#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cw5 s ASN 2 N 0.00 -1.45 0.36 6.55 0.01 -1.26 -5.08 114.94 114.06 1cw5 s ASN 2 Ca 0.00 -0.56 -0.25 0.00 -0.71 0.00 0.00 52.86 51.34 1cw5 s ASN 2 Cb 0.00 1.86 -0.10 0.00 0.41 0.00 0.00 41.25 43.42 1cw5 s ASN 2 CO 0.00 -0.18 0.96 -0.31 -1.51 0.00 0.00 177.10 176.06 1cw5 s TYR 3 N 2.04 3.55 0.00 2.20 2.02 -1.26 -1.99 117.35 123.91 1cw5 s TYR 3 Ca 0.15 1.73 0.00 0.00 -0.37 0.00 0.00 57.07 58.58 1cw5 s TYR 3 Cb -0.04 -2.93 0.00 0.00 -0.40 0.00 0.00 41.96 38.59 1cw5 s TYR 3 CO -0.11 0.04 0.00 0.41 -1.57 0.00 0.00 175.55 174.32 1cw5 n GLY 4 N 0.25 1.55 0.08 0.71 0.00 -1.26 -4.53 105.19 102.00 1cw5 n GLY 4 Ca 0.03 -0.64 -0.15 0.00 0.00 0.00 0.00 46.02 45.26 1cw5 n GLY 4 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1cw5 h ASN 5 N 0.00 0.15 0.12 1.61 2.35 -2.04 -3.40 115.58 114.36 1cw5 h ASN 5 Ca 0.00 -0.90 -0.00 0.00 -0.55 0.00 0.00 56.30 54.85 1cw5 h ASN 5 Cb 0.00 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.32 1cw5 h ASN 5 CO 0.00 1.03 -0.11 1.23 -1.65 0.00 0.00 177.43 177.93 1cw5 h GLY 6 N -0.71 -0.79 -5.53 2.83 0.00 -1.64 -3.41 103.07 93.82 1cw5 h GLY 6 Ca -0.03 0.35 -0.58 0.00 0.00 0.00 0.00 47.33 47.07 1cw5 h GLY 6 CO 0.04 -0.28 0.08 0.54 0.00 0.00 0.00 176.54 176.92 1cw5 s VAL 7 N -3.63 5.05 -1.20 4.60 0.11 -1.07 -4.98 120.40 119.28 1cw5 s VAL 7 Ca -0.04 1.26 -0.20 0.00 -2.93 0.00 0.00 61.98 60.07 1cw5 s VAL 7 Cb 0.01 -3.97 0.04 0.00 -1.53 0.00 0.00 36.38 30.93 1cw5 s VAL 7 CO 0.13 0.19 1.71 -0.55 -3.33 0.00 0.00 175.10 173.26 1cw5 s SER 8 N 0.95 6.41 0.11 3.54 0.15 -1.26 -4.12 113.70 119.48 1cw5 s SER 8 Ca 0.32 -2.02 -0.17 0.00 0.70 0.00 0.00 55.95 54.78 1cw5 s SER 8 Cb -0.16 -2.58 -0.04 0.00 -1.71 0.00 0.00 66.02 61.52 1cw5 s SER 8 CO 0.13 -1.61 1.60 0.00 1.20 0.00 0.00 173.24 174.56 1cw5 n SER 10 N -4.63 0.00 0.00 0.00 3.41 -1.26 -3.13 113.62 108.01 1cw5 n SER 10 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 1cw5 n SER 10 Cb 0.20 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 1cw5 n SER 10 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1cw5 n LYS 11 N 0.00 0.00 -2.87 4.33 4.76 -1.26 -5.04 118.16 118.07 1cw5 n LYS 11 Ca 0.00 0.00 -0.44 0.00 -2.87 0.00 0.00 58.31 55.00 1cw5 n LYS 11 Cb 0.00 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.17 1cw5 n LYS 11 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1cw5 s THR 12 N -0.38 4.70 0.05 -0.18 2.01 -1.18 -4.94 115.64 115.72 1cw5 s THR 12 Ca 0.00 -1.84 0.00 0.00 0.31 0.00 0.00 61.69 60.16 1cw5 s THR 12 Cb 0.00 -4.87 0.00 0.00 0.01 0.00 0.00 72.50 67.64 1cw5 s THR 12 CO 0.00 -1.62 0.00 2.29 -0.69 0.00 0.00 174.62 174.60 1cw5 n LYS 13 N 6.62 -0.42 0.00 4.92 0.00 -1.26 -4.99 118.16 123.03 1cw5 n LYS 13 Ca 0.30 0.28 0.00 0.00 -0.00 0.00 0.00 58.31 58.89 1cw5 n LYS 13 Cb 0.47 -0.51 0.00 0.00 -0.00 0.00 0.00 35.03 34.99 1cw5 n LYS 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1cw5 s SER 15 N 1.00 6.14 -0.28 0.00 0.15 -1.26 -5.06 113.70 114.39 1cw5 s SER 15 Ca 0.00 1.86 -0.17 0.00 0.70 0.00 0.00 55.95 58.34 1cw5 s SER 15 Cb 0.00 -2.55 0.11 0.00 -1.71 0.00 0.00 66.02 61.88 1cw5 s SER 15 CO 0.00 -0.92 0.86 0.54 1.20 0.00 0.00 173.24 174.92 1cw5 s VAL 16 N -2.21 0.00 0.39 4.45 0.11 -1.26 -5.11 120.40 116.77 1cw5 s VAL 16 Ca 0.65 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 59.43 1cw5 s VAL 16 Cb -0.16 -1.00 -0.10 0.00 -1.53 0.00 0.00 36.38 33.59 1cw5 s VAL 16 CO 0.27 0.00 1.43 0.21 -3.33 0.00 0.00 175.10 173.69 1cw5 s ASN 17 N 1.28 6.28 -1.50 3.54 3.84 -1.26 -1.98 114.94 125.15 1cw5 s ASN 17 Ca -0.08 2.94 -0.04 0.00 0.21 0.00 0.00 52.86 55.89 1cw5 s ASN 17 Cb -0.04 -2.66 0.02 0.00 -0.55 0.00 0.00 41.25 38.01 1cw5 s ASN 17 CO -0.15 -0.90 0.43 1.87 -2.79 0.00 0.00 177.10 175.56 1cw5 n TRP 18 N 0.31 -1.73 -0.10 0.43 -0.00 -1.26 -4.86 117.44 110.24 1cw5 n TRP 18 Ca 0.02 0.38 -0.16 0.00 -0.00 0.00 0.00 57.50 57.74 1cw5 n TRP 18 Cb 0.41 -3.97 -0.08 0.00 -0.00 0.00 0.00 31.31 27.66 1cw5 n TRP 18 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1cw5 n GLY 19 N -1.31 -0.29 0.28 5.87 0.00 -0.84 -3.81 105.19 105.10 1cw5 n GLY 19 Ca -0.12 -0.12 -0.08 0.00 0.00 0.00 0.00 46.02 45.70 1cw5 n GLY 19 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1cw5 h GLN 20 N -0.22 0.97 0.30 1.61 5.75 -1.89 0.73 115.11 122.35 1cw5 h GLN 20 Ca -0.46 -0.24 -0.01 0.00 -0.15 0.00 0.00 58.65 57.79 1cw5 h GLN 20 Cb 1.60 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 30.03 1cw5 h GLN 20 CO -0.14 0.89 -0.14 0.00 -2.65 0.00 0.00 178.83 176.79 1cw5 h ALA 21 N 1.04 -0.61 -0.55 3.38 0.00 -1.95 -1.91 119.26 118.66 1cw5 h ALA 21 Ca 0.19 -0.09 0.14 0.00 0.00 0.00 0.00 54.91 55.15 1cw5 h ALA 21 Cb 0.36 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1cw5 h ALA 21 CO 0.00 -0.58 0.39 0.35 0.00 0.00 0.00 179.25 179.41 1cw5 h PHE 22 N -0.69 0.15 0.08 0.00 3.57 -1.66 0.13 116.94 118.53 1cw5 h PHE 22 Ca -0.04 0.00 -0.25 0.00 3.53 0.00 0.00 57.97 61.21 1cw5 h PHE 22 Cb 0.31 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.00 1cw5 h PHE 22 CO 0.05 0.06 -1.13 0.37 -2.23 0.00 0.00 178.31 175.43 1cw5 h GLN 23 N 0.13 0.27 0.00 1.11 4.15 -0.91 0.18 115.11 120.05 1cw5 h GLN 23 Ca 0.26 -0.41 -0.13 0.00 0.77 0.00 0.00 58.65 59.14 1cw5 h GLN 23 Cb 0.87 0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.68 1cw5 h GLN 23 CO -0.03 1.16 -0.64 1.49 -1.93 0.00 0.00 178.83 178.87 1cw5 h GLU 24 N 0.10 0.00 0.00 1.69 4.57 -0.36 -1.49 114.58 119.09 1cw5 h GLU 24 Ca -0.11 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.07 1cw5 h GLU 24 Cb 1.83 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 30.42 1cw5 h GLU 24 CO 0.18 0.64 -0.02 -0.09 -1.18 0.00 0.00 179.01 178.55 1cw5 h ARG 25 N 0.00 0.00 0.41 1.92 1.12 -0.79 -3.24 114.38 113.80 1cw5 h ARG 25 Ca -0.01 0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 58.84 1cw5 h ARG 25 Cb 1.17 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.14 1cw5 h ARG 25 CO 0.08 0.29 -0.19 0.10 -3.11 0.00 0.00 179.97 177.14 1cw5 h TYR 26 N -1.00 -0.51 -0.91 2.20 -0.00 -1.05 -2.89 116.97 112.81 1cw5 h TYR 26 Ca -0.00 -0.01 0.11 0.00 0.00 0.00 0.00 58.73 58.82 1cw5 h TYR 26 Cb 0.30 0.17 -0.08 0.00 0.00 0.00 0.00 36.73 37.12 1cw5 h TYR 26 CO 0.08 -0.20 0.55 1.15 -0.00 0.00 0.00 178.16 179.73 1cw5 h THR 27 N -1.03 0.91 -0.51 -0.90 2.02 -1.43 0.20 112.91 112.17 1cw5 h THR 27 Ca -0.06 -0.30 0.05 0.00 0.77 0.00 0.00 66.41 66.87 1cw5 h THR 27 Cb 0.53 -0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 66.84 1cw5 h THR 27 CO 0.09 0.16 0.25 0.00 0.37 0.00 0.00 175.52 176.40 1cw5 h ALA 28 N 1.50 0.65 0.04 6.16 0.00 -1.62 0.35 119.26 126.34 1cw5 h ALA 28 Ca 0.45 0.02 -0.20 0.00 0.00 0.00 0.00 54.91 55.18 1cw5 h ALA 28 Cb 0.42 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.17 1cw5 h ALA 28 CO -0.26 -0.10 -0.82 0.78 0.00 0.00 0.00 179.25 178.86 1cw5 h GLY 29 N 0.49 0.54 1.89 0.00 0.00 -1.10 -2.95 103.07 101.93 1cw5 h GLY 29 Ca 0.23 -1.03 -0.13 0.00 0.00 0.00 0.00 47.33 46.40 1cw5 h GLY 29 CO -0.16 0.90 -0.55 1.19 0.00 0.00 0.00 176.54 177.92 1cw5 h ILE 30 N -0.00 1.38 -0.12 2.60 6.09 -0.55 -2.61 117.51 124.31 1cw5 h ILE 30 Ca -0.11 -1.87 -0.10 0.00 -1.37 0.00 0.00 64.86 61.40 1cw5 h ILE 30 Cb 1.53 1.96 0.00 0.00 0.47 0.00 0.00 36.82 40.79 1cw5 h ILE 30 CO 0.16 0.54 -0.32 -1.13 -3.07 0.00 0.00 178.15 174.33 1cw5 h ASN 31 N 0.09 0.49 -0.46 2.19 -1.24 -0.39 -3.16 115.58 113.09 1cw5 h ASN 31 Ca -0.00 -0.59 -0.03 0.00 0.71 0.00 0.00 56.30 56.38 1cw5 h ASN 31 Cb 1.00 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.88 1cw5 h ASN 31 CO 0.08 0.99 0.18 0.77 -1.29 0.00 0.00 177.43 178.16 1cw5 h SER 32 N 0.00 0.69 -0.63 1.15 4.64 -1.52 -2.25 113.55 115.63 1cw5 h SER 32 Ca -0.01 -0.09 0.04 0.00 -0.47 0.00 0.00 61.79 61.25 1cw5 h SER 32 Cb 0.94 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.82 1cw5 h SER 32 CO 0.07 0.65 0.42 0.15 -0.87 0.00 0.00 176.83 177.24 1cw5 h PHE 33 N 0.74 0.71 0.32 4.77 3.57 -1.46 -0.63 116.94 124.96 1cw5 h PHE 33 Ca 0.17 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 1cw5 h PHE 33 Cb 0.19 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.70 1cw5 h PHE 33 CO 0.01 0.41 -0.15 0.28 -2.23 0.00 0.00 178.31 176.63 1cw5 h VAL 34 N 0.73 0.00 -0.99 1.41 2.07 -1.38 -2.71 116.25 115.38 1cw5 h VAL 34 Ca 0.26 -0.37 0.21 0.00 0.82 0.00 0.00 66.70 67.62 1cw5 h VAL 34 Cb 0.10 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 29.78 1cw5 h VAL 34 CO -0.07 0.00 0.62 0.28 0.02 0.00 0.00 177.57 178.42 1cw5 h SER 35 N -0.80 0.63 -0.54 0.57 0.02 -1.45 1.01 113.55 112.98 1cw5 h SER 35 Ca -0.04 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1cw5 h SER 35 Cb 0.33 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 1cw5 h SER 35 CO 0.07 0.20 0.35 1.23 -1.14 0.00 0.00 176.83 177.54 1cw5 h GLY 36 N 0.60 0.77 1.96 -3.77 0.00 -1.16 0.38 103.07 101.85 1cw5 h GLY 36 Ca 0.57 -0.30 -0.14 0.00 0.00 0.00 0.00 47.33 47.45 1cw5 h GLY 36 CO -0.33 0.29 -0.69 -0.39 0.00 0.00 0.00 176.54 175.42 1cw5 h VAL 37 N 0.73 1.12 0.00 4.60 -1.51 -0.52 -3.25 116.25 117.42 1cw5 h VAL 37 Ca 0.20 -2.59 -0.02 0.00 -1.23 0.00 0.00 66.70 63.06 1cw5 h VAL 37 Cb -0.06 2.55 -0.00 0.00 -2.13 0.00 0.00 31.29 31.65 1cw5 h VAL 37 CO -0.04 0.64 -0.12 0.00 -1.23 0.00 0.00 177.57 176.82 1cw5 h ALA 38 N 1.34 0.93 -0.24 5.19 0.00 0.14 -3.11 119.26 123.51 1cw5 h ALA 38 Ca -0.01 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1cw5 h ALA 38 Cb 1.52 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 1cw5 h ALA 38 CO 0.08 0.10 0.12 1.03 0.00 0.00 0.00 179.25 180.58 1cw5 h SER 39 N 0.00 0.29 0.00 0.00 0.87 -0.28 -3.44 113.55 110.98 1cw5 h SER 39 Ca -0.00 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 1cw5 h SER 39 Cb 1.06 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 1cw5 h SER 39 CO 0.01 0.25 0.00 0.61 -0.53 0.00 0.00 176.83 177.17 1cw5 n GLY 40 N -1.39 -0.04 0.24 5.77 0.00 -1.23 -5.01 105.19 103.53 1cw5 n GLY 40 Ca 0.01 -0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 1cw5 n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cw5 h ALA 41 N 0.00 0.77 0.00 4.61 0.00 -1.75 -2.71 119.26 120.18 1cw5 h ALA 41 Ca 0.00 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.39 1cw5 h ALA 41 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1cw5 h ALA 41 CO 0.00 0.66 -1.99 0.41 0.00 0.00 0.00 179.25 178.33 1cw5 n GLY 42 N 0.04 -0.91 0.26 0.00 0.00 -1.26 -3.67 105.19 99.63 1cw5 n GLY 42 Ca -0.02 -0.44 -0.16 0.00 0.00 0.00 0.00 46.02 45.41 1cw5 n GLY 42 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1cw5 h SER 43 N 0.00 -0.50 0.00 1.61 0.87 -1.94 -3.42 113.55 110.17 1cw5 h SER 43 Ca -0.11 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1cw5 h SER 43 Cb 1.18 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 1cw5 h SER 43 CO 0.01 -0.30 -0.67 0.00 -0.53 0.00 0.00 176.83 175.33 1cw5 n ILE 44 N -5.32 0.00 -1.84 2.23 3.06 -1.21 -5.02 119.36 111.27 1cw5 n ILE 44 Ca -0.11 0.00 -0.15 0.00 -2.50 0.00 0.00 62.75 59.99 1cw5 n ILE 44 Cb 0.26 -1.07 -0.04 0.00 0.54 0.00 0.00 39.64 39.33 1cw5 n ILE 44 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1cw5 n GLY 45 N 2.54 0.62 0.12 4.50 0.00 -1.03 -4.83 105.19 107.11 1cw5 n GLY 45 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1cw5 n GLY 45 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1cw5 h ARG 46 N 0.00 0.18 0.00 1.61 1.12 -1.90 -3.39 114.38 112.00 1cw5 h ARG 46 Ca -0.32 -0.32 -0.00 0.00 -1.11 0.00 0.00 59.98 58.23 1cw5 h ARG 46 Cb 1.08 0.12 0.00 0.00 -0.01 0.00 0.00 29.97 31.16 1cw5 h ARG 46 CO 0.43 1.15 -0.00 0.00 -3.11 0.00 0.00 179.97 178.44 1cw5 h ARG 47 N -0.45 -0.00 0.00 0.20 2.47 -1.95 -3.56 114.38 111.08 1cw5 h ARG 47 Ca -0.30 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.42 1cw5 h ARG 47 Cb 1.64 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.96 1cw5 h ARG 47 CO 0.01 0.75 0.00 -0.35 0.56 0.00 0.00 179.97 180.94