb 0.16 -0.18 0.21 0.00 0.02 0.00 0.00 35.03 35.24 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 2.12 0.46 0.00 3.15 2.04 -1.55 -3.49 117.51 120.24 1x93 h ILE 72 Ca -0.26 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.51 1x93 h ILE 72 Cb 1.28 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1x93 h ILE 72 CO -0.00 0.05 0.00 1.21 0.00 0.00 0.00 178.15 179.40