#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 -1.70 -4.36 1.64 4.81 -1.26 -5.03 118.16 112.27 2kmr n LYS 2 Ca 0.00 0.42 -0.25 0.00 -0.87 0.00 0.00 58.31 57.61 2kmr n LYS 2 Cb 0.00 -4.12 -0.17 0.00 0.02 0.00 0.00 35.03 30.76 2kmr n LYS 2 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2kmr s VAL 3 N -3.58 1.05 -0.63 3.15 1.01 -1.26 -5.11 120.40 115.03 2kmr s VAL 3 Ca 0.36 -0.39 -0.28 0.00 0.00 0.00 0.00 61.98 61.67 2kmr s VAL 3 Cb -0.14 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.26 2kmr s VAL 3 CO 0.87 0.35 1.37 0.00 0.00 0.00 0.00 175.10 177.69 2kmr n ALA 5 N 9.60 5.80 -1.24 0.00 0.00 -1.26 -4.96 120.51 128.45 2kmr n ALA 5 Ca 0.09 -2.61 -0.33 0.00 0.00 0.00 0.00 53.44 50.59 2kmr n ALA 5 Cb 0.49 -3.16 0.10 0.00 0.00 0.00 0.00 19.45 16.89 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 -4.20 0.85 0.62 0.00 0.04 -1.26 -4.95 135.00 126.10 2kmr s PRO 7 Ca 0.70 0.53 0.40 0.00 0.04 0.00 0.00 61.00 62.67 2kmr s PRO 7 Cb -0.25 -1.79 1.98 0.00 0.04 0.00 0.00 34.50 34.49 2kmr s PRO 7 CO 0.48 -2.45 2.21 -0.22 0.04 0.00 0.00 177.00 177.07 2kmr h LYS 8 N -1.69 0.00 -6.32 4.56 3.64 -2.04 -3.44 116.57 111.28 2kmr h LYS 8 Ca -0.52 0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.29 2kmr h LYS 8 Cb 1.32 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 33.16 2kmr h LYS 8 CO 0.58 0.01 1.18 -0.89 -2.27 0.00 0.00 179.45 178.06 2kmr n ILE 9 N -3.12 0.69 -3.53 2.00 5.41 -1.26 -4.99 119.36 114.56 2kmr n ILE 9 Ca -0.02 -0.12 -0.39 0.00 1.00 0.00 0.00 62.75 63.22 2kmr n ILE 9 Cb 0.17 -2.14 -0.10 0.00 -0.71 0.00 0.00 39.64 36.86 2kmr n ILE 9 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 2kmr s LEU 10 N 4.31 4.29 -0.52 1.39 2.96 -1.26 -4.77 118.68 125.08 2kmr s LEU 10 Ca 0.91 -0.20 0.05 0.00 -0.22 0.00 0.00 54.13 54.66 2kmr s LEU 10 Cb -0.54 -2.17 0.18 0.00 0.50 0.00 0.00 46.19 44.16 2kmr s LEU 10 CO 0.46 -0.17 0.44 1.17 -1.32 0.00 0.00 176.35 176.93 2kmr n LYS 11 N 5.13 0.94 -2.13 1.98 0.00 -0.14 -5.01 118.16 118.92 2kmr n LYS 11 Ca -0.13 -3.71 -0.40 0.00 0.00 0.00 0.00 58.31 54.08 2kmr n LYS 11 Cb 0.51 -1.86 -0.03 0.00 0.00 0.00 0.00 35.03 33.65 2kmr n LYS 11 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2kmr s PRO 12 N -0.74 2.91 0.21 1.64 0.04 -1.23 -3.89 135.00 133.94 2kmr s PRO 12 Ca 0.31 0.67 0.04 0.00 0.04 0.00 0.00 61.00 62.06 2kmr s PRO 12 Cb 0.04 -4.29 -0.03 0.00 0.04 0.00 0.00 34.50 30.25 2kmr s PRO 12 CO -0.17 -2.40 0.33 0.08 0.04 0.00 0.00 177.00 174.88 2kmr s VAL 13 N 7.93 5.26 -0.22 -0.36 1.01 -1.11 -4.95 120.40 127.95 2kmr s VAL 13 Ca 0.64 -0.89 0.29 0.00 0.00 0.00 0.00 61.98 62.02 2kmr s VAL 13 Cb -0.14 -3.80 0.34 0.00 0.00 0.00 0.00 36.38 32.78 2kmr s VAL 13 CO 0.23 -0.24 1.83 0.00 0.00 0.00 0.00 175.10 176.92 2kmr n GLY 15 N 0.35 -1.85 0.13 0.00 0.00 -1.25 -3.61 105.19 98.96 2kmr n GLY 15 Ca 0.02 -1.20 -0.21 0.00 0.00 0.00 0.00 46.02 44.63 2kmr n GLY 15 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2kmr h SER 16 N -0.97 0.56 1.27 1.61 0.02 -1.87 -3.37 113.55 110.81 2kmr h SER 16 Ca 0.02 -0.79 0.00 0.00 -0.84 0.00 0.00 61.79 60.18 2kmr h SER 16 Cb 0.95 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.31 2kmr h SER 16 CO 0.01 1.66 0.00 0.47 -1.14 0.00 0.00 176.83 177.83 2kmr n ASP 17 N -3.55 0.81 0.00 3.07 9.92 -1.26 -4.93 116.55 120.60 2kmr n ASP 17 Ca -0.21 0.61 0.00 0.00 -0.53 0.00 0.00 54.79 54.66 2kmr n ASP 17 Cb 1.07 -0.81 0.00 0.00 -0.64 0.00 0.00 41.12 40.73 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 0.92 0.85 3.84 0.44 0.00 -1.24 -5.08 105.19 104.92 2kmr n GLY 18 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.90 3.63 -0.39 1.61 1.70 -1.25 -4.86 118.95 118.48 2kmr s ARG 19 Ca 0.00 0.95 -0.26 0.00 -0.47 0.00 0.00 55.73 55.95 2kmr s ARG 19 Cb 0.00 -2.09 0.02 0.00 -0.57 0.00 0.00 34.95 32.31 2kmr s ARG 19 CO 0.00 -0.54 0.93 0.95 -1.08 0.00 0.00 175.30 175.56 2kmr s THR 20 N -2.78 4.55 0.21 4.99 -4.23 -1.26 -3.92 115.64 113.19 2kmr s THR 20 Ca 0.59 1.07 -0.09 0.00 -1.18 0.00 0.00 61.69 62.08 2kmr s THR 20 Cb -0.12 -4.36 -0.07 0.00 1.34 0.00 0.00 72.50 69.29 2kmr s THR 20 CO 0.41 -0.62 0.52 -0.31 -0.54 0.00 0.00 174.62 174.08 2kmr s TYR 21 N 3.57 3.45 0.08 3.99 1.51 -1.14 -4.94 117.35 123.86 2kmr s TYR 21 Ca 0.38 0.85 -0.20 0.00 -1.01 0.00 0.00 57.07 57.09 2kmr s TYR 21 Cb -0.11 -2.23 -0.10 0.00 -0.11 0.00 0.00 41.96 39.41 2kmr s TYR 21 CO 0.21 0.31 1.53 0.00 -1.11 0.00 0.00 175.55 176.49 2kmr h ALA 22 N 2.68 0.28 -3.21 3.71 0.00 -1.91 -2.94 119.26 117.86 2kmr h ALA 22 Ca -0.47 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.16 2kmr h ALA 22 Cb 1.17 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2kmr h ALA 22 CO 0.69 -0.02 0.16 0.27 0.00 0.00 0.00 179.25 180.35 2kmr n ASN 23 N -4.71 -1.96 0.09 0.00 0.23 -1.25 -0.97 115.26 106.70 2kmr n ASN 23 Ca -0.04 -2.59 0.04 0.00 -0.53 0.00 0.00 54.58 51.46 2kmr n ASN 23 Cb 0.21 3.33 0.45 0.00 -2.08 0.00 0.00 39.78 41.69 2kmr n ASN 23 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2kmr h SER 24 N 1.88 0.29 0.86 0.53 4.64 -1.92 -2.96 113.55 116.87 2kmr h SER 24 Ca -0.30 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 60.95 2kmr h SER 24 Cb 1.17 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2kmr h SER 24 CO 0.39 0.30 -0.47 0.00 -0.87 0.00 0.00 176.83 176.18 2kmr h ILE 26 N -1.22 1.06 0.69 0.00 6.09 -1.96 -0.18 117.51 121.98 2kmr h ILE 26 Ca -0.12 -0.38 -0.03 0.00 -1.37 0.00 0.00 64.86 62.97 2kmr h ILE 26 Cb 0.96 -0.15 -0.01 0.00 0.47 0.00 0.00 36.82 38.09 2kmr h ILE 26 CO 0.15 0.20 -0.47 0.00 -3.07 0.00 0.00 178.15 174.96 2kmr h ALA 27 N 1.45 -1.17 -0.83 0.18 0.00 -1.46 -0.75 119.26 116.68 2kmr h ALA 27 Ca 0.43 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 55.13 2kmr h ALA 27 Cb 0.20 0.61 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 2kmr h ALA 27 CO -0.18 -1.18 0.54 0.00 0.00 0.00 0.00 179.25 178.43 2kmr h ARG 28 N -1.11 1.04 -0.51 0.00 2.47 -1.06 0.54 114.38 115.75 2kmr h ARG 28 Ca -0.09 -0.06 -0.09 0.00 -1.26 0.00 0.00 59.98 58.48 2kmr h ARG 28 Cb 0.91 -0.24 -0.02 0.00 -1.65 0.00 0.00 29.97 28.97 2kmr h ARG 28 CO 0.06 0.69 -0.04 0.00 0.56 0.00 0.00 179.97 181.24 2kmr h ASN 30 N 0.79 0.79 0.00 0.00 -1.24 -0.95 -3.48 115.58 111.49 2kmr h ASN 30 Ca 0.14 -0.55 0.00 0.00 0.71 0.00 0.00 56.30 56.60 2kmr h ASN 30 Cb 0.57 -0.23 0.00 0.00 0.73 0.00 0.00 38.32 39.40 2kmr h ASN 30 CO 0.03 1.19 0.00 0.61 -1.29 0.00 0.00 177.43 177.98 2kmr n GLY 31 N 0.42 1.02 3.55 1.57 0.00 -0.55 -5.10 105.19 106.10 2kmr n GLY 31 Ca -0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.03 1.71 0.10 1.61 1.01 0.07 -5.01 120.40 118.86 2kmr s VAL 32 Ca 0.00 -2.01 -0.07 0.00 0.00 0.00 0.00 61.98 59.90 2kmr s VAL 32 Cb 0.00 -2.90 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 2kmr s VAL 32 CO 0.00 -0.01 0.17 -0.55 0.00 0.00 0.00 175.10 174.71 2kmr s SER 33 N -3.62 0.16 0.00 3.32 0.15 -1.26 -3.34 113.70 109.11 2kmr s SER 33 Ca 0.35 -0.78 0.21 0.00 0.70 0.00 0.00 55.95 56.43 2kmr s SER 33 Cb 0.09 0.34 -0.11 0.00 -1.71 0.00 0.00 66.02 64.63 2kmr s SER 33 CO 0.17 -0.75 0.96 -0.38 1.20 0.00 0.00 173.24 174.44 2kmr n ILE 34 N -0.08 0.00 0.25 6.45 2.08 -1.26 -4.18 119.36 122.62 2kmr n ILE 34 Ca -0.13 -0.15 0.08 0.00 0.56 0.00 0.00 62.75 63.12 2kmr n ILE 34 Cb 0.62 1.13 0.62 0.00 -0.75 0.00 0.00 39.64 41.26 2kmr n ILE 34 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 2kmr h LYS 35 N 1.19 0.00 0.40 0.38 1.79 -1.97 -2.58 116.57 115.78 2kmr h LYS 35 Ca 0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 2kmr h LYS 35 Cb 0.60 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 2kmr h LYS 35 CO 0.00 0.10 -0.19 1.03 -1.08 0.00 0.00 179.45 179.31 2kmr h SER 36 N 0.00 -0.45 -4.52 0.86 0.87 -1.96 -3.48 113.55 104.87 2kmr h SER 36 Ca -0.00 -0.06 0.03 0.00 -1.23 0.00 0.00 61.79 60.53 2kmr h SER 36 Cb 0.20 0.12 -0.21 0.00 -0.44 0.00 0.00 62.40 62.07 2kmr h SER 36 CO 0.01 -0.22 0.40 -1.61 -0.53 0.00 0.00 176.83 174.88 2kmr s GLU 37 N -5.52 0.81 0.00 2.24 2.02 -0.97 -5.12 118.70 112.16 2kmr s GLU 37 Ca -0.15 0.14 0.00 0.00 0.02 0.00 0.00 54.97 54.97 2kmr s GLU 37 Cb 0.03 0.38 0.00 0.00 0.10 0.00 0.00 34.13 34.64 2kmr s GLU 37 CO 0.60 -0.26 0.00 0.41 0.02 0.00 0.00 175.26 176.02 2kmr n GLY 38 N 0.69 1.62 3.66 -1.39 0.00 -1.26 -4.41 105.19 104.10 2kmr n GLY 38 Ca -0.14 -0.25 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 2kmr n GLY 38 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kmr n SER 39 N 0.00 1.72 -3.87 1.61 7.64 -1.26 -4.99 113.62 114.47 2kmr n SER 39 Ca 0.00 0.97 -0.09 0.00 1.01 0.00 0.00 58.87 60.76 2kmr n SER 39 Cb 0.00 -1.45 -0.08 0.00 -1.01 0.00 0.00 64.21 61.68 2kmr n SER 39 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kmr s PRO 41 N -3.54 4.26 0.14 0.00 0.04 -1.26 -4.99 135.00 129.64 2kmr s PRO 41 Ca 0.03 2.01 -0.31 0.00 0.04 0.00 0.00 61.00 62.76 2kmr s PRO 41 Cb 0.04 -3.64 -0.09 0.00 0.04 0.00 0.00 34.50 30.84 2kmr s PRO 41 CO -0.09 -0.63 1.54 0.95 0.04 0.00 0.00 177.00 178.80 2kmr s THR 42 N 2.71 2.85 -0.00 1.26 -4.23 -1.26 -4.95 115.64 112.02 2kmr s THR 42 Ca 0.65 0.57 -0.01 0.00 -1.18 0.00 0.00 61.69 61.72 2kmr s THR 42 Cb -0.32 -3.37 -0.00 0.00 1.34 0.00 0.00 72.50 70.15 2kmr s THR 42 CO 0.26 0.04 -0.02 0.61 -0.54 0.00 0.00 174.62 174.97 2kmr n GLY 43 N 3.73 -0.14 0.05 3.99 0.00 -1.26 -5.37 105.19 106.20 2kmr n GLY 43 Ca 0.14 -0.02 0.01 0.00 0.00 0.00 0.00 46.02 46.14 2kmr n GLY 43 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83