#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 -4.39 0.00 -1.58 4.76 -1.26 -4.87 118.16 110.82 2kmr n LYS 2 Ca 0.00 0.57 0.00 0.00 -2.87 0.00 0.00 58.31 56.01 2kmr n LYS 2 Cb 0.00 -5.37 0.00 0.00 -1.84 0.00 0.00 35.03 27.82 2kmr n LYS 2 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58 2kmr n VAL 3 N -4.33 0.00 -1.73 -0.18 3.14 -1.26 -5.00 118.33 108.97 2kmr n VAL 3 Ca 0.00 -0.49 -0.39 0.00 -2.96 0.00 0.00 64.34 60.50 2kmr n VAL 3 Cb 0.54 1.01 -0.03 0.00 -1.06 0.00 0.00 33.84 34.30 2kmr n VAL 3 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kmr n ALA 5 N 13.51 4.54 -1.09 0.00 0.00 -1.26 -4.95 120.51 131.26 2kmr n ALA 5 Ca 0.30 -1.64 -0.32 0.00 0.00 0.00 0.00 53.44 51.78 2kmr n ALA 5 Cb 0.51 -2.71 0.12 0.00 0.00 0.00 0.00 19.45 17.37 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 -4.40 2.27 0.59 0.00 0.04 -1.26 -4.93 135.00 127.31 2kmr s PRO 7 Ca 0.68 1.61 0.29 0.00 0.04 0.00 0.00 61.00 63.62 2kmr s PRO 7 Cb -0.24 -1.87 1.78 0.00 0.04 0.00 0.00 34.50 34.22 2kmr s PRO 7 CO 0.52 -1.70 2.24 1.57 0.04 0.00 0.00 177.00 179.67 2kmr h LYS 8 N -0.33 0.00 -6.87 4.56 2.10 -2.03 -3.45 116.57 110.54 2kmr h LYS 8 Ca -0.47 0.00 -0.56 0.00 -2.00 0.00 0.00 60.65 57.62 2kmr h LYS 8 Cb 1.28 0.00 0.13 0.00 -0.90 0.00 0.00 32.23 32.74 2kmr h LYS 8 CO 0.51 0.00 0.46 1.51 -2.00 0.00 0.00 179.45 179.92 2kmr n ILE 9 N -3.89 3.02 -4.05 0.07 0.13 -1.26 -5.03 119.36 108.35 2kmr n ILE 9 Ca -0.03 -0.50 -0.32 0.00 -1.10 0.00 0.00 62.75 60.80 2kmr n ILE 9 Cb 0.10 -1.52 -0.15 0.00 -0.84 0.00 0.00 39.64 37.23 2kmr n ILE 9 CO 0.00 0.00 0.00 -0.22 2.80 0.00 0.00 176.55 179.13 2kmr s LEU 10 N -2.12 3.71 -0.57 9.51 2.96 -1.26 -4.75 118.68 126.16 2kmr s LEU 10 Ca 0.66 -1.53 0.05 0.00 -0.22 0.00 0.00 54.13 53.09 2kmr s LEU 10 Cb -0.47 -1.57 0.18 0.00 0.50 0.00 0.00 46.19 44.82 2kmr s LEU 10 CO 0.54 -0.23 0.45 1.17 -1.32 0.00 0.00 176.35 176.96 2kmr n LYS 11 N 4.41 1.16 -2.24 1.98 4.81 -0.37 -5.03 118.16 122.88 2kmr n LYS 11 Ca -0.11 -3.92 -0.32 0.00 -0.87 0.00 0.00 58.31 53.09 2kmr n LYS 11 Cb 0.42 -1.99 -0.04 0.00 0.02 0.00 0.00 35.03 33.44 2kmr n LYS 11 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2kmr s PRO 12 N -0.90 2.95 0.58 1.64 0.04 -1.22 -3.94 135.00 134.14 2kmr s PRO 12 Ca 0.29 -0.58 -0.08 0.00 0.04 0.00 0.00 61.00 60.67 2kmr s PRO 12 Cb 0.01 -5.15 -0.02 0.00 0.04 0.00 0.00 34.50 29.38 2kmr s PRO 12 CO -0.17 -2.92 0.93 0.08 0.04 0.00 0.00 177.00 174.96 2kmr s VAL 13 N 8.12 4.48 -0.34 -0.36 1.01 -1.23 -4.94 120.40 127.13 2kmr s VAL 13 Ca 0.61 0.46 -0.29 0.00 0.00 0.00 0.00 61.98 62.76 2kmr s VAL 13 Cb -0.04 -3.76 -0.00 0.00 0.00 0.00 0.00 36.38 32.57 2kmr s VAL 13 CO -0.04 -0.88 1.53 0.00 0.00 0.00 0.00 175.10 175.71 2kmr s GLY 15 N 4.35 2.84 0.49 0.00 0.00 -0.08 -4.94 107.32 109.97 2kmr s GLY 15 Ca 0.67 1.13 0.16 0.00 0.00 0.00 0.00 44.72 46.68 2kmr s GLY 15 CO 0.31 1.63 2.09 1.48 0.00 0.00 0.00 173.10 178.61 2kmr h SER 16 N 1.86 0.00 0.61 1.64 4.64 -1.86 -1.21 113.55 119.23 2kmr h SER 16 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2kmr h SER 16 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2kmr h SER 16 CO 0.59 0.07 -0.20 -0.67 -0.87 0.00 0.00 176.83 175.75 2kmr n ASP 17 N -4.44 0.34 0.00 4.97 2.03 -1.26 -4.93 116.55 113.26 2kmr n ASP 17 Ca -0.03 -0.12 0.00 0.00 0.52 0.00 0.00 54.79 55.16 2kmr n ASP 17 Cb 0.15 -0.10 0.00 0.00 -0.72 0.00 0.00 41.12 40.44 2kmr n ASP 17 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kmr n GLY 18 N 1.43 0.74 0.88 0.27 0.00 -0.46 -5.12 105.19 102.93 2kmr n GLY 18 Ca 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.06 2kmr n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kmr n ARG 19 N -1.25 0.33 -4.63 1.61 1.74 -1.25 -4.80 116.66 108.40 2kmr n ARG 19 Ca 0.00 -0.59 -0.24 0.00 -0.77 0.00 0.00 57.85 56.25 2kmr n ARG 19 Cb 0.00 -0.18 -0.16 0.00 -1.02 0.00 0.00 32.46 31.10 2kmr n ARG 19 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2kmr s THR 20 N -0.71 1.14 0.04 0.55 2.01 -1.26 -0.91 115.64 116.51 2kmr s THR 20 Ca 0.15 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 61.62 2kmr s THR 20 Cb -0.01 -0.99 -0.02 0.00 0.01 0.00 0.00 72.50 71.49 2kmr s THR 20 CO 0.10 0.34 -0.08 -0.31 -0.69 0.00 0.00 174.62 173.98 2kmr s TYR 21 N 0.14 0.68 0.12 4.92 1.51 -1.25 -4.97 117.35 118.49 2kmr s TYR 21 Ca -0.04 -0.52 -0.16 0.00 -1.01 0.00 0.00 57.07 55.34 2kmr s TYR 21 Cb -0.10 -0.41 -0.03 0.00 -0.11 0.00 0.00 41.96 41.31 2kmr s TYR 21 CO 0.01 -0.09 1.63 0.00 -1.11 0.00 0.00 175.55 176.00 2kmr h ALA 22 N 4.43 0.48 -2.99 3.71 0.00 -1.93 -3.26 119.26 119.70 2kmr h ALA 22 Ca -0.36 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.31 2kmr h ALA 22 Cb 1.20 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2kmr h ALA 22 CO 0.42 0.13 0.19 0.54 0.00 0.00 0.00 179.25 180.52 2kmr s ASN 23 N -5.92 0.18 0.51 0.00 2.20 -1.25 -1.23 114.94 109.43 2kmr s ASN 23 Ca -0.13 -1.20 0.17 0.00 -0.94 0.00 0.00 52.86 50.75 2kmr s ASN 23 Cb 0.09 0.82 1.27 0.00 -2.00 0.00 0.00 41.25 41.43 2kmr s ASN 23 CO 0.76 -1.61 2.13 0.77 -2.94 0.00 0.00 177.10 176.21 2kmr h SER 24 N 2.02 0.00 0.74 3.54 4.64 -1.90 -2.87 113.55 119.72 2kmr h SER 24 Ca -0.31 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.97 2kmr h SER 24 Cb 1.25 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.35 2kmr h SER 24 CO 0.40 0.03 -0.36 0.00 -0.87 0.00 0.00 176.83 176.03 2kmr h ILE 26 N -1.08 1.19 0.39 0.00 6.09 -1.94 -0.56 117.51 121.60 2kmr h ILE 26 Ca -0.10 -0.37 -0.01 0.00 -1.37 0.00 0.00 64.86 63.01 2kmr h ILE 26 Cb 0.78 0.03 -0.01 0.00 0.47 0.00 0.00 36.82 38.09 2kmr h ILE 26 CO 0.17 0.19 -0.31 0.00 -3.07 0.00 0.00 178.15 175.13 2kmr h ALA 27 N 1.51 -0.71 -0.87 0.18 0.00 -1.48 -1.02 119.26 116.87 2kmr h ALA 27 Ca 0.30 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2kmr h ALA 27 Cb -0.09 0.43 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2kmr h ALA 27 CO -0.07 -0.93 0.50 0.00 0.00 0.00 0.00 179.25 178.76 2kmr h ARG 28 N -0.71 1.20 -0.42 0.00 3.08 -0.94 0.25 114.38 116.84 2kmr h ARG 28 Ca -0.03 -0.12 -0.07 0.00 0.07 0.00 0.00 59.98 59.82 2kmr h ARG 28 Cb 0.61 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 2kmr h ARG 28 CO -0.01 0.86 -0.04 0.00 -1.07 0.00 0.00 179.97 179.70 2kmr h ASN 30 N 0.66 0.24 0.00 0.00 -0.73 -0.86 -3.48 115.58 111.41 2kmr h ASN 30 Ca 0.13 -0.61 0.00 0.00 1.87 0.00 0.00 56.30 57.69 2kmr h ASN 30 Cb 0.47 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 38.99 2kmr h ASN 30 CO 0.02 0.81 0.00 0.61 -0.37 0.00 0.00 177.43 178.50 2kmr n GLY 31 N 0.57 0.42 3.25 1.57 0.00 -0.24 -5.10 105.19 105.65 2kmr n GLY 31 Ca -0.08 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.42 1.45 0.06 1.61 1.01 -0.09 -5.00 120.40 119.02 2kmr s VAL 32 Ca 0.00 -1.60 -0.03 0.00 0.00 0.00 0.00 61.98 60.35 2kmr s VAL 32 Cb 0.00 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 2kmr s VAL 32 CO 0.00 -0.26 0.03 -0.44 0.00 0.00 0.00 175.10 174.43 2kmr s SER 33 N -2.16 0.40 -0.00 3.32 0.01 -1.26 -2.50 113.70 111.50 2kmr s SER 33 Ca 0.07 -0.92 0.07 0.00 1.31 0.00 0.00 55.95 56.48 2kmr s SER 33 Cb -0.08 0.24 -0.09 0.00 0.21 0.00 0.00 66.02 66.30 2kmr s SER 33 CO 0.04 -0.63 0.27 -0.38 0.41 0.00 0.00 173.24 172.94 2kmr n ILE 34 N 0.07 0.00 0.24 1.44 5.41 -1.26 -4.50 119.36 120.75 2kmr n ILE 34 Ca -0.14 -0.28 0.16 0.00 1.00 0.00 0.00 62.75 63.48 2kmr n ILE 34 Cb 0.61 0.81 0.84 0.00 -0.71 0.00 0.00 39.64 41.19 2kmr n ILE 34 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 176.55 176.62 2kmr h LYS 35 N 0.00 0.00 -0.02 0.38 5.09 -1.98 -2.94 116.57 117.09 2kmr h LYS 35 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 60.65 60.74 2kmr h LYS 35 Cb 0.22 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 32.55 2kmr h LYS 35 CO 0.00 0.00 0.01 0.77 -2.09 0.00 0.00 179.45 178.14 2kmr h SER 36 N 0.00 0.03 -3.40 7.07 0.02 -1.89 -3.46 113.55 111.92 2kmr h SER 36 Ca 0.05 -0.18 -0.04 0.00 -0.84 0.00 0.00 61.79 60.78 2kmr h SER 36 Cb 0.28 -0.01 -0.23 0.00 0.14 0.00 0.00 62.40 62.58 2kmr h SER 36 CO -0.00 0.20 -0.06 -1.83 -1.14 0.00 0.00 176.83 174.00 2kmr s GLU 37 N -5.48 0.64 0.00 3.45 -1.05 -1.11 -5.03 118.70 110.12 2kmr s GLU 37 Ca -0.14 0.99 0.00 0.00 -0.15 0.00 0.00 54.97 55.67 2kmr s GLU 37 Cb 0.05 0.18 0.00 0.00 -0.44 0.00 0.00 34.13 33.92 2kmr s GLU 37 CO 0.67 -0.13 0.00 0.41 0.95 0.00 0.00 175.26 177.16 2kmr n GLY 38 N 3.73 2.12 3.42 -3.83 0.00 -1.25 -4.84 105.19 104.54 2kmr n GLY 38 Ca -0.18 -0.30 -0.09 0.00 0.00 0.00 0.00 46.02 45.44 2kmr n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kmr s SER 39 N 0.00 -0.06 -0.43 1.61 1.04 -1.26 -5.12 113.70 109.48 2kmr s SER 39 Ca 0.00 -0.77 0.08 0.00 0.48 0.00 0.00 55.95 55.74 2kmr s SER 39 Cb 0.00 0.50 0.28 0.00 0.10 0.00 0.00 66.02 66.90 2kmr s SER 39 CO 0.00 -0.97 0.78 0.00 0.98 0.00 0.00 173.24 174.03 2kmr s PRO 41 N -0.63 2.97 0.36 0.00 0.04 -1.26 -4.98 135.00 131.50 2kmr s PRO 41 Ca 0.33 0.80 -0.28 0.00 0.04 0.00 0.00 61.00 61.88 2kmr s PRO 41 Cb 0.25 -4.27 -0.11 0.00 0.04 0.00 0.00 34.50 30.40 2kmr s PRO 41 CO -0.13 -2.31 1.48 0.99 0.04 0.00 0.00 177.00 177.07 2kmr s THR 42 N 7.79 2.13 0.09 1.26 2.01 -1.26 -5.04 115.64 122.63 2kmr s THR 42 Ca 0.67 0.13 -0.26 0.00 0.31 0.00 0.00 61.69 62.54 2kmr s THR 42 Cb -0.15 -3.08 0.08 0.00 0.01 0.00 0.00 72.50 69.36 2kmr s THR 42 CO 0.25 0.03 0.90 -0.83 -0.69 0.00 0.00 174.62 174.28 2kmr s GLY 43 N -0.07 -0.35 0.00 4.40 0.00 -1.26 -5.36 107.32 104.68 2kmr s GLY 43 Ca 0.54 0.49 0.00 0.00 0.00 0.00 0.00 44.72 45.75 2kmr s GLY 43 CO 0.60 0.14 0.00 4.51 0.00 0.00 0.00 173.10 178.35