#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmq n LYS 2 N 0.00 0.00 -4.00 1.97 4.81 -1.26 -5.11 118.16 114.57 2kmq n LYS 2 Ca 0.00 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.31 2kmq n LYS 2 Cb 0.00 -0.26 -0.14 0.00 0.02 0.00 0.00 35.03 34.65 2kmq n LYS 2 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2kmq s VAL 3 N -2.00 0.20 0.20 3.15 0.11 -1.26 -5.16 120.40 115.64 2kmq s VAL 3 Ca 0.00 -0.29 -0.30 0.00 -2.93 0.00 0.00 61.98 58.46 2kmq s VAL 3 Cb 0.00 -0.21 -0.08 0.00 -1.53 0.00 0.00 36.38 34.56 2kmq s VAL 3 CO 0.00 -0.06 1.01 0.00 -3.33 0.00 0.00 175.10 172.72 2kmq s ALA 5 N -0.62 3.78 0.63 0.00 0.00 -1.26 -5.00 121.76 119.29 2kmq s ALA 5 Ca 0.45 1.37 -0.17 0.00 0.00 0.00 0.00 51.96 53.61 2kmq s ALA 5 Cb -0.27 -3.65 -0.02 0.00 0.00 0.00 0.00 23.12 19.18 2kmq s ALA 5 CO 0.34 -0.88 1.16 0.00 0.00 0.00 0.00 175.76 176.37 2kmq s PRO 7 N -3.66 0.46 -0.40 0.00 0.04 -1.26 -5.03 135.00 125.14 2kmq s PRO 7 Ca 0.73 0.22 0.08 0.00 0.04 0.00 0.00 61.00 62.07 2kmq s PRO 7 Cb -0.26 -1.77 0.43 0.00 0.04 0.00 0.00 34.50 32.95 2kmq s PRO 7 CO 0.36 -2.65 1.08 1.17 0.04 0.00 0.00 177.00 177.00 2kmq n LYS 8 N -4.06 2.89 -4.14 4.56 4.81 -1.26 -5.00 118.16 115.95 2kmq n LYS 8 Ca 0.08 -4.19 -0.16 0.00 -0.87 0.00 0.00 58.31 53.17 2kmq n LYS 8 Cb 0.59 -2.01 -0.12 0.00 0.02 0.00 0.00 35.03 33.51 2kmq n LYS 8 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 2kmq s ILE 9 N -4.92 0.91 0.21 3.15 2.07 -1.26 -5.18 121.20 116.19 2kmq s ILE 9 Ca 0.43 -1.31 -0.04 0.00 -1.41 0.00 0.00 60.65 58.32 2kmq s ILE 9 Cb 0.41 -1.00 0.05 0.00 0.13 0.00 0.00 42.46 42.05 2kmq s ILE 9 CO -0.12 -0.34 0.26 0.18 -1.91 0.00 0.00 174.94 173.01 2kmq n LEU 10 N 1.17 0.00 -3.14 8.50 7.99 -1.26 -4.81 117.00 125.45 2kmq n LEU 10 Ca -0.21 -0.29 -0.03 0.00 -0.01 0.00 0.00 56.01 55.48 2kmq n LEU 10 Cb 0.55 -0.21 0.00 0.00 -0.11 0.00 0.00 43.42 43.65 2kmq n LEU 10 CO 0.22 -0.80 0.28 0.29 -1.51 0.00 0.00 177.39 175.88 2kmq n LYS 11 N -1.69 -1.36 -0.71 3.23 4.76 -1.26 -4.94 118.16 116.19 2kmq n LYS 11 Ca 0.03 1.41 -0.30 0.00 -2.87 0.00 0.00 58.31 56.59 2kmq n LYS 11 Cb 0.12 -5.42 0.25 0.00 -1.84 0.00 0.00 35.03 28.14 2kmq n LYS 11 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2kmq s PRO 12 N -3.24 -1.61 0.26 1.97 0.04 -1.26 -4.82 135.00 126.34 2kmq s PRO 12 Ca 0.01 0.29 0.01 0.00 0.04 0.00 0.00 61.00 61.35 2kmq s PRO 12 Cb -0.00 -1.52 -0.05 0.00 0.04 0.00 0.00 34.50 32.97 2kmq s PRO 12 CO 0.76 -4.04 0.10 0.14 0.04 0.00 0.00 177.00 174.00 2kmq s VAL 13 N -2.60 0.55 -0.22 -0.36 -7.23 0.04 -1.73 120.40 108.84 2kmq s VAL 13 Ca 0.69 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.83 2kmq s VAL 13 Cb -0.16 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 34.15 2kmq s VAL 13 CO 0.59 -0.00 -0.06 0.00 -0.31 0.00 0.00 175.10 175.32 2kmq s GLY 15 N 1.42 1.58 0.00 0.00 0.00 -0.07 -2.29 107.32 107.95 2kmq s GLY 15 Ca 0.04 -0.24 0.22 0.00 0.00 0.00 0.00 44.72 44.75 2kmq s GLY 15 CO -0.05 0.35 1.71 -1.14 0.00 0.00 0.00 173.10 173.97 2kmq n SER 16 N -4.18 0.00 0.13 1.64 3.41 0.11 -1.49 113.62 113.24 2kmq n SER 16 Ca 0.06 0.47 0.13 0.00 -0.26 0.00 0.00 58.87 59.26 2kmq n SER 16 Cb 0.56 -0.49 0.42 0.00 -0.26 0.00 0.00 64.21 64.44 2kmq n SER 16 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2kmq h ASP 17 N 0.00 0.00 -0.30 4.04 3.58 -1.92 -3.48 116.42 118.33 2kmq h ASP 17 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2kmq h ASP 17 Cb 0.37 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.42 2kmq h ASP 17 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 2kmq n GLY 18 N 0.91 0.88 3.20 -0.78 0.00 -0.55 -5.10 105.19 103.75 2kmq n GLY 18 Ca 0.04 -0.58 -0.15 0.00 0.00 0.00 0.00 46.02 45.33 2kmq n GLY 18 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2kmq s ARG 19 N -3.37 0.90 0.01 1.61 3.52 -1.25 -4.98 118.95 115.39 2kmq s ARG 19 Ca 0.00 -1.21 -0.14 0.00 -0.13 0.00 0.00 55.73 54.25 2kmq s ARG 19 Cb 0.00 -0.60 -0.06 0.00 -1.56 0.00 0.00 34.95 32.73 2kmq s ARG 19 CO 0.00 0.10 0.40 0.99 -0.81 0.00 0.00 175.30 175.98 2kmq s THR 20 N -2.51 5.04 -0.01 4.11 2.01 -1.26 -0.89 115.64 122.13 2kmq s THR 20 Ca 0.07 0.79 0.01 0.00 0.31 0.00 0.00 61.69 62.88 2kmq s THR 20 Cb -0.02 -3.70 0.00 0.00 0.01 0.00 0.00 72.50 68.79 2kmq s THR 20 CO 0.01 0.55 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.13 2kmq s TYR 21 N -1.11 0.48 0.55 4.92 2.02 -0.35 -4.94 117.35 118.92 2kmq s TYR 21 Ca 0.24 -0.09 0.23 0.00 -0.37 0.00 0.00 57.07 57.08 2kmq s TYR 21 Cb -0.16 -0.34 1.50 0.00 -0.40 0.00 0.00 41.96 42.56 2kmq s TYR 21 CO 0.14 -0.04 2.16 0.00 -1.57 0.00 0.00 175.55 176.24 2kmq h ALA 22 N 6.24 1.89 -2.42 3.71 0.00 -1.93 0.16 119.26 126.90 2kmq h ALA 22 Ca -0.30 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2kmq h ALA 22 Cb 1.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2kmq h ALA 22 CO 0.50 -0.12 0.13 -1.71 0.00 0.00 0.00 179.25 178.06 2kmq n ASN 23 N -4.21 -1.03 0.26 0.00 2.85 -1.26 -3.99 115.26 107.88 2kmq n ASN 23 Ca -0.01 -1.70 0.13 0.00 -0.11 0.00 0.00 54.58 52.89 2kmq n ASN 23 Cb 0.18 1.71 0.72 0.00 1.24 0.00 0.00 39.78 43.63 2kmq n ASN 23 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 2kmq h SER 24 N 0.90 0.00 0.09 1.20 4.64 -1.96 -3.32 113.55 115.09 2kmq h SER 24 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 2kmq h SER 24 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 2kmq h SER 24 CO 0.19 0.12 0.00 0.00 -0.87 0.00 0.00 176.83 176.27 2kmq n ILE 26 N -1.13 0.00 -0.33 0.00 -5.35 -1.25 -4.50 119.36 106.80 2kmq n ILE 26 Ca 0.06 0.00 0.15 0.00 -0.27 0.00 0.00 62.75 62.69 2kmq n ILE 26 Cb 0.06 -0.95 0.37 0.00 -1.74 0.00 0.00 39.64 37.38 2kmq n ILE 26 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2kmq h ALA 27 N 0.00 1.81 0.00 -1.28 0.00 -1.71 -1.22 119.26 116.86 2kmq h ALA 27 Ca 0.00 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2kmq h ALA 27 Cb 0.73 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2kmq h ALA 27 CO 0.00 -0.18 -0.21 0.00 0.00 0.00 0.00 179.25 178.86 2kmq h ARG 28 N 0.67 0.00 0.00 0.00 3.08 -1.61 -1.44 114.38 115.09 2kmq h ARG 28 Ca 0.57 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.62 2kmq h ARG 28 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.06 2kmq h ARG 28 CO -0.34 0.21 -0.10 0.00 -1.07 0.00 0.00 179.97 178.66 2kmq n ASN 30 N -1.63 0.70 0.00 0.00 3.02 -1.10 -4.93 115.26 111.33 2kmq n ASN 30 Ca 0.06 -0.85 0.00 0.00 -0.03 0.00 0.00 54.58 53.76 2kmq n ASN 30 Cb 0.36 0.91 0.00 0.00 -0.61 0.00 0.00 39.78 40.43 2kmq n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kmq n GLY 31 N 1.23 0.75 3.89 7.41 0.00 -1.09 -5.10 105.19 112.27 2kmq n GLY 31 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2kmq n GLY 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kmq s VAL 32 N -2.11 4.43 0.05 1.61 1.01 -0.56 -5.00 120.40 119.83 2kmq s VAL 32 Ca 0.00 0.44 0.08 0.00 0.00 0.00 0.00 61.98 62.50 2kmq s VAL 32 Cb 0.00 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 2kmq s VAL 32 CO 0.00 -0.86 -0.24 -0.94 0.00 0.00 0.00 175.10 173.06 2kmq s SER 33 N -4.20 2.85 0.28 3.32 1.04 -1.26 -3.63 113.70 112.10 2kmq s SER 33 Ca 0.53 -0.56 -0.30 0.00 0.48 0.00 0.00 55.95 56.10 2kmq s SER 33 Cb -0.11 -0.25 -0.11 0.00 0.10 0.00 0.00 66.02 65.66 2kmq s SER 33 CO 0.49 0.21 1.48 -0.51 0.98 0.00 0.00 173.24 175.89 2kmq s ILE 34 N -0.81 2.45 0.03 -1.02 -1.16 -1.26 0.04 121.20 119.47 2kmq s ILE 34 Ca 0.10 0.39 -0.04 0.00 -0.51 0.00 0.00 60.65 60.59 2kmq s ILE 34 Cb -0.09 -3.25 -0.01 0.00 0.61 0.00 0.00 42.46 39.72 2kmq s ILE 34 CO 0.02 0.07 -0.08 1.17 -2.81 0.00 0.00 174.94 173.31 2kmq n LYS 35 N 2.01 0.11 -4.25 3.50 0.00 -0.97 -4.77 118.16 113.80 2kmq n LYS 35 Ca 0.06 0.05 -0.17 0.00 0.00 0.00 0.00 58.31 58.25 2kmq n LYS 35 Cb 0.39 -0.68 -0.14 0.00 0.00 0.00 0.00 35.03 34.60 2kmq n LYS 35 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2kmq s SER 36 N -5.93 0.91 0.88 3.14 1.04 -1.12 -5.06 113.70 107.56 2kmq s SER 36 Ca -0.06 -0.20 -0.12 0.00 0.48 0.00 0.00 55.95 56.05 2kmq s SER 36 Cb 0.01 -0.08 0.12 0.00 0.10 0.00 0.00 66.02 66.17 2kmq s SER 36 CO 0.09 0.05 1.12 -1.83 0.98 0.00 0.00 173.24 173.66 2kmq s GLU 37 N -0.39 1.40 0.06 4.02 -1.05 -1.26 -0.47 118.70 121.02 2kmq s GLU 37 Ca 0.01 0.42 0.00 0.00 -0.15 0.00 0.00 54.97 55.25 2kmq s GLU 37 Cb -0.04 -1.86 0.00 0.00 -0.44 0.00 0.00 34.13 31.79 2kmq s GLU 37 CO -0.00 -2.04 0.00 0.41 0.95 0.00 0.00 175.26 174.57 2kmq n GLY 38 N -2.11 -2.72 3.73 -3.83 0.00 -0.71 -4.62 105.19 94.94 2kmq n GLY 38 Ca 0.07 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 2kmq n GLY 38 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2kmq s SER 39 N -4.25 6.55 0.24 1.61 0.15 -1.23 -2.66 113.70 114.12 2kmq s SER 39 Ca 0.00 2.71 -0.26 0.00 0.70 0.00 0.00 55.95 59.11 2kmq s SER 39 Cb 0.00 -2.61 -0.09 0.00 -1.71 0.00 0.00 66.02 61.61 2kmq s SER 39 CO 0.00 -0.81 0.85 0.00 1.20 0.00 0.00 173.24 174.48 2kmq s PRO 41 N -1.58 2.58 -0.10 0.00 0.04 -1.26 -4.81 135.00 129.86 2kmq s PRO 41 Ca 0.43 0.99 -0.02 0.00 0.04 0.00 0.00 61.00 62.43 2kmq s PRO 41 Cb -0.21 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 2kmq s PRO 41 CO 0.26 -1.36 -0.04 1.15 0.04 0.00 0.00 177.00 177.04 2kmq h THR 42 N -0.92 0.00 0.00 1.26 2.02 -1.97 -3.48 112.91 109.83 2kmq h THR 42 Ca -0.44 -0.94 0.00 0.00 0.77 0.00 0.00 66.41 65.79 2kmq h THR 42 Cb 1.22 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2kmq h THR 42 CO 0.55 0.00 0.00 0.61 0.37 0.00 0.00 175.52 177.05 2kmq n GLY 43 N 1.75 0.61 0.00 2.16 0.00 -1.26 -5.19 105.19 103.27 2kmq n GLY 43 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2kmq n GLY 43 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83