#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rqt n ILE 2 N 0.00 5.64 -1.51 2.46 5.41 -1.26 -4.92 119.36 125.18 1rqt n ILE 2 Ca 0.00 -5.85 -0.31 0.00 1.00 0.00 0.00 62.75 57.60 1rqt n ILE 2 Cb 0.00 -1.51 0.07 0.00 -0.71 0.00 0.00 39.64 37.48 1rqt n ILE 2 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 1rqt s THR 3 N -4.40 3.71 0.28 1.39 -4.23 -1.26 -4.94 115.64 106.18 1rqt s THR 3 Ca 0.41 0.56 -0.03 0.00 -1.18 0.00 0.00 61.69 61.45 1rqt s THR 3 Cb 0.22 -3.25 0.27 0.00 1.34 0.00 0.00 72.50 71.07 1rqt s THR 3 CO -0.15 -0.73 1.93 0.11 -0.54 0.00 0.00 174.62 175.24 1rqt h LYS 4 N -0.87 1.16 -0.22 3.99 1.57 -2.01 -2.53 116.57 117.67 1rqt h LYS 4 Ca -0.44 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.26 1rqt h LYS 4 Cb 1.23 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 33.26 1rqt h LYS 4 CO 0.56 0.77 0.13 -0.44 -0.57 0.00 0.00 179.45 179.91 1rqt h ASP 5 N 1.20 0.26 -1.03 0.86 5.19 -1.99 -1.27 116.42 119.63 1rqt h ASP 5 Ca 0.37 -0.05 0.30 0.00 -0.62 0.00 0.00 57.03 57.03 1rqt h ASP 5 Cb -0.01 -0.07 -0.04 0.00 0.18 0.00 0.00 39.33 39.39 1rqt h ASP 5 CO -0.11 0.23 0.75 1.56 -3.12 0.00 0.00 179.24 178.56 1rqt h GLN 6 N 0.27 0.00 0.13 3.56 1.08 -1.81 0.82 115.11 119.17 1rqt h GLN 6 Ca 0.08 0.00 -0.28 0.00 -1.45 0.00 0.00 58.65 57.00 1rqt h GLN 6 Cb 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 1rqt h GLN 6 CO -0.01 0.00 -1.27 0.82 -0.95 0.00 0.00 178.83 177.42 1rqt h ILE 7 N 0.00 1.47 -0.20 2.54 1.08 -1.21 -3.03 117.51 118.16 1rqt h ILE 7 Ca 0.49 -3.04 -0.00 0.00 -0.39 0.00 0.00 64.86 61.92 1rqt h ILE 7 Cb 1.99 2.94 -0.01 0.00 -3.07 0.00 0.00 36.82 38.67 1rqt h ILE 7 CO -0.01 0.89 0.12 0.40 -0.69 0.00 0.00 178.15 178.87 1rqt h ILE 8 N 0.08 1.08 0.00 -0.67 1.08 0.12 -0.92 117.51 118.27 1rqt h ILE 8 Ca -0.14 -0.20 0.00 0.00 -0.39 0.00 0.00 64.86 64.12 1rqt h ILE 8 Cb 1.98 0.85 0.00 0.00 -3.07 0.00 0.00 36.82 36.58 1rqt h ILE 8 CO 0.20 0.08 0.00 -0.33 -0.69 0.00 0.00 178.15 177.41 1rqt h GLU 9 N 0.25 0.00 0.01 2.37 4.39 -1.30 -2.11 114.58 118.19 1rqt h GLU 9 Ca 0.07 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.52 1rqt h GLU 9 Cb 0.02 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.69 1rqt h GLU 9 CO -0.01 0.00 -1.04 0.00 -1.16 0.00 0.00 179.01 176.80 1rqt h ALA 10 N 2.18 0.19 0.00 3.43 0.00 -1.05 -2.78 119.26 121.23 1rqt h ALA 10 Ca 0.00 -0.71 -0.07 0.00 0.00 0.00 0.00 54.91 54.12 1rqt h ALA 10 Cb 0.31 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1rqt h ALA 10 CO 0.00 0.73 -0.35 0.28 0.00 0.00 0.00 179.25 179.91 1rqt h VAL 11 N 0.33 0.69 -0.03 0.00 2.07 -0.92 -2.27 116.25 116.12 1rqt h VAL 11 Ca -0.12 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 65.73 1rqt h VAL 11 Cb 1.69 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 33.57 1rqt h VAL 11 CO 0.20 0.34 0.00 0.00 0.02 0.00 0.00 177.57 178.13 1rqt n ALA 12 N -2.22 2.62 -0.04 1.67 0.00 -0.97 -3.21 120.51 118.36 1rqt n ALA 12 Ca 0.01 -0.31 -0.01 0.00 0.00 0.00 0.00 53.44 53.13 1rqt n ALA 12 Cb 0.59 -1.31 -0.12 0.00 0.00 0.00 0.00 19.45 18.61 1rqt n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rqt n ALA 13 N -0.40 2.05 -2.03 0.00 0.00 -0.88 -5.01 120.51 114.25 1rqt n ALA 13 Ca 0.20 -0.71 -0.21 0.00 0.00 0.00 0.00 53.44 52.72 1rqt n ALA 13 Cb 0.22 -0.27 0.03 0.00 0.00 0.00 0.00 19.45 19.42 1rqt n ALA 13 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1rqt s MET 14 N -2.68 2.64 0.65 0.00 -1.94 -1.04 -5.10 119.30 111.83 1rqt s MET 14 Ca -0.07 -0.79 -0.09 0.00 -1.71 0.00 0.00 55.69 53.03 1rqt s MET 14 Cb 0.07 -2.53 0.00 0.00 2.01 0.00 0.00 34.83 34.39 1rqt s MET 14 CO 0.63 -0.61 1.01 -1.54 -0.01 0.00 0.00 175.02 174.50 1rqt s SER 15 N -4.39 5.62 0.20 3.03 1.04 -1.26 -4.94 113.70 112.99 1rqt s SER 15 Ca 0.56 1.01 -0.10 0.00 0.48 0.00 0.00 55.95 57.90 1rqt s SER 15 Cb -0.10 -1.93 0.21 0.00 0.10 0.00 0.00 66.02 64.30 1rqt s SER 15 CO 0.38 -1.16 1.81 0.58 0.98 0.00 0.00 173.24 175.82 1rqt h VAL 16 N -0.42 0.98 -0.60 5.02 2.07 -1.99 -1.78 116.25 119.53 1rqt h VAL 16 Ca -0.45 -0.23 0.07 0.00 0.82 0.00 0.00 66.70 66.91 1rqt h VAL 16 Cb 1.25 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 1rqt h VAL 16 CO 0.62 0.12 0.29 0.24 0.02 0.00 0.00 177.57 178.87 1rqt h MET 17 N 0.66 0.52 0.00 1.57 2.86 -1.99 0.23 114.93 118.78 1rqt h MET 17 Ca 0.28 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.88 1rqt h MET 17 Cb 0.16 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 31.70 1rqt h MET 17 CO -0.17 0.34 -0.06 0.22 1.06 0.00 0.00 176.91 178.30 1rqt h ASP 18 N 0.54 0.00 0.88 1.22 1.82 -1.72 0.33 116.42 119.48 1rqt h ASP 18 Ca 0.28 0.00 -0.22 0.00 -0.39 0.00 0.00 57.03 56.70 1rqt h ASP 18 Cb 0.24 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.21 1rqt h ASP 18 CO -0.22 0.06 -1.19 0.58 -1.61 0.00 0.00 179.24 176.87 1rqt h VAL 19 N 0.00 1.27 -0.26 2.25 2.07 -0.26 -2.60 116.25 118.72 1rqt h VAL 19 Ca -0.00 -2.97 -0.11 0.00 0.82 0.00 0.00 66.70 64.44 1rqt h VAL 19 Cb 0.14 2.61 -0.00 0.00 -1.52 0.00 0.00 31.29 32.52 1rqt h VAL 19 CO 0.01 0.73 -0.26 0.58 0.02 0.00 0.00 177.57 178.65 1rqt h VAL 20 N 0.00 1.31 -0.04 2.57 2.07 0.11 -0.25 116.25 122.02 1rqt h VAL 20 Ca -0.10 -1.42 -0.00 0.00 0.82 0.00 0.00 66.70 65.99 1rqt h VAL 20 Cb 1.79 1.63 -0.00 0.00 -1.52 0.00 0.00 31.29 33.19 1rqt h VAL 20 CO 0.10 0.45 0.01 -0.33 0.02 0.00 0.00 177.57 177.82 1rqt h GLU 21 N 0.36 0.07 0.55 1.57 4.39 -1.09 0.43 114.58 120.86 1rqt h GLU 21 Ca 0.04 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 1rqt h GLU 21 Cb 0.82 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.44 1rqt h GLU 21 CO 0.06 0.25 -0.50 1.25 -1.16 0.00 0.00 179.01 178.92 1rqt h LEU 22 N -0.13 -1.35 -1.15 1.33 5.85 -1.47 0.24 115.31 118.63 1rqt h LEU 22 Ca 0.01 0.10 0.19 0.00 0.84 0.00 0.00 57.88 59.03 1rqt h LEU 22 Cb 0.21 0.44 -0.09 0.00 0.37 0.00 0.00 40.66 41.59 1rqt h LEU 22 CO -0.00 -0.68 0.61 0.40 -0.34 0.00 0.00 178.44 178.43 1rqt h ILE 23 N -1.04 0.71 -0.46 4.05 1.08 -1.02 0.29 117.51 121.12 1rqt h ILE 23 Ca -0.07 -0.23 -0.11 0.00 -0.39 0.00 0.00 64.86 64.06 1rqt h ILE 23 Cb 0.89 -0.03 -0.02 0.00 -3.07 0.00 0.00 36.82 34.59 1rqt h ILE 23 CO -0.03 0.12 -0.16 0.28 -0.69 0.00 0.00 178.15 177.67 1rqt h SER 24 N 0.67 0.88 0.69 1.72 0.02 -0.11 -0.97 113.55 116.45 1rqt h SER 24 Ca 0.55 -0.30 -0.03 0.00 -0.84 0.00 0.00 61.79 61.17 1rqt h SER 24 Cb 0.97 -0.24 0.01 0.00 0.14 0.00 0.00 62.40 63.27 1rqt h SER 24 CO -0.32 1.03 -0.33 0.00 -1.14 0.00 0.00 176.83 176.07 1rqt h ALA 25 N 1.04 -1.18 -0.97 3.77 0.00 0.29 -2.77 119.26 119.44 1rqt h ALA 25 Ca 0.12 -0.20 0.21 0.00 0.00 0.00 0.00 54.91 55.04 1rqt h ALA 25 Cb 0.68 0.36 -0.12 0.00 0.00 0.00 0.00 17.79 18.71 1rqt h ALA 25 CO 0.05 -1.11 0.56 0.52 0.00 0.00 0.00 179.25 179.27 1rqt h MET 26 N -0.98 0.60 -0.32 0.00 2.07 -1.17 0.30 114.93 115.43 1rqt h MET 26 Ca -0.09 -0.04 0.07 0.00 -2.07 0.00 0.00 59.70 57.57 1rqt h MET 26 Cb 0.71 -0.14 -0.08 0.00 -1.87 0.00 0.00 31.60 30.23 1rqt h MET 26 CO 0.16 0.40 -0.21 0.93 1.07 0.00 0.00 176.91 179.25 1rqt h GLU 27 N 0.62 -0.17 0.00 1.72 5.08 -1.02 0.23 114.58 121.04 1rqt h GLU 27 Ca 0.59 0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.89 1rqt h GLU 27 Cb 1.04 0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.33 1rqt h GLU 27 CO -0.44 -0.11 -0.28 1.49 -1.00 0.00 0.00 179.01 178.66 1rqt h GLU 28 N -0.18 0.19 0.01 2.33 4.81 -0.83 0.43 114.58 121.34 1rqt h GLU 28 Ca 0.17 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1rqt h GLU 28 Cb 0.43 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.87 1rqt h GLU 28 CO -0.43 0.94 -0.05 -0.22 -0.73 0.00 0.00 179.01 178.52 1rqt h LYS 29 N -0.49 -0.07 0.00 1.92 1.63 -0.22 -0.94 116.57 118.40 1rqt h LYS 29 Ca -0.04 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 1rqt h LYS 29 Cb 1.04 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.69 1rqt h LYS 29 CO 0.06 -0.05 0.00 1.19 -3.45 0.00 0.00 179.45 177.20 1rqt n PHE 30 N -2.74 0.00 -4.08 1.91 3.72 0.77 -4.88 117.46 112.17 1rqt n PHE 30 Ca -0.01 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.09 1rqt n PHE 30 Cb 0.04 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.54 1rqt n PHE 30 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1rqt n GLY 31 N 0.50 -0.31 2.87 1.37 0.00 -0.12 -4.88 105.19 104.62 1rqt n GLY 31 Ca 0.18 0.20 -0.27 0.00 0.00 0.00 0.00 46.02 46.13 1rqt n GLY 31 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1rqt n VAL 32 N -4.53 3.00 -2.94 1.61 3.14 -0.05 -4.86 118.33 113.71 1rqt n VAL 32 Ca -0.28 -5.54 -0.26 0.00 -2.96 0.00 0.00 64.34 55.30 1rqt n VAL 32 Cb 0.67 -1.50 -0.04 0.00 -1.06 0.00 0.00 33.84 31.92 1rqt n VAL 32 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1rqt n SER 33 N -0.10 3.96 0.00 6.55 3.41 -1.26 -4.79 113.62 121.39 1rqt n SER 33 Ca 0.31 -3.59 0.00 0.00 -0.26 0.00 0.00 58.87 55.33 1rqt n SER 33 Cb 0.39 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 1rqt n SER 33 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rqt n ALA 34 N -0.19 0.00 -2.72 7.33 0.00 -1.26 -5.08 120.51 118.59 1rqt n ALA 34 Ca 0.30 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.69 1rqt n ALA 34 Cb 0.45 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.94 1rqt n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rqt n ALA 35 N 0.00 -2.40 -1.64 0.00 0.00 -1.26 -5.12 120.51 110.09 1rqt n ALA 35 Ca 0.00 -0.83 -0.62 0.00 0.00 0.00 0.00 53.44 51.99 1rqt n ALA 35 Cb 0.00 -2.12 -0.09 0.00 0.00 0.00 0.00 19.45 17.24 1rqt n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rqt n ALA 36 N 2.08 -2.05 -1.27 0.00 0.00 -1.26 -5.22 120.51 112.78 1rqt n ALA 36 Ca 0.10 0.53 0.00 0.00 0.00 0.00 0.00 53.44 54.06 1rqt n ALA 36 Cb 0.63 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.18 1rqt n ALA 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50