#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmq s LYS 2 N 0.00 0.15 0.11 1.97 -0.14 -1.26 -5.15 119.74 115.43 2kmq s LYS 2 Ca 0.00 -0.06 -0.10 0.00 -1.36 0.00 0.00 55.97 54.45 2kmq s LYS 2 Cb 0.00 -1.65 0.00 0.00 -1.68 0.00 0.00 37.83 34.51 2kmq s LYS 2 CO 0.00 -0.60 0.25 0.54 -0.76 0.00 0.00 175.35 174.78 2kmq s VAL 3 N 2.09 0.11 0.69 3.17 0.11 -1.26 -5.17 120.40 120.14 2kmq s VAL 3 Ca 0.02 -1.11 -0.15 0.00 -2.93 0.00 0.00 61.98 57.81 2kmq s VAL 3 Cb -0.15 -1.42 0.02 0.00 -1.53 0.00 0.00 36.38 33.29 2kmq s VAL 3 CO -0.08 -0.51 1.15 0.00 -3.33 0.00 0.00 175.10 172.33 2kmq n ALA 5 N -2.54 1.35 -3.82 0.00 0.00 -1.26 -5.07 120.51 109.18 2kmq n ALA 5 Ca 0.12 -0.72 -0.31 0.00 0.00 0.00 0.00 53.44 52.52 2kmq n ALA 5 Cb 0.51 -0.10 0.01 0.00 0.00 0.00 0.00 19.45 19.87 2kmq n ALA 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kmq s PRO 7 N -5.73 2.61 0.00 0.00 0.04 -1.26 -4.98 135.00 125.67 2kmq s PRO 7 Ca 0.22 1.19 0.19 0.00 0.04 0.00 0.00 61.00 62.64 2kmq s PRO 7 Cb -0.11 -1.94 0.61 0.00 0.04 0.00 0.00 34.50 33.10 2kmq s PRO 7 CO 0.91 -1.37 1.47 0.36 0.04 0.00 0.00 177.00 178.40 2kmq n LYS 8 N -3.04 1.91 -1.66 4.56 -0.00 -1.26 -4.84 118.16 113.83 2kmq n LYS 8 Ca 0.09 -1.37 -0.43 0.00 -0.00 0.00 0.00 58.31 56.60 2kmq n LYS 8 Cb 0.53 -1.40 -0.01 0.00 -0.00 0.00 0.00 35.03 34.15 2kmq n LYS 8 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.40 178.91 2kmq n ILE 9 N 0.60 2.06 -1.82 0.58 3.06 -1.26 -5.04 119.36 117.54 2kmq n ILE 9 Ca 0.16 -0.50 -0.26 0.00 -2.50 0.00 0.00 62.75 59.65 2kmq n ILE 9 Cb 0.38 -1.36 0.18 0.00 0.54 0.00 0.00 39.64 39.38 2kmq n ILE 9 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 2kmq n LEU 10 N 0.86 0.00 -3.42 9.51 7.99 -1.26 -4.69 117.00 125.99 2kmq n LEU 10 Ca 0.07 -1.30 -0.13 0.00 -0.01 0.00 0.00 56.01 54.64 2kmq n LEU 10 Cb 0.35 -0.91 0.00 0.00 -0.11 0.00 0.00 43.42 42.75 2kmq n LEU 10 CO 0.61 -1.35 0.06 0.29 -1.51 0.00 0.00 177.39 175.49 2kmq n LYS 11 N -3.53 -1.42 -0.76 3.23 5.02 -1.26 -4.93 118.16 114.51 2kmq n LYS 11 Ca 0.15 1.12 -0.28 0.00 -2.02 0.00 0.00 58.31 57.27 2kmq n LYS 11 Cb 0.52 -4.14 0.23 0.00 -0.02 0.00 0.00 35.03 31.61 2kmq n LYS 11 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2kmq s PRO 12 N -4.02 -0.45 0.29 1.97 0.04 -1.26 -4.82 135.00 126.76 2kmq s PRO 12 Ca 0.03 0.74 0.02 0.00 0.04 0.00 0.00 61.00 61.83 2kmq s PRO 12 Cb -0.01 -1.62 -0.05 0.00 0.04 0.00 0.00 34.50 32.87 2kmq s PRO 12 CO 0.82 -3.38 0.10 0.14 0.04 0.00 0.00 177.00 174.72 2kmq s VAL 13 N -2.64 0.68 -0.28 -0.36 -7.23 0.30 -2.69 120.40 108.17 2kmq s VAL 13 Ca 0.67 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.87 2kmq s VAL 13 Cb -0.23 -2.63 0.07 0.00 0.56 0.00 0.00 36.38 34.15 2kmq s VAL 13 CO 0.62 0.00 -0.06 0.00 -0.31 0.00 0.00 175.10 175.35 2kmq s GLY 15 N 1.05 1.59 0.11 0.00 0.00 -0.74 -1.61 107.32 107.71 2kmq s GLY 15 Ca -0.03 -0.30 0.25 0.00 0.00 0.00 0.00 44.72 44.63 2kmq s GLY 15 CO -0.06 0.25 1.76 -1.26 0.00 0.00 0.00 173.10 173.79 2kmq n SER 16 N -3.94 0.37 0.09 1.64 2.88 0.96 -1.71 113.62 113.91 2kmq n SER 16 Ca 0.06 0.55 0.13 0.00 -1.33 0.00 0.00 58.87 58.28 2kmq n SER 16 Cb 0.57 -0.65 0.39 0.00 -0.75 0.00 0.00 64.21 63.78 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 -1.87 0.73 -0.06 -3.46 2.03 -1.26 -4.96 116.55 107.71 2kmq n ASP 17 Ca 0.05 0.50 0.00 0.00 0.52 0.00 0.00 54.79 55.86 2kmq n ASP 17 Cb 0.32 -0.64 0.00 0.00 -0.72 0.00 0.00 41.12 40.08 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 1.33 0.98 3.39 0.27 0.00 -0.69 -5.10 105.19 105.37 2kmq n GLY 18 Ca 0.05 -0.53 -0.26 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.92 1.44 0.26 1.61 3.52 -1.26 -4.83 118.95 116.76 2kmq s ARG 19 Ca 0.00 -1.48 -0.29 0.00 -0.13 0.00 0.00 55.73 53.83 2kmq s ARG 19 Cb 0.00 -1.70 -0.09 0.00 -1.56 0.00 0.00 34.95 31.60 2kmq s ARG 19 CO 0.00 0.37 0.94 0.99 -0.81 0.00 0.00 175.30 176.79 2kmq s THR 20 N -1.72 4.09 -0.01 4.11 2.01 -1.26 -1.79 115.64 121.07 2kmq s THR 20 Ca 0.19 2.03 0.02 0.00 0.31 0.00 0.00 61.69 64.24 2kmq s THR 20 Cb -0.08 -4.26 -0.00 0.00 0.01 0.00 0.00 72.50 68.17 2kmq s THR 20 CO 0.09 0.43 -0.07 -0.31 -0.69 0.00 0.00 174.62 174.06 2kmq s TYR 21 N -1.27 0.66 0.51 4.92 2.02 -0.43 -4.96 117.35 118.81 2kmq s TYR 21 Ca 0.43 -0.13 0.16 0.00 -0.37 0.00 0.00 57.07 57.16 2kmq s TYR 21 Cb -0.25 -0.43 1.23 0.00 -0.40 0.00 0.00 41.96 42.11 2kmq s TYR 21 CO 0.31 -0.02 2.12 0.00 -1.57 0.00 0.00 175.55 176.39 2kmq h ALA 22 N 6.00 1.91 -2.88 3.71 0.00 -1.88 0.87 119.26 127.00 2kmq h ALA 22 Ca -0.30 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2kmq h ALA 22 Cb 1.18 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 2kmq h ALA 22 CO 0.50 0.05 -0.02 1.21 0.00 0.00 0.00 179.25 180.99 2kmq s ASN 23 N -7.01 -0.14 0.62 0.00 2.47 -1.26 -4.06 114.94 105.55 2kmq s ASN 23 Ca -0.05 -0.83 0.31 0.00 0.42 0.00 0.00 52.86 52.72 2kmq s ASN 23 Cb 0.17 0.62 1.76 0.00 -1.45 0.00 0.00 41.25 42.35 2kmq s ASN 23 CO 0.67 -1.19 2.10 0.28 -3.72 0.00 0.00 177.10 175.24 2kmq h SER 24 N 2.19 0.00 0.19 -4.21 0.02 -1.97 -2.84 113.55 106.92 2kmq h SER 24 Ca -0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2kmq h SER 24 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2kmq h SER 24 CO 0.32 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.01 2kmq n ILE 26 N -2.10 1.22 -0.30 0.00 5.41 -1.07 -4.29 119.36 118.23 2kmq n ILE 26 Ca -0.00 -0.25 0.09 0.00 1.00 0.00 0.00 62.75 63.59 2kmq n ILE 26 Cb 0.08 -1.84 0.25 0.00 -0.71 0.00 0.00 39.64 37.42 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 -0.78 1.35 0.00 -1.39 0.00 -1.69 -0.95 119.26 115.81 2kmq h ALA 27 Ca -0.49 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 2kmq h ALA 27 Cb 1.40 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.20 2kmq h ALA 27 CO -0.30 -0.14 -0.08 0.00 0.00 0.00 0.00 179.25 178.74 2kmq h ARG 28 N 0.59 0.00 0.00 0.00 3.08 -1.54 -1.53 114.38 114.98 2kmq h ARG 28 Ca 0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.55 2kmq h ARG 28 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.81 2kmq h ARG 28 CO -0.40 0.08 0.00 0.00 -1.07 0.00 0.00 179.97 178.58 2kmq n ASN 30 N -1.67 2.12 0.00 0.00 3.02 -0.68 -4.99 115.26 113.06 2kmq n ASN 30 Ca 0.05 -1.60 0.00 0.00 -0.03 0.00 0.00 54.58 53.01 2kmq n ASN 30 Cb 0.30 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 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 0.46 0.71 3.90 7.41 0.00 -1.16 -5.05 105.19 111.47 2kmq n GLY 31 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.89 4.47 0.19 1.61 1.01 -0.66 -4.99 120.40 119.14 2kmq s VAL 32 Ca 0.00 0.27 0.10 0.00 0.00 0.00 0.00 61.98 62.35 2kmq s VAL 32 Cb 0.00 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 2kmq s VAL 32 CO 0.00 -0.78 -0.21 -0.94 0.00 0.00 0.00 175.10 173.17 2kmq s SER 33 N -4.18 3.11 0.32 3.32 1.04 -1.26 -3.34 113.70 112.71 2kmq s SER 33 Ca 0.51 -0.88 -0.29 0.00 0.48 0.00 0.00 55.95 55.77 2kmq s SER 33 Cb -0.10 -0.21 -0.10 0.00 0.10 0.00 0.00 66.02 65.70 2kmq s SER 33 CO 0.47 0.04 1.33 -0.51 0.98 0.00 0.00 173.24 175.55 2kmq s ILE 34 N -1.93 2.68 0.12 -1.02 -1.16 -1.26 -0.02 121.20 118.60 2kmq s ILE 34 Ca 0.19 0.67 0.00 0.00 -0.51 0.00 0.00 60.65 61.00 2kmq s ILE 34 Cb -0.07 -3.42 0.00 0.00 0.61 0.00 0.00 42.46 39.58 2kmq s ILE 34 CO 0.09 0.15 0.00 1.17 -2.81 0.00 0.00 174.94 173.54 2kmq n LYS 35 N 0.96 0.00 -4.30 3.50 0.00 -0.88 -4.74 118.16 112.70 2kmq n LYS 35 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 58.31 58.11 2kmq n LYS 35 Cb 0.41 -0.36 -0.11 0.00 0.00 0.00 0.00 35.03 34.98 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 -5.53 2.46 0.73 3.14 1.04 -0.64 -5.04 113.70 109.87 2kmq s SER 36 Ca 0.00 -0.84 -0.11 0.00 0.48 0.00 0.00 55.95 55.48 2kmq s SER 36 Cb 0.00 -0.13 0.03 0.00 0.10 0.00 0.00 66.02 66.02 2kmq s SER 36 CO 0.00 -0.06 1.08 -1.61 0.98 0.00 0.00 173.24 173.63 2kmq s GLU 37 N -2.71 2.62 0.24 4.02 0.41 -1.26 -0.73 118.70 121.30 2kmq s GLU 37 Ca 0.13 0.72 0.00 0.00 -0.41 0.00 0.00 54.97 55.42 2kmq s GLU 37 Cb -0.06 -1.97 0.00 0.00 -1.78 0.00 0.00 34.13 30.32 2kmq s GLU 37 CO 0.05 -1.26 0.00 0.41 -0.49 0.00 0.00 175.26 173.97 2kmq n GLY 38 N -2.27 -2.24 3.72 -1.39 0.00 -1.10 -4.55 105.19 97.36 2kmq n GLY 38 Ca 0.07 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 2kmq n GLY 38 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2kmq n SER 39 N -3.35 3.67 -4.77 1.61 2.88 -1.23 -2.67 113.62 109.76 2kmq n SER 39 Ca -0.02 1.12 -0.38 0.00 -1.33 0.00 0.00 58.87 58.26 2kmq n SER 39 Cb 0.34 -1.55 -0.04 0.00 -0.75 0.00 0.00 64.21 62.21 2kmq n SER 39 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2kmq n PRO 41 N 0.36 -2.42 -2.34 0.00 -0.04 -1.26 -4.02 135.00 125.28 2kmq n PRO 41 Ca 0.03 -1.67 -0.11 0.00 -0.04 0.00 0.00 63.50 61.70 2kmq n PRO 41 Cb 0.48 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 2kmq n PRO 41 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2kmq n THR 42 N -4.35 -0.69 0.00 0.52 -1.04 -1.26 -4.58 114.28 102.88 2kmq n THR 42 Ca 0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.15 2kmq n THR 42 Cb 0.53 -1.98 0.00 0.00 -1.82 0.00 0.00 70.33 67.06 2kmq n THR 42 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2kmq n GLY 43 N -1.05 0.00 0.00 3.41 0.00 -1.26 -5.06 105.19 101.22 2kmq n GLY 43 Ca -0.11 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.98 2kmq n GLY 43 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83