#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u57 n GLU 2 N 0.00 3.06 0.00 3.23 4.71 -1.26 -4.77 120.64 125.61 1u57 n GLU 2 Ca 0.00 -2.81 0.00 0.00 -0.01 0.00 0.00 57.16 54.34 1u57 n GLU 2 Cb 0.00 -3.19 0.00 0.00 -1.01 0.00 0.00 31.44 27.24 1u57 n GLU 2 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 1u57 n GLU 3 N 5.50 0.78 -0.23 3.49 0.28 -1.26 -3.52 120.64 125.68 1u57 n GLU 3 Ca 0.50 0.00 -0.05 0.00 -0.16 0.00 0.00 57.16 57.45 1u57 n GLU 3 Cb 0.38 -1.13 0.11 0.00 1.43 0.00 0.00 31.44 32.23 1u57 n GLU 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1u57 h MET 4 N 0.07 1.07 -0.00 3.44 -0.00 -1.99 -0.79 114.93 116.73 1u57 h MET 4 Ca 0.00 -0.21 -0.08 0.00 -0.00 0.00 0.00 59.70 59.41 1u57 h MET 4 Cb 0.13 -0.16 -0.01 0.00 -0.00 0.00 0.00 31.60 31.55 1u57 h MET 4 CO 0.00 0.90 -0.38 0.52 -0.00 0.00 0.00 176.91 177.95 1u57 h MET 5 N 1.03 0.00 -0.12 -0.10 2.86 -1.88 -0.38 114.93 116.34 1u57 h MET 5 Ca 0.23 -0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.72 1u57 h MET 5 Cb 0.26 -0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.93 1u57 h MET 5 CO -0.01 0.38 -0.50 1.15 1.06 0.00 0.00 176.91 178.99 1u57 h THR 6 N 0.00 1.35 0.05 2.22 2.02 -1.70 -3.27 112.91 113.59 1u57 h THR 6 Ca -0.00 -1.79 -0.00 0.00 0.77 0.00 0.00 66.41 65.38 1u57 h THR 6 Cb 0.66 2.12 0.00 0.00 -1.74 0.00 0.00 68.15 69.20 1u57 h THR 6 CO 0.05 0.54 -0.02 0.00 0.37 0.00 0.00 175.52 176.46 1u57 h ALA 7 N 0.50 -0.74 -0.84 6.16 0.00 -0.76 -3.34 119.26 120.25 1u57 h ALA 7 Ca -0.03 -0.01 -0.76 0.00 0.00 0.00 0.00 54.91 54.11 1u57 h ALA 7 Cb 1.13 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.77 1u57 h ALA 7 CO 0.10 -0.73 1.90 0.00 0.00 0.00 0.00 179.25 180.52 1u57 n GLN 9 N 1.09 3.01 0.34 0.00 7.27 -1.23 -4.70 117.38 123.15 1u57 n GLN 9 Ca 0.57 -2.79 -0.14 0.00 0.07 0.00 0.00 57.00 54.71 1u57 n GLN 9 Cb 0.26 -3.22 -0.07 0.00 2.41 0.00 0.00 30.24 29.62 1u57 n GLN 9 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 1u57 h GLY 10 N 9.61 -0.93 -6.70 1.69 0.00 -1.90 -3.47 103.07 101.38 1u57 h GLY 10 Ca 0.53 0.35 -0.54 0.00 0.00 0.00 0.00 47.33 47.67 1u57 h GLY 10 CO 1.83 -0.34 -0.85 1.55 0.00 0.00 0.00 176.54 178.73 1u57 n VAL 11 N -5.26 -1.55 -0.85 4.60 3.14 -1.26 -4.86 118.33 112.29 1u57 n VAL 11 Ca -0.11 -0.15 -0.21 0.00 -2.96 0.00 0.00 64.34 60.90 1u57 n VAL 11 Cb 0.35 -1.91 0.10 0.00 -1.06 0.00 0.00 33.84 31.32 1u57 n VAL 11 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1u57 n GLY 12 N -1.60 4.36 3.85 7.55 0.00 -1.26 -4.97 105.19 113.12 1u57 n GLY 12 Ca -0.04 -1.20 -0.31 0.00 0.00 0.00 0.00 46.02 44.47 1u57 n GLY 12 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1u57 s GLY 13 N -0.76 1.66 0.00 -0.02 0.00 -1.26 -5.04 107.32 101.90 1u57 s GLY 13 Ca 0.45 -0.08 0.00 0.00 0.00 0.00 0.00 44.72 45.08 1u57 s GLY 13 CO 0.04 0.22 0.60 -1.55 0.00 0.00 0.00 173.10 172.41 1u57 n PRO 14 N -2.93 0.00 0.00 2.90 -0.04 -1.26 -4.86 135.00 128.81 1u57 n PRO 14 Ca 0.07 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.76 1u57 n PRO 14 Cb 0.54 -1.14 0.00 0.00 -0.04 0.00 0.00 33.50 32.86 1u57 n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1u57 n GLY 15 N -0.18 1.47 0.00 0.55 0.00 -1.26 -3.64 105.19 102.13 1u57 n GLY 15 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1u57 n GLY 15 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1u57 n HIS 16 N 0.00 0.00 0.25 1.61 -0.00 -1.26 -4.36 115.22 111.46 1u57 n HIS 16 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.80 1u57 n HIS 16 Cb 0.00 0.00 0.63 0.00 -0.00 0.00 0.00 29.99 30.62 1u57 n HIS 16 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.34 176.12 1u57 h LYS 17 N 0.00 0.00 -0.53 1.57 1.63 -1.93 0.11 116.57 117.42 1u57 h LYS 17 Ca 0.00 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.72 1u57 h LYS 17 Cb 0.75 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.36 1u57 h LYS 17 CO 0.00 0.07 0.03 0.00 -3.45 0.00 0.00 179.45 176.10 1u57 h ALA 18 N 1.93 0.71 -0.18 5.00 0.00 -1.83 -0.40 119.26 124.49 1u57 h ALA 18 Ca -0.00 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 54.46 1u57 h ALA 18 Cb 0.12 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1u57 h ALA 18 CO 0.01 0.50 -0.58 -0.09 0.00 0.00 0.00 179.25 179.09 1u57 h ARG 19 N 0.79 0.59 -0.37 0.00 2.43 -1.27 -0.49 114.38 116.07 1u57 h ARG 19 Ca 0.15 -0.39 -0.05 0.00 -0.81 0.00 0.00 59.98 58.88 1u57 h ARG 19 Cb 0.48 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 1u57 h ARG 19 CO 0.02 1.01 0.03 0.28 -1.51 0.00 0.00 179.97 179.80 1u57 h VAL 20 N 0.45 1.25 0.35 0.20 2.07 -0.80 -1.25 116.25 118.52 1u57 h VAL 20 Ca 0.00 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 1u57 h VAL 20 Cb 1.14 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 1u57 h VAL 20 CO 0.11 0.31 -0.23 0.25 0.02 0.00 0.00 177.57 178.03 1u57 h LEU 21 N 0.46 -0.60 -0.95 2.57 5.85 -0.98 -1.42 115.31 120.25 1u57 h LEU 21 Ca 0.11 0.04 0.20 0.00 0.84 0.00 0.00 57.88 59.07 1u57 h LEU 21 Cb 0.41 0.18 -0.11 0.00 0.37 0.00 0.00 40.66 41.51 1u57 h LEU 21 CO 0.01 -0.37 0.52 0.00 -0.34 0.00 0.00 178.44 178.26 1u57 h ALA 22 N 0.04 1.57 -0.25 1.25 0.00 -0.96 0.31 119.26 121.23 1u57 h ALA 22 Ca -0.03 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1u57 h ALA 22 Cb 0.48 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1u57 h ALA 22 CO 0.02 -0.19 0.11 1.49 0.00 0.00 0.00 179.25 180.68 1u57 h GLU 23 N 0.60 0.37 -0.31 0.00 4.81 -0.92 -1.38 114.58 117.75 1u57 h GLU 23 Ca 0.57 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.65 1u57 h GLU 23 Cb 0.98 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 1u57 h GLU 23 CO -0.44 0.38 -0.21 0.00 -0.73 0.00 0.00 179.01 178.01 1u57 h ALA 24 N 0.97 1.05 0.00 2.92 0.00 0.06 -0.38 119.26 123.88 1u57 h ALA 24 Ca 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1u57 h ALA 24 Cb 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1u57 h ALA 24 CO -0.01 0.57 0.00 -1.33 0.00 0.00 0.00 179.25 178.48 1u57 n MET 25 N -4.13 0.95 -0.00 0.00 2.81 0.93 -0.45 117.12 117.23 1u57 n MET 25 Ca 0.00 0.00 0.05 0.00 -1.81 0.00 0.00 57.70 55.94 1u57 n MET 25 Cb 0.40 -1.43 -0.06 0.00 -0.71 0.00 0.00 33.22 31.41 1u57 n MET 25 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1u57 n SER 26 N -0.93 1.14 -0.13 7.83 7.64 -0.54 -4.42 113.62 124.21 1u57 n SER 26 Ca 0.20 -0.51 -0.25 0.00 1.01 0.00 0.00 58.87 59.32 1u57 n SER 26 Cb 0.09 1.13 -0.10 0.00 -1.01 0.00 0.00 64.21 64.33 1u57 n SER 26 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1u57 n GLN 27 N -1.40 0.55 0.05 1.43 7.27 -0.26 -3.94 117.38 121.07 1u57 n GLN 27 Ca 0.01 0.21 -0.13 0.00 0.07 0.00 0.00 57.00 57.16 1u57 n GLN 27 Cb 0.18 -1.42 -0.09 0.00 2.41 0.00 0.00 30.24 31.32 1u57 n GLN 27 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1u57 h VAL 28 N -0.69 1.09 -0.75 1.69 2.07 -1.02 -0.56 116.25 118.08 1u57 h VAL 28 Ca -0.62 -0.87 0.15 0.00 0.82 0.00 0.00 66.70 66.18 1u57 h VAL 28 Cb 1.63 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 32.98 1u57 h VAL 28 CO -0.32 0.21 0.50 0.74 0.02 0.00 0.00 177.57 178.72 1u57 h THR 29 N -0.56 0.80 -0.13 2.57 2.02 -1.77 0.01 112.91 115.86 1u57 h THR 29 Ca -0.01 -0.15 -0.11 0.00 0.77 0.00 0.00 66.41 66.91 1u57 h THR 29 Cb 0.45 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1u57 h THR 29 CO 0.02 0.08 -0.35 -1.13 0.37 0.00 0.00 175.52 174.51 1u57 h ASN 30 N 0.43 0.52 -0.01 4.18 -1.24 -1.61 0.96 115.58 118.80 1u57 h ASN 30 Ca 0.37 -0.59 0.00 0.00 0.71 0.00 0.00 56.30 56.79 1u57 h ASN 30 Cb 0.83 -0.15 -0.00 0.00 0.73 0.00 0.00 38.32 39.72 1u57 h ASN 30 CO -0.12 1.02 0.01 -1.28 -1.29 0.00 0.00 177.43 175.77 1u57 h SER 31 N 0.05 0.00 0.82 1.15 0.87 0.17 -0.02 113.55 116.59 1u57 h SER 31 Ca -0.01 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.33 1u57 h SER 31 Cb 0.96 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.89 1u57 h SER 31 CO 0.08 0.00 -1.27 0.00 -0.53 0.00 0.00 176.83 175.10 1u57 h ALA 32 N 1.99 0.59 -0.33 6.23 0.00 -0.95 -3.28 119.26 123.51 1u57 h ALA 32 Ca 0.01 -1.07 -0.03 0.00 0.00 0.00 0.00 54.91 53.81 1u57 h ALA 32 Cb 0.03 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1u57 h ALA 32 CO -0.00 1.28 0.08 0.00 0.00 0.00 0.00 179.25 180.61 1u57 h THR 33 N 0.00 1.16 -0.41 0.00 1.03 0.95 -0.08 112.91 115.56 1u57 h THR 33 Ca -0.13 -0.55 -0.01 0.00 -0.01 0.00 0.00 66.41 65.71 1u57 h THR 33 Cb 1.80 0.82 -0.02 0.00 -1.07 0.00 0.00 68.15 69.69 1u57 h THR 33 CO 0.09 0.20 0.23 0.40 -0.01 0.00 0.00 175.52 176.43 1u57 h ILE 34 N 0.47 1.13 -0.17 0.00 1.08 -1.18 -0.46 117.51 118.38 1u57 h ILE 34 Ca 0.11 -0.32 -0.20 0.00 -0.39 0.00 0.00 64.86 64.07 1u57 h ILE 34 Cb 0.19 0.57 0.01 0.00 -3.07 0.00 0.00 36.82 34.52 1u57 h ILE 34 CO -0.00 0.14 -0.67 0.24 -0.69 0.00 0.00 178.15 177.16 1u57 h MET 35 N 0.56 0.75 -0.03 2.37 2.86 -1.11 0.83 114.93 121.16 1u57 h MET 35 Ca 0.15 -0.58 -0.00 0.00 -2.06 0.00 0.00 59.70 57.20 1u57 h MET 35 Cb 0.01 0.11 -0.00 0.00 0.06 0.00 0.00 31.60 31.78 1u57 h MET 35 CO -0.03 1.20 0.02 0.52 1.06 0.00 0.00 176.91 179.68 1u57 h MET 36 N 0.47 0.05 -0.85 1.72 2.86 -1.04 -2.18 114.93 115.95 1u57 h MET 36 Ca -0.04 -0.01 0.12 0.00 -2.06 0.00 0.00 59.70 57.72 1u57 h MET 36 Cb 1.30 -0.01 -0.08 0.00 0.06 0.00 0.00 31.60 32.87 1u57 h MET 36 CO 0.14 0.12 0.48 0.37 1.06 0.00 0.00 176.91 179.07 1u57 h GLN 37 N -0.04 0.72 -2.00 1.72 4.15 -1.10 -1.95 115.11 116.63 1u57 h GLN 37 Ca 0.01 -0.04 -0.13 0.00 0.77 0.00 0.00 58.65 59.26 1u57 h GLN 37 Cb 0.09 -0.16 -0.05 0.00 0.21 0.00 0.00 27.48 27.57 1u57 h GLN 37 CO -0.00 0.48 -0.25 0.54 -1.93 0.00 0.00 178.83 177.67 1u57 n ARG 38 N -4.78 1.66 0.12 1.69 3.00 0.28 -2.41 116.66 116.22 1u57 n ARG 38 Ca 0.15 -0.66 0.00 0.00 -0.01 0.00 0.00 57.85 57.33 1u57 n ARG 38 Cb 0.35 -1.66 0.00 0.00 0.00 0.00 0.00 32.46 31.15 1u57 n ARG 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1u57 n GLY 39 N 2.15 -0.28 2.46 -0.13 0.00 -0.73 -4.47 105.19 104.18 1u57 n GLY 39 Ca 0.28 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.90 1u57 n GLY 39 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1u57 n ASN 40 N -3.38 7.77 0.01 1.61 5.15 -1.01 -1.64 115.26 123.77 1u57 n ASN 40 Ca 0.00 -2.86 0.00 0.00 -0.60 0.00 0.00 54.58 51.12 1u57 n ASN 40 Cb 0.00 -1.49 0.00 0.00 -0.53 0.00 0.00 39.78 37.76 1u57 n ASN 40 CO 0.00 0.00 0.00 0.33 1.40 0.00 0.00 177.26 178.99 1u57 n PHE 41 N 3.11 -0.83 -0.17 1.20 -0.00 -1.22 -4.84 117.46 114.71 1u57 n PHE 41 Ca 0.67 0.05 -0.06 0.00 -0.00 0.00 0.00 57.45 58.11 1u57 n PHE 41 Cb 0.26 0.26 0.04 0.00 -0.00 0.00 0.00 39.48 40.04 1u57 n PHE 41 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 1u57 h ARG 42 N 0.00 0.58 -0.09 -4.13 2.43 -1.72 -0.10 114.38 111.35 1u57 h ARG 42 Ca 0.00 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1u57 h ARG 42 Cb 0.00 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.42 1u57 h ARG 42 CO 0.00 0.38 -0.01 -0.97 -1.51 0.00 0.00 179.97 177.86 1u57 h ASN 43 N 0.59 0.16 0.03 -3.80 -0.73 -1.66 -3.33 115.58 106.83 1u57 h ASN 43 Ca 0.20 -0.33 0.02 0.00 1.87 0.00 0.00 56.30 58.06 1u57 h ASN 43 Cb 0.03 -0.04 -0.02 0.00 0.27 0.00 0.00 38.32 38.55 1u57 h ASN 43 CO -0.10 0.45 -0.13 1.56 -0.37 0.00 0.00 177.43 178.85 1u57 h GLN 44 N -0.14 -0.22 -5.56 6.67 1.08 -1.71 -3.48 115.11 111.75 1u57 h GLN 44 Ca 0.02 0.02 -0.29 0.00 -1.45 0.00 0.00 58.65 56.94 1u57 h GLN 44 Cb 0.38 0.05 0.18 0.00 -0.05 0.00 0.00 27.48 28.04 1u57 h GLN 44 CO 0.01 -0.15 -0.81 0.54 -0.95 0.00 0.00 178.83 177.46 1u57 n ARG 45 N -5.26 -4.58 0.00 1.46 1.74 -0.08 -5.01 116.66 104.93 1u57 n ARG 45 Ca -0.06 0.86 0.00 0.00 -0.77 0.00 0.00 57.85 57.88 1u57 n ARG 45 Cb 0.18 -5.84 0.00 0.00 -1.02 0.00 0.00 32.46 25.78 1u57 n ARG 45 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1u57 n LYS 46 N -3.72 0.00 -1.70 5.56 4.81 -1.26 -5.09 118.16 116.76 1u57 n LYS 46 Ca -0.19 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 56.88 1u57 n LYS 46 Cb 0.65 0.00 0.06 0.00 0.02 0.00 0.00 35.03 35.76 1u57 n LYS 46 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1u57 n ILE 47 N 0.00 4.44 0.82 3.15 2.08 -1.26 -5.17 119.36 123.42 1u57 n ILE 47 Ca 0.00 -0.50 0.10 0.00 0.56 0.00 0.00 62.75 62.91 1u57 n ILE 47 Cb 0.00 -1.43 0.08 0.00 -0.75 0.00 0.00 39.64 37.54 1u57 n ILE 47 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63