#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 1.81 -3.81 1.97 5.02 -1.26 -5.04 118.16 116.85 2kmq n LYS 2 Ca 0.00 -4.22 -0.30 0.00 -2.02 0.00 0.00 58.31 51.78 2kmq n LYS 2 Cb 0.00 -2.01 -0.15 0.00 -0.02 0.00 0.00 35.03 32.85 2kmq n LYS 2 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2kmq s VAL 3 N -1.78 1.13 0.36 -0.18 1.01 -1.26 -5.14 120.40 114.53 2kmq s VAL 3 Ca 0.35 -1.32 -0.06 0.00 0.00 0.00 0.00 61.98 60.95 2kmq s VAL 3 Cb 0.10 -1.71 0.09 0.00 0.00 0.00 0.00 36.38 34.86 2kmq s VAL 3 CO -0.08 -0.46 0.40 0.00 0.00 0.00 0.00 175.10 174.96 2kmq h ALA 5 N -2.07 2.05 -6.87 0.00 0.00 -2.00 -3.47 119.26 106.90 2kmq h ALA 5 Ca -0.14 -0.01 -0.51 0.00 0.00 0.00 0.00 54.91 54.25 2kmq h ALA 5 Cb 0.40 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2kmq h ALA 5 CO 0.09 -0.40 -0.94 0.00 0.00 0.00 0.00 179.25 178.00 2kmq s PRO 7 N -6.31 1.35 0.00 0.00 0.04 -1.26 -5.02 135.00 123.80 2kmq s PRO 7 Ca 0.28 0.59 0.00 0.00 0.04 0.00 0.00 61.00 61.91 2kmq s PRO 7 Cb -0.16 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.54 2kmq s PRO 7 CO 0.85 -2.12 0.55 1.17 0.04 0.00 0.00 177.00 177.49 2kmq n LYS 8 N -3.76 -0.28 -1.71 4.56 4.81 -1.26 -4.85 118.16 115.67 2kmq n LYS 8 Ca 0.07 -0.63 -0.43 0.00 -0.87 0.00 0.00 58.31 56.44 2kmq n LYS 8 Cb 0.57 -0.96 -0.03 0.00 0.02 0.00 0.00 35.03 34.63 2kmq n LYS 8 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 2kmq n ILE 9 N -0.08 0.37 -0.50 3.15 5.41 -1.26 -5.00 119.36 121.44 2kmq n ILE 9 Ca 0.00 -0.09 -0.24 0.00 1.00 0.00 0.00 62.75 63.42 2kmq n ILE 9 Cb 0.06 -1.85 0.22 0.00 -0.71 0.00 0.00 39.64 37.36 2kmq n ILE 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2kmq n LEU 10 N 3.20 0.00 -3.02 1.39 -0.00 -1.26 -4.72 117.00 112.60 2kmq n LEU 10 Ca 0.14 -0.80 -0.03 0.00 -0.00 0.00 0.00 56.01 55.32 2kmq n LEU 10 Cb 0.34 -0.80 0.01 0.00 -0.00 0.00 0.00 43.42 42.98 2kmq n LEU 10 CO 0.64 -2.30 0.26 1.17 -0.00 0.00 0.00 177.39 177.16 2kmq n LYS 11 N -4.68 -1.44 -0.86 1.47 3.00 -1.26 -4.97 118.16 109.42 2kmq n LYS 11 Ca 0.11 1.31 -0.28 0.00 -0.00 0.00 0.00 58.31 59.45 2kmq n LYS 11 Cb 0.47 -5.55 0.22 0.00 0.00 0.00 0.00 35.03 30.17 2kmq n LYS 11 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2kmq s PRO 12 N -3.29 -0.31 0.31 1.64 0.04 -1.25 -4.84 135.00 127.28 2kmq s PRO 12 Ca 0.10 0.66 0.03 0.00 0.04 0.00 0.00 61.00 61.83 2kmq s PRO 12 Cb -0.01 -1.64 -0.04 0.00 0.04 0.00 0.00 34.50 32.85 2kmq s PRO 12 CO 0.71 -3.27 0.17 0.14 0.04 0.00 0.00 177.00 174.78 2kmq s VAL 13 N -2.71 0.31 -0.16 -0.36 -7.23 -0.19 -2.02 120.40 108.04 2kmq s VAL 13 Ca 0.67 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.85 2kmq s VAL 13 Cb -0.22 -2.50 0.01 0.00 0.56 0.00 0.00 36.38 34.23 2kmq s VAL 13 CO 0.61 0.00 -0.19 0.00 -0.31 0.00 0.00 175.10 175.21 2kmq s GLY 15 N 1.07 1.57 0.03 0.00 0.00 -0.30 -2.35 107.32 107.35 2kmq s GLY 15 Ca -0.01 -0.41 0.26 0.00 0.00 0.00 0.00 44.72 44.57 2kmq s GLY 15 CO -0.07 0.17 1.82 -1.26 0.00 0.00 0.00 173.10 173.76 2kmq n SER 16 N -3.97 0.12 0.06 1.64 2.88 0.11 -1.70 113.62 112.75 2kmq n SER 16 Ca 0.06 0.51 0.13 0.00 -1.33 0.00 0.00 58.87 58.24 2kmq n SER 16 Cb 0.58 -0.55 0.49 0.00 -0.75 0.00 0.00 64.21 63.98 2kmq n SER 16 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2kmq n ASP 17 N -1.61 0.46 0.00 -3.46 2.03 -1.26 -4.95 116.55 107.76 2kmq n ASP 17 Ca 0.06 0.55 0.00 0.00 0.52 0.00 0.00 54.79 55.92 2kmq n ASP 17 Cb 0.32 -0.67 0.00 0.00 -0.72 0.00 0.00 41.12 40.05 2kmq n ASP 17 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kmq n GLY 18 N 1.26 1.03 3.37 0.27 0.00 -0.69 -5.10 105.19 105.33 2kmq n GLY 18 Ca 0.06 -0.46 -0.26 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.87 1.35 0.24 1.61 6.06 -1.26 -4.97 118.95 120.11 2kmq s ARG 19 Ca 0.00 -1.36 -0.30 0.00 -2.50 0.00 0.00 55.73 51.57 2kmq s ARG 19 Cb 0.00 -1.70 -0.09 0.00 0.06 0.00 0.00 34.95 33.22 2kmq s ARG 19 CO 0.00 0.38 0.95 0.99 -2.50 0.00 0.00 175.30 175.12 2kmq s THR 20 N -1.37 4.05 0.00 4.11 2.01 -1.26 -1.15 115.64 122.03 2kmq s THR 20 Ca 0.14 2.05 0.03 0.00 0.31 0.00 0.00 61.69 64.23 2kmq s THR 20 Cb -0.09 -4.31 -0.01 0.00 0.01 0.00 0.00 72.50 68.10 2kmq s THR 20 CO 0.07 0.49 -0.10 -0.31 -0.69 0.00 0.00 174.62 174.07 2kmq s TYR 21 N -1.15 0.89 0.32 4.92 2.02 -0.20 -4.93 117.35 119.22 2kmq s TYR 21 Ca 0.41 -0.21 0.01 0.00 -0.37 0.00 0.00 57.07 56.91 2kmq s TYR 21 Cb -0.26 -0.56 0.56 0.00 -0.40 0.00 0.00 41.96 41.30 2kmq s TYR 21 CO 0.32 -0.01 1.96 0.00 -1.57 0.00 0.00 175.55 176.25 2kmq h ALA 22 N 5.66 1.53 -2.78 3.71 0.00 -1.90 -0.47 119.26 125.00 2kmq h ALA 22 Ca -0.32 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.49 2kmq h ALA 22 Cb 1.18 -0.27 -0.10 0.00 0.00 0.00 0.00 17.79 18.59 2kmq h ALA 22 CO 0.48 0.39 -0.15 -0.80 0.00 0.00 0.00 179.25 179.17 2kmq s ASN 23 N -6.22 -0.09 0.27 0.00 0.01 -1.26 -3.94 114.94 103.70 2kmq s ASN 23 Ca -0.11 -0.79 0.21 0.00 -0.71 0.00 0.00 52.86 51.46 2kmq s ASN 23 Cb 0.19 0.53 1.02 0.00 0.41 0.00 0.00 41.25 43.40 2kmq s ASN 23 CO 0.79 -1.04 1.65 -1.20 -1.51 0.00 0.00 177.10 175.79 2kmq n SER 24 N -0.32 0.57 0.27 -1.22 7.64 -1.26 -2.49 113.62 116.82 2kmq n SER 24 Ca -0.06 0.70 0.15 0.00 1.01 0.00 0.00 58.87 60.68 2kmq n SER 24 Cb 0.62 -0.80 0.72 0.00 -1.01 0.00 0.00 64.21 63.75 2kmq n SER 24 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kmq n ILE 26 N -3.31 1.49 -0.24 0.00 5.41 -1.04 -3.77 119.36 117.91 2kmq n ILE 26 Ca -0.01 0.01 0.04 0.00 1.00 0.00 0.00 62.75 63.79 2kmq n ILE 26 Cb 0.28 -2.16 0.16 0.00 -0.71 0.00 0.00 39.64 37.22 2kmq n ILE 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2kmq h ALA 27 N -0.79 0.94 0.00 -1.39 0.00 -1.71 -1.30 119.26 115.00 2kmq h ALA 27 Ca -0.26 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2kmq h ALA 27 Cb 1.08 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2kmq h ALA 27 CO -0.16 -0.27 -0.18 0.00 0.00 0.00 0.00 179.25 178.64 2kmq h ARG 28 N 0.35 0.00 0.00 0.00 3.08 -1.62 -1.77 114.38 114.42 2kmq h ARG 28 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.44 2kmq h ARG 28 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2kmq h ARG 28 CO -0.43 0.18 0.00 0.00 -1.07 0.00 0.00 179.97 178.65 2kmq n ASN 30 N -1.43 2.25 0.00 0.00 3.02 -0.74 -4.99 115.26 113.36 2kmq n ASN 30 Ca 0.09 -1.65 0.00 0.00 -0.03 0.00 0.00 54.58 52.98 2kmq n ASN 30 Cb 0.29 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.37 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 0.51 0.86 3.87 7.41 0.00 -1.16 -5.06 105.19 111.62 2kmq n GLY 31 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.39 3.31 0.20 1.61 1.01 -0.74 -4.98 120.40 117.42 2kmq s VAL 32 Ca 0.00 0.43 0.09 0.00 0.00 0.00 0.00 61.98 62.49 2kmq s VAL 32 Cb 0.00 -3.37 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 2kmq s VAL 32 CO 0.00 -0.56 -0.17 -0.94 0.00 0.00 0.00 175.10 173.44 2kmq s SER 33 N -4.27 2.78 0.28 3.32 1.04 -1.26 -3.45 113.70 112.13 2kmq s SER 33 Ca 0.59 -0.96 -0.29 0.00 0.48 0.00 0.00 55.95 55.76 2kmq s SER 33 Cb -0.12 -0.17 -0.10 0.00 0.10 0.00 0.00 66.02 65.74 2kmq s SER 33 CO 0.52 -0.09 1.25 -0.51 0.98 0.00 0.00 173.24 175.40 2kmq s ILE 34 N -2.56 3.05 0.12 -1.02 -1.16 -1.26 0.04 121.20 118.40 2kmq s ILE 34 Ca 0.21 1.00 0.00 0.00 -0.51 0.00 0.00 60.65 61.35 2kmq s ILE 34 Cb -0.03 -3.64 0.00 0.00 0.61 0.00 0.00 42.46 39.40 2kmq s ILE 34 CO 0.08 0.22 0.00 1.17 -2.81 0.00 0.00 174.94 173.60 2kmq n LYS 35 N 1.37 0.00 -4.19 3.50 0.00 -1.01 -4.74 118.16 113.09 2kmq n LYS 35 Ca 0.01 0.00 -0.17 0.00 0.00 0.00 0.00 58.31 58.15 2kmq n LYS 35 Cb 0.43 -0.43 -0.11 0.00 0.00 0.00 0.00 35.03 34.92 2kmq n LYS 35 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2kmq s SER 36 N -5.85 1.70 0.74 3.14 0.15 -0.99 -5.05 113.70 107.53 2kmq s SER 36 Ca 0.00 -0.72 -0.12 0.00 0.70 0.00 0.00 55.95 55.81 2kmq s SER 36 Cb 0.00 -0.04 0.03 0.00 -1.71 0.00 0.00 66.02 64.30 2kmq s SER 36 CO 0.00 -0.15 1.11 -1.61 1.20 0.00 0.00 173.24 173.79 2kmq s GLU 37 N -2.29 2.60 0.15 5.44 8.01 -1.26 -0.59 118.70 130.75 2kmq s GLU 37 Ca 0.03 0.43 0.00 0.00 0.01 0.00 0.00 54.97 55.44 2kmq s GLU 37 Cb -0.07 -1.99 0.00 0.00 -4.31 0.00 0.00 34.13 27.76 2kmq s GLU 37 CO 0.02 -1.21 0.00 0.41 0.01 0.00 0.00 175.26 174.49 2kmq n GLY 38 N -2.91 -2.84 3.72 -1.39 0.00 -0.86 -4.58 105.19 96.33 2kmq n GLY 38 Ca 0.07 -1.33 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 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 -4.62 6.41 0.34 1.61 0.15 -1.21 -2.70 113.70 113.68 2kmq s SER 39 Ca 0.00 2.83 -0.26 0.00 0.70 0.00 0.00 55.95 59.22 2kmq s SER 39 Cb 0.00 -2.60 -0.09 0.00 -1.71 0.00 0.00 66.02 61.62 2kmq s SER 39 CO 0.00 -0.95 1.05 0.00 1.20 0.00 0.00 173.24 174.54 2kmq s PRO 41 N -2.00 2.94 0.27 0.00 0.04 -1.26 -4.77 135.00 130.22 2kmq s PRO 41 Ca 0.51 1.10 0.14 0.00 0.04 0.00 0.00 61.00 62.80 2kmq s PRO 41 Cb -0.25 -1.99 0.06 0.00 0.04 0.00 0.00 34.50 32.36 2kmq s PRO 41 CO 0.32 -1.11 1.44 1.15 0.04 0.00 0.00 177.00 178.85 2kmq h THR 42 N -0.36 0.94 0.00 1.26 2.02 -1.97 -3.47 112.91 111.33 2kmq h THR 42 Ca -0.45 -2.30 0.00 0.00 0.77 0.00 0.00 66.41 64.43 2kmq h THR 42 Cb 1.22 2.45 0.00 0.00 -1.74 0.00 0.00 68.15 70.08 2kmq h THR 42 CO 0.56 0.53 0.00 0.61 0.37 0.00 0.00 175.52 177.59 2kmq n GLY 43 N 1.21 -0.61 0.00 2.16 0.00 -1.26 -5.23 105.19 101.46 2kmq n GLY 43 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.06 2kmq n GLY 43 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71