#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmr n LYS 2 N 0.00 -4.25 -3.88 -1.58 4.81 -1.26 -5.01 118.16 106.99 2kmr n LYS 2 Ca 0.00 0.51 -0.11 0.00 -0.87 0.00 0.00 58.31 57.84 2kmr n LYS 2 Cb 0.00 -4.98 -0.12 0.00 0.02 0.00 0.00 35.03 29.95 2kmr n LYS 2 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2kmr s VAL 3 N -3.69 0.05 -0.47 3.15 0.11 -1.26 -5.13 120.40 113.16 2kmr s VAL 3 Ca 0.18 -0.39 -0.28 0.00 -2.93 0.00 0.00 61.98 58.55 2kmr s VAL 3 Cb -0.09 -0.24 0.03 0.00 -1.53 0.00 0.00 36.38 34.55 2kmr s VAL 3 CO 0.85 -0.22 1.10 0.00 -3.33 0.00 0.00 175.10 173.51 2kmr n ALA 5 N 7.70 4.57 -1.50 0.00 0.00 -1.26 -4.98 120.51 125.04 2kmr n ALA 5 Ca 0.11 -3.45 -0.33 0.00 0.00 0.00 0.00 53.44 49.77 2kmr n ALA 5 Cb 0.49 -3.53 0.05 0.00 0.00 0.00 0.00 19.45 16.46 2kmr n ALA 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kmr s PRO 7 N -4.07 2.93 0.52 0.00 0.04 -1.26 -4.96 135.00 128.19 2kmr s PRO 7 Ca 0.68 1.55 0.25 0.00 0.04 0.00 0.00 61.00 63.51 2kmr s PRO 7 Cb -0.21 -1.95 1.40 0.00 0.04 0.00 0.00 34.50 33.78 2kmr s PRO 7 CO 0.42 -1.18 2.08 1.57 0.04 0.00 0.00 177.00 179.93 2kmr h LYS 8 N 0.46 0.00 -7.10 4.56 2.10 -2.04 -3.45 116.57 111.10 2kmr h LYS 8 Ca -0.48 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 57.64 2kmr h LYS 8 Cb 1.26 0.00 0.20 0.00 -0.90 0.00 0.00 32.23 32.79 2kmr h LYS 8 CO 0.55 0.12 0.05 1.51 -2.00 0.00 0.00 179.45 179.67 2kmr n ILE 9 N -3.82 0.75 -3.94 0.07 3.06 -1.26 -5.05 119.36 109.17 2kmr n ILE 9 Ca -0.02 -0.13 -0.29 0.00 -2.50 0.00 0.00 62.75 59.81 2kmr n ILE 9 Cb 0.22 -0.96 -0.16 0.00 0.54 0.00 0.00 39.64 39.27 2kmr n ILE 9 CO 0.00 0.00 0.00 -0.22 -2.50 0.00 0.00 176.55 173.83 2kmr s LEU 10 N -4.73 1.92 -0.59 9.51 2.96 -1.26 -4.89 118.68 121.60 2kmr s LEU 10 Ca 0.67 -0.78 0.05 0.00 -0.22 0.00 0.00 54.13 53.85 2kmr s LEU 10 Cb -0.25 -1.06 0.17 0.00 0.50 0.00 0.00 46.19 45.55 2kmr s LEU 10 CO 0.58 -0.17 0.44 -0.54 -1.32 0.00 0.00 176.35 175.33 2kmr s LYS 11 N 1.53 1.87 -1.10 1.98 -0.14 -0.41 -5.06 119.74 118.41 2kmr s LYS 11 Ca -0.00 -2.88 -0.22 0.00 -1.36 0.00 0.00 55.97 51.51 2kmr s LYS 11 Cb -0.16 -2.66 -0.03 0.00 -1.68 0.00 0.00 37.83 33.30 2kmr s LYS 11 CO -0.08 -1.32 1.84 -1.25 -0.76 0.00 0.00 175.35 173.78 2kmr s PRO 12 N -0.88 2.90 0.82 -1.68 0.04 -1.26 -4.19 135.00 130.75 2kmr s PRO 12 Ca 0.28 -1.05 -0.11 0.00 0.04 0.00 0.00 61.00 60.16 2kmr s PRO 12 Cb -0.01 -5.26 0.08 0.00 0.04 0.00 0.00 34.50 29.35 2kmr s PRO 12 CO -0.18 -3.30 1.10 0.14 0.04 0.00 0.00 177.00 174.80 2kmr s VAL 13 N 8.85 2.98 -1.48 -0.36 -7.23 -1.23 -4.91 120.40 117.01 2kmr s VAL 13 Ca 0.64 0.32 0.30 0.00 -1.81 0.00 0.00 61.98 61.43 2kmr s VAL 13 Cb -0.02 -3.00 0.55 0.00 0.56 0.00 0.00 36.38 34.48 2kmr s VAL 13 CO 0.05 -0.42 2.06 0.00 -0.31 0.00 0.00 175.10 176.49 2kmr n GLY 15 N 1.23 0.95 0.00 0.00 0.00 -1.24 -3.87 105.19 102.26 2kmr n GLY 15 Ca 0.15 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.45 2kmr n GLY 15 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kmr n SER 16 N -3.14 4.69 0.08 1.61 7.64 -1.26 -4.68 113.62 118.57 2kmr n SER 16 Ca 0.00 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.01 2kmr n SER 16 Cb 0.00 0.91 0.42 0.00 -1.01 0.00 0.00 64.21 64.54 2kmr n SER 16 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2kmr n ASP 17 N -1.44 0.66 0.00 6.43 9.92 -1.26 -4.95 116.55 125.91 2kmr n ASP 17 Ca 0.00 0.51 0.00 0.00 -0.53 0.00 0.00 54.79 54.77 2kmr n ASP 17 Cb 0.03 -0.65 0.00 0.00 -0.64 0.00 0.00 41.12 39.85 2kmr n ASP 17 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2kmr n GLY 18 N 1.35 1.82 3.85 0.44 0.00 -1.25 -5.08 105.19 106.31 2kmr n GLY 18 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 2kmr n GLY 18 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2kmr s ARG 19 N -0.93 1.83 0.14 1.61 1.70 -1.26 -4.90 118.95 117.14 2kmr s ARG 19 Ca 0.00 0.26 -0.05 0.00 -0.47 0.00 0.00 55.73 55.46 2kmr s ARG 19 Cb 0.00 -1.92 -0.06 0.00 -0.57 0.00 0.00 34.95 32.40 2kmr s ARG 19 CO 0.00 -1.72 0.38 0.99 -1.08 0.00 0.00 175.30 173.87 2kmr s THR 20 N -3.42 5.15 0.08 4.99 2.01 -1.26 -3.65 115.64 119.55 2kmr s THR 20 Ca 0.62 0.10 0.05 0.00 0.31 0.00 0.00 61.69 62.76 2kmr s THR 20 Cb -0.12 -3.62 -0.03 0.00 0.01 0.00 0.00 72.50 68.73 2kmr s THR 20 CO 0.51 0.07 -0.12 -0.31 -0.69 0.00 0.00 174.62 174.07 2kmr s TYR 21 N -1.63 1.15 0.17 4.92 1.51 -1.25 -5.02 117.35 117.20 2kmr s TYR 21 Ca 0.40 -0.53 -0.10 0.00 -1.01 0.00 0.00 57.07 55.83 2kmr s TYR 21 Cb -0.12 -0.63 0.03 0.00 -0.11 0.00 0.00 41.96 41.13 2kmr s TYR 21 CO 0.24 0.04 1.60 0.00 -1.11 0.00 0.00 175.55 176.32 2kmr h ALA 22 N 4.02 0.74 -2.71 3.71 0.00 -1.94 -3.27 119.26 119.81 2kmr h ALA 22 Ca -0.39 -0.33 -0.19 0.00 0.00 0.00 0.00 54.91 54.00 2kmr h ALA 22 Cb 1.19 -0.20 -0.12 0.00 0.00 0.00 0.00 17.79 18.66 2kmr h ALA 22 CO 0.45 0.62 -0.41 -0.80 0.00 0.00 0.00 179.25 179.11 2kmr s ASN 23 N -6.57 0.18 0.44 0.00 -0.87 -1.26 -1.29 114.94 105.57 2kmr s ASN 23 Ca -0.12 -1.25 0.11 0.00 -1.57 0.00 0.00 52.86 50.03 2kmr s ASN 23 Cb 0.13 0.48 0.97 0.00 -0.02 0.00 0.00 41.25 42.80 2kmr s ASN 23 CO 0.85 -0.98 2.04 0.77 -2.57 0.00 0.00 177.10 177.21 2kmr h SER 24 N 2.44 0.23 0.29 -1.22 4.64 -1.89 -3.03 113.55 115.01 2kmr h SER 24 Ca -0.32 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 60.98 2kmr h SER 24 Cb 1.25 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 2kmr h SER 24 CO 0.45 0.24 -0.30 0.00 -0.87 0.00 0.00 176.83 176.36 2kmr h ILE 26 N -0.58 1.06 0.60 0.00 2.10 -1.96 0.21 117.51 118.94 2kmr h ILE 26 Ca -0.04 -0.24 -0.03 0.00 1.08 0.00 0.00 64.86 65.63 2kmr h ILE 26 Cb 0.51 0.29 -0.00 0.00 -1.09 0.00 0.00 36.82 36.52 2kmr h ILE 26 CO -0.04 0.13 -0.33 0.00 -1.08 0.00 0.00 178.15 176.83 2kmr h ALA 27 N 1.64 -0.87 -0.54 0.18 0.00 -1.48 -0.46 119.26 117.72 2kmr h ALA 27 Ca 0.26 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2kmr h ALA 27 Cb 0.13 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2kmr h ALA 27 CO -0.07 -1.00 0.08 0.00 0.00 0.00 0.00 179.25 178.25 2kmr h ARG 28 N -0.87 0.86 -0.52 0.00 3.08 -0.79 0.08 114.38 116.23 2kmr h ARG 28 Ca -0.08 -0.21 0.03 0.00 0.07 0.00 0.00 59.98 59.80 2kmr h ARG 28 Cb 0.69 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 2kmr h ARG 28 CO 0.10 0.81 0.30 0.00 -1.07 0.00 0.00 179.97 180.12 2kmr h ASN 30 N 0.60 0.11 0.00 0.00 -0.73 -0.73 -3.48 115.58 111.36 2kmr h ASN 30 Ca 0.22 -0.57 0.00 0.00 1.87 0.00 0.00 56.30 57.81 2kmr h ASN 30 Cb 0.05 -0.03 0.00 0.00 0.27 0.00 0.00 38.32 38.61 2kmr h ASN 30 CO -0.11 0.67 0.00 0.61 -0.37 0.00 0.00 177.43 178.23 2kmr n GLY 31 N 0.47 0.00 3.18 1.57 0.00 -0.22 -5.09 105.19 105.09 2kmr n GLY 31 Ca -0.08 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.76 2kmr n GLY 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kmr s VAL 32 N 0.00 1.12 -0.09 1.61 1.01 -0.15 -4.99 120.40 118.90 2kmr s VAL 32 Ca 0.00 -1.42 -0.04 0.00 0.00 0.00 0.00 61.98 60.52 2kmr s VAL 32 Cb 0.00 -1.18 0.05 0.00 0.00 0.00 0.00 36.38 35.25 2kmr s VAL 32 CO 0.00 -0.31 0.20 -0.94 0.00 0.00 0.00 175.10 174.05 2kmr s SER 33 N -1.96 0.21 0.61 3.32 1.04 -1.26 -2.06 113.70 113.61 2kmr s SER 33 Ca 0.01 0.43 0.39 0.00 0.48 0.00 0.00 55.95 57.25 2kmr s SER 33 Cb -0.08 0.38 1.98 0.00 0.10 0.00 0.00 66.02 68.40 2kmr s SER 33 CO 0.02 -0.20 2.22 0.40 0.98 0.00 0.00 173.24 176.66 2kmr h ILE 34 N 6.16 0.10 0.00 -1.02 2.04 -1.95 -1.29 117.51 121.56 2kmr h ILE 34 Ca -0.27 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2kmr h ILE 34 Cb 1.13 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 2kmr h ILE 34 CO 0.26 0.02 0.00 0.11 0.00 0.00 0.00 178.15 178.54 2kmr h LYS 35 N 0.00 0.00 -0.94 2.37 6.56 -1.96 -3.47 116.57 119.12 2kmr h LYS 35 Ca -0.00 0.00 -0.39 0.00 -1.06 0.00 0.00 60.65 59.20 2kmr h LYS 35 Cb 0.19 0.00 -0.15 0.00 -0.57 0.00 0.00 32.23 31.70 2kmr h LYS 35 CO 0.00 0.00 -0.36 0.45 -2.06 0.00 0.00 179.45 177.49 2kmr n SER 36 N -2.47 -5.29 -3.99 0.86 2.88 -0.49 -4.97 113.62 100.16 2kmr n SER 36 Ca 0.01 0.46 -0.10 0.00 -1.33 0.00 0.00 58.87 57.91 2kmr n SER 36 Cb 0.19 -4.46 -0.07 0.00 -0.75 0.00 0.00 64.21 59.12 2kmr n SER 36 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 2kmr s GLU 37 N -3.64 1.22 -0.41 -1.46 -1.05 -1.26 -5.07 118.70 107.03 2kmr s GLU 37 Ca 0.00 -1.22 -0.07 0.00 -0.15 0.00 0.00 54.97 53.53 2kmr s GLU 37 Cb 0.00 0.38 -0.22 0.00 -0.44 0.00 0.00 34.13 33.85 2kmr s GLU 37 CO 0.00 -0.46 3.46 0.41 0.95 0.00 0.00 175.26 179.63 2kmr n GLY 38 N -0.25 3.31 3.56 -3.83 0.00 -1.26 -4.89 105.19 101.84 2kmr n GLY 38 Ca -0.06 -1.28 -0.31 0.00 0.00 0.00 0.00 46.02 44.37 2kmr n GLY 38 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2kmr s SER 39 N 2.04 5.50 -0.64 1.61 0.15 -1.26 -4.38 113.70 116.72 2kmr s SER 39 Ca 0.68 -1.01 -0.20 0.00 0.70 0.00 0.00 55.95 56.12 2kmr s SER 39 Cb 0.29 -2.57 0.03 0.00 -1.71 0.00 0.00 66.02 62.06 2kmr s SER 39 CO -0.02 -2.44 0.64 0.00 1.20 0.00 0.00 173.24 172.62 2kmr s PRO 41 N -3.67 2.82 -0.58 0.00 0.04 -1.26 -4.95 135.00 127.40 2kmr s PRO 41 Ca 0.19 -0.58 -0.27 0.00 0.04 0.00 0.00 61.00 60.39 2kmr s PRO 41 Cb -0.02 -5.15 -0.01 0.00 0.04 0.00 0.00 34.50 29.36 2kmr s PRO 41 CO 0.88 -3.12 1.72 0.95 0.04 0.00 0.00 177.00 177.47 2kmr s THR 42 N 8.84 3.48 0.00 1.26 -4.23 -1.26 -4.66 115.64 119.07 2kmr s THR 42 Ca 0.64 0.34 0.00 0.00 -1.18 0.00 0.00 61.69 61.49 2kmr s THR 42 Cb -0.05 -4.09 0.00 0.00 1.34 0.00 0.00 72.50 69.71 2kmr s THR 42 CO -0.02 -0.99 0.00 0.61 -0.54 0.00 0.00 174.62 173.68 2kmr n GLY 43 N 5.56 0.46 0.00 3.99 0.00 -1.26 -4.79 105.19 109.15 2kmr n GLY 43 Ca 0.18 -1.03 0.14 0.00 0.00 0.00 0.00 46.02 45.31 2kmr n GLY 43 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71