#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmo n LYS 2 N 0.00 3.46 -2.12 -1.58 5.02 -1.26 -4.97 118.16 116.72 2kmo n LYS 2 Ca 0.00 -2.13 -0.39 0.00 -2.02 0.00 0.00 58.31 53.76 2kmo n LYS 2 Cb 0.00 -2.62 -0.01 0.00 -0.02 0.00 0.00 35.03 32.38 2kmo n LYS 2 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2kmo s VAL 3 N 1.45 2.75 0.33 -0.18 1.01 -1.26 -5.00 120.40 119.51 2kmo s VAL 3 Ca 0.67 0.69 -0.29 0.00 0.00 0.00 0.00 61.98 63.05 2kmo s VAL 3 Cb 0.21 -3.41 -0.11 0.00 0.00 0.00 0.00 36.38 33.08 2kmo s VAL 3 CO -0.06 0.11 1.39 0.00 0.00 0.00 0.00 175.10 176.54 2kmo s ALA 5 N -0.96 2.00 0.25 0.00 0.00 -1.26 -4.96 121.76 116.83 2kmo s ALA 5 Ca 0.52 -1.44 0.11 0.00 0.00 0.00 0.00 51.96 51.15 2kmo s ALA 5 Cb -0.43 -4.48 -0.05 0.00 0.00 0.00 0.00 23.12 18.17 2kmo s ALA 5 CO 0.55 -4.34 -0.19 0.00 0.00 0.00 0.00 175.76 171.78 2kmo s PRO 7 N -3.44 2.27 0.00 0.00 0.04 -1.26 -4.98 135.00 127.64 2kmo s PRO 7 Ca 0.27 0.54 0.23 0.00 0.04 0.00 0.00 61.00 62.08 2kmo s PRO 7 Cb -0.04 -1.95 1.08 0.00 0.04 0.00 0.00 34.50 33.63 2kmo s PRO 7 CO 0.12 -1.47 1.76 1.63 0.04 0.00 0.00 177.00 179.08 2kmo n LYS 8 N -3.31 0.15 -1.68 4.56 5.02 -1.26 -4.92 118.16 116.72 2kmo n LYS 8 Ca 0.07 0.09 -0.45 0.00 -2.02 0.00 0.00 58.31 56.00 2kmo n LYS 8 Cb 0.57 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.05 2kmo n LYS 8 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2kmo n ILE 9 N -1.40 0.38 -2.67 -0.18 5.41 -1.26 -4.92 119.36 114.71 2kmo n ILE 9 Ca 0.08 -0.09 -0.43 0.00 1.00 0.00 0.00 62.75 63.30 2kmo n ILE 9 Cb 0.23 -1.60 0.00 0.00 -0.71 0.00 0.00 39.64 37.56 2kmo n ILE 9 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2kmo n LEU 10 N 2.97 5.24 -3.13 1.39 4.32 -1.26 -4.70 117.00 121.84 2kmo n LEU 10 Ca 0.14 -4.18 -0.24 0.00 -0.02 0.00 0.00 56.01 51.71 2kmo n LEU 10 Cb 0.31 -1.68 -0.05 0.00 -1.62 0.00 0.00 43.42 40.38 2kmo n LEU 10 CO 0.63 0.49 -0.01 0.29 -1.22 0.00 0.00 177.39 177.57 2kmo n LYS 11 N 6.97 2.24 -0.93 3.23 4.76 -1.19 -5.10 118.16 128.14 2kmo n LYS 11 Ca 0.44 -4.26 -0.30 0.00 -2.87 0.00 0.00 58.31 51.31 2kmo n LYS 11 Cb 0.44 -1.99 0.15 0.00 -1.84 0.00 0.00 35.03 31.79 2kmo n LYS 11 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2kmo s PRO 12 N -2.76 1.18 0.04 1.97 0.04 -1.03 -4.06 135.00 130.39 2kmo s PRO 12 Ca 0.43 1.23 -0.04 0.00 0.04 0.00 0.00 61.00 62.66 2kmo s PRO 12 Cb 0.26 -1.77 -0.02 0.00 0.04 0.00 0.00 34.50 33.02 2kmo s PRO 12 CO -0.10 -2.41 0.07 0.14 0.04 0.00 0.00 177.00 174.74 2kmo s VAL 13 N -2.75 0.14 -0.37 -0.36 -7.23 -1.21 -0.71 120.40 107.90 2kmo s VAL 13 Ca 0.65 -1.13 -0.22 0.00 -1.81 0.00 0.00 61.98 59.46 2kmo s VAL 13 Cb -0.21 -0.86 0.01 0.00 0.56 0.00 0.00 36.38 35.88 2kmo s VAL 13 CO 0.58 -0.63 0.71 0.00 -0.31 0.00 0.00 175.10 175.46 2kmo s GLY 15 N 1.86 1.67 0.55 0.00 0.00 -0.17 -0.48 107.32 110.76 2kmo s GLY 15 Ca 0.28 0.25 0.31 0.00 0.00 0.00 0.00 44.72 45.55 2kmo s GLY 15 CO 0.17 0.60 2.11 1.76 0.00 0.00 0.00 173.10 177.74 2kmo h SER 16 N -1.17 0.00 1.59 1.64 0.02 -1.35 -0.86 113.55 113.41 2kmo h SER 16 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2kmo h SER 16 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 2kmo h SER 16 CO 0.51 0.08 0.00 -0.78 -1.14 0.00 0.00 176.83 175.50 2kmo h ASP 17 N 0.00 0.00 0.00 3.07 3.58 -1.93 -3.48 116.42 117.66 2kmo h ASP 17 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2kmo h ASP 17 Cb 0.30 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.35 2kmo h ASP 17 CO 0.01 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.98 2kmo n GLY 18 N 0.75 0.40 3.75 -0.78 0.00 -0.33 -5.10 105.19 103.88 2kmo n GLY 18 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2kmo n GLY 18 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2kmo s ARG 19 N -0.77 2.30 -0.08 1.61 3.52 -1.26 -4.68 118.95 119.58 2kmo s ARG 19 Ca 0.00 1.42 0.02 0.00 -0.13 0.00 0.00 55.73 57.04 2kmo s ARG 19 Cb 0.00 -1.89 -0.02 0.00 -1.56 0.00 0.00 34.95 31.48 2kmo s ARG 19 CO 0.00 -1.64 -0.13 0.99 -0.81 0.00 0.00 175.30 173.71 2kmo s THR 20 N -2.47 3.14 0.37 4.11 2.01 -1.26 -1.00 115.64 120.54 2kmo s THR 20 Ca 0.67 -0.67 0.03 0.00 0.31 0.00 0.00 61.69 62.03 2kmo s THR 20 Cb -0.21 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.99 2kmo s THR 20 CO 0.48 0.57 0.09 -0.31 -0.69 0.00 0.00 174.62 174.76 2kmo s TYR 21 N -0.34 1.84 0.11 4.92 1.51 -1.25 -5.04 117.35 119.10 2kmo s TYR 21 Ca 0.03 -1.13 -0.22 0.00 -1.01 0.00 0.00 57.07 54.74 2kmo s TYR 21 Cb -0.13 -1.21 -0.09 0.00 -0.11 0.00 0.00 41.96 40.43 2kmo s TYR 21 CO 0.02 -0.16 1.71 0.00 -1.11 0.00 0.00 175.55 176.01 2kmo h ALA 22 N 1.95 -0.01 -2.55 3.71 0.00 -1.93 -3.34 119.26 117.08 2kmo h ALA 22 Ca -0.38 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.57 2kmo h ALA 22 Cb 1.26 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 2kmo h ALA 22 CO 0.63 -0.54 0.25 0.27 0.00 0.00 0.00 179.25 179.86 2kmo n ASN 23 N -5.19 -1.46 -0.37 0.00 6.94 -1.26 -2.45 115.26 111.48 2kmo n ASN 23 Ca -0.05 -1.95 0.03 0.00 -0.02 0.00 0.00 54.58 52.59 2kmo n ASN 23 Cb 0.11 2.41 0.18 0.00 -2.36 0.00 0.00 39.78 40.13 2kmo n ASN 23 CO 0.00 0.00 0.00 -1.28 -1.03 0.00 0.00 177.26 174.95 2kmo h SER 24 N 1.34 1.03 -0.55 0.53 0.87 -1.93 -2.04 113.55 112.80 2kmo h SER 24 Ca -0.22 0.01 0.07 0.00 -1.23 0.00 0.00 61.79 60.43 2kmo h SER 24 Cb 0.83 -0.21 -0.06 0.00 -0.44 0.00 0.00 62.40 62.53 2kmo h SER 24 CO 0.28 0.65 0.23 0.00 -0.53 0.00 0.00 176.83 177.45 2kmo h ILE 26 N 0.43 1.39 -0.28 0.00 6.09 -1.90 -2.98 117.51 120.26 2kmo h ILE 26 Ca 0.26 -2.14 0.04 0.00 -1.37 0.00 0.00 64.86 61.65 2kmo h ILE 26 Cb 0.26 2.55 -0.04 0.00 0.47 0.00 0.00 36.82 40.06 2kmo h ILE 26 CO -0.23 0.63 0.03 0.00 -3.07 0.00 0.00 178.15 175.51 2kmo h ALA 27 N 0.34 0.27 -0.69 0.18 0.00 -0.98 -0.20 119.26 118.18 2kmo h ALA 27 Ca -0.09 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2kmo h ALA 27 Cb 1.44 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.29 2kmo h ALA 27 CO 0.15 -0.38 0.40 0.00 0.00 0.00 0.00 179.25 179.42 2kmo h ARG 28 N 0.13 0.95 -0.03 0.00 2.47 -1.15 -3.03 114.38 113.72 2kmo h ARG 28 Ca 0.13 -0.10 -0.11 0.00 -1.26 0.00 0.00 59.98 58.64 2kmo h ARG 28 Cb 0.15 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.26 2kmo h ARG 28 CO -0.19 0.69 -0.51 0.00 0.56 0.00 0.00 179.97 180.53 2kmo n ASN 30 N -3.94 0.00 0.00 0.00 3.02 -0.14 -4.88 115.26 109.31 2kmo n ASN 30 Ca -0.02 0.28 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 2kmo n ASN 30 Cb 0.53 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 2kmo n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kmo n GLY 31 N -0.50 0.67 3.47 7.41 0.00 -0.90 -5.08 105.19 110.25 2kmo n GLY 31 Ca 0.04 -0.54 -0.25 0.00 0.00 0.00 0.00 46.02 45.27 2kmo n GLY 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kmo s VAL 32 N -2.00 2.49 0.42 1.61 1.01 -1.20 -5.07 120.40 117.66 2kmo s VAL 32 Ca 0.00 -2.29 0.04 0.00 0.00 0.00 0.00 61.98 59.73 2kmo s VAL 32 Cb 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 36.38 34.10 2kmo s VAL 32 CO 0.00 -0.33 0.60 -0.55 0.00 0.00 0.00 175.10 174.82 2kmo s SER 33 N -3.30 5.79 -0.07 3.32 0.15 -1.26 -4.07 113.70 114.27 2kmo s SER 33 Ca 0.28 -0.01 -0.03 0.00 0.70 0.00 0.00 55.95 56.88 2kmo s SER 33 Cb -0.06 -1.24 -0.04 0.00 -1.71 0.00 0.00 66.02 62.97 2kmo s SER 33 CO 0.14 -0.66 0.10 0.27 1.20 0.00 0.00 173.24 174.29 2kmo s ILE 34 N -2.42 5.03 -0.17 6.45 -5.25 -1.26 -0.93 121.20 122.66 2kmo s ILE 34 Ca 0.49 -0.11 0.14 0.00 -0.99 0.00 0.00 60.65 60.18 2kmo s ILE 34 Cb -0.10 -3.23 -0.24 0.00 2.95 0.00 0.00 42.46 41.84 2kmo s ILE 34 CO 0.35 0.50 0.18 1.17 -1.79 0.00 0.00 174.94 175.35 2kmo n LYS 35 N 1.65 0.68 -3.81 0.37 3.00 0.37 -4.84 118.16 115.57 2kmo n LYS 35 Ca -0.16 0.08 -0.06 0.00 -0.00 0.00 0.00 58.31 58.17 2kmo n LYS 35 Cb 0.54 -1.59 -0.02 0.00 0.00 0.00 0.00 35.03 33.96 2kmo n LYS 35 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2kmo s SER 36 N -5.78 -0.24 0.68 3.14 1.04 -1.23 -5.03 113.70 106.28 2kmo s SER 36 Ca -0.12 -0.52 -0.11 0.00 0.48 0.00 0.00 55.95 55.69 2kmo s SER 36 Cb 0.07 0.64 -0.00 0.00 0.10 0.00 0.00 66.02 66.82 2kmo s SER 36 CO 0.80 -1.18 1.05 -1.83 0.98 0.00 0.00 173.24 173.07 2kmo s GLU 37 N -3.69 3.08 0.08 4.02 -1.05 -1.26 -0.98 118.70 118.90 2kmo s GLU 37 Ca 0.11 0.86 0.00 0.00 -0.15 0.00 0.00 54.97 55.79 2kmo s GLU 37 Cb -0.04 -2.01 0.00 0.00 -0.44 0.00 0.00 34.13 31.64 2kmo s GLU 37 CO 0.05 -0.97 0.00 0.41 0.95 0.00 0.00 175.26 175.69 2kmo n GLY 38 N -2.25 -2.31 3.76 -3.83 0.00 0.11 -4.55 105.19 96.11 2kmo n GLY 38 Ca 0.07 -1.42 -0.38 0.00 0.00 0.00 0.00 46.02 44.29 2kmo n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kmo s SER 39 N -5.02 5.56 0.24 1.61 1.04 -1.26 -1.59 113.70 114.27 2kmo s SER 39 Ca 0.00 2.58 -0.16 0.00 0.48 0.00 0.00 55.95 58.85 2kmo s SER 39 Cb 0.00 -2.62 -0.08 0.00 0.10 0.00 0.00 66.02 63.42 2kmo s SER 39 CO 0.00 -1.36 0.68 0.00 0.98 0.00 0.00 173.24 173.54 2kmo s PRO 41 N -2.33 3.17 0.18 0.00 0.04 -1.26 -4.94 135.00 129.85 2kmo s PRO 41 Ca 0.45 1.49 0.24 0.00 0.04 0.00 0.00 61.00 63.22 2kmo s PRO 41 Cb -0.14 -1.99 0.91 0.00 0.04 0.00 0.00 34.50 33.32 2kmo s PRO 41 CO 0.20 -0.98 1.74 -2.37 0.04 0.00 0.00 177.00 175.63 2kmo n THR 42 N -1.76 0.65 0.00 1.26 5.66 -1.26 -4.92 114.28 113.92 2kmo n THR 42 Ca 0.11 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.11 2kmo n THR 42 Cb 0.52 -0.84 0.00 0.00 -1.55 0.00 0.00 70.33 68.46 2kmo n THR 42 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kmo n GLY 43 N 0.70 0.77 0.00 1.09 0.00 -1.26 -5.24 105.19 101.25 2kmo n GLY 43 Ca 0.04 -0.70 0.01 0.00 0.00 0.00 0.00 46.02 45.38 2kmo n GLY 43 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83