#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kzi s GLU 2 N 0.00 4.36 -0.43 2.12 2.12 -1.26 -4.91 118.70 120.70 3kzi s GLU 2 Ca 0.00 1.82 -0.29 0.00 0.36 0.00 0.00 54.97 56.86 3kzi s GLU 2 Cb 0.00 -3.46 -0.08 0.00 0.26 0.00 0.00 34.13 30.85 3kzi s GLU 2 CO 0.00 -0.41 2.35 -2.30 -0.54 0.00 0.00 175.26 174.36 3kzi n PRO 3 N 4.68 1.24 -1.70 4.30 -0.02 -1.26 -4.83 135.00 137.41 3kzi n PRO 3 Ca 0.11 0.21 -0.58 0.00 -2.02 0.00 0.00 63.50 61.22 3kzi n PRO 3 Cb 0.45 -3.06 -0.07 0.00 -0.02 0.00 0.00 33.50 30.80 3kzi n PRO 3 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3kzi n ASN 4 N 13.22 2.23 -0.74 2.55 2.85 -1.26 -4.86 115.26 129.24 3kzi n ASN 4 Ca 0.38 1.09 0.02 0.00 -0.11 0.00 0.00 54.58 55.96 3kzi n ASN 4 Cb 0.42 -1.13 0.11 0.00 1.24 0.00 0.00 39.78 40.42 3kzi n ASN 4 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3kzi n PRO 5 N 5.00 1.91 -0.04 1.20 -0.04 -1.26 -4.04 135.00 137.72 3kzi n PRO 5 Ca 0.26 -0.83 0.08 0.00 -0.04 0.00 0.00 63.50 62.98 3kzi n PRO 5 Cb 0.12 -1.56 0.09 0.00 -0.04 0.00 0.00 33.50 32.11 3kzi n PRO 5 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3kzi n ASN 6 N 0.15 2.55 -4.82 3.54 4.13 -1.26 -5.00 115.26 114.55 3kzi n ASN 6 Ca 0.07 -1.74 -0.38 0.00 1.68 0.00 0.00 54.58 54.21 3kzi n ASN 6 Cb 0.42 -0.05 -0.06 0.00 -1.54 0.00 0.00 39.78 38.55 3kzi n ASN 6 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3kzi s ARG 7 N -1.34 4.10 0.31 3.52 1.04 -1.26 -5.10 118.95 120.23 3kzi s ARG 7 Ca 0.22 0.62 0.07 0.00 -1.04 0.00 0.00 55.73 55.60 3kzi s ARG 7 Cb 0.15 -3.21 -0.06 0.00 -2.04 0.00 0.00 34.95 29.78 3kzi s ARG 7 CO 0.21 0.65 -0.04 -0.65 -0.04 0.00 0.00 175.30 175.43 3kzi s GLN 8 N -1.15 1.65 0.57 3.89 1.11 -1.26 -5.15 119.66 119.31 3kzi s GLN 8 Ca 0.28 -1.86 -0.07 0.00 0.01 0.00 0.00 55.36 53.72 3kzi s GLN 8 Cb -0.18 -1.25 -0.02 0.00 -1.01 0.00 0.00 33.01 30.55 3kzi s GLN 8 CO 0.17 0.01 0.90 -1.25 0.01 0.00 0.00 175.29 175.14 3kzi s PRO 9 N -3.73 3.29 0.05 2.91 0.04 -1.26 -5.08 135.00 131.22 3kzi s PRO 9 Ca 0.32 0.27 0.05 0.00 0.04 0.00 0.00 61.00 61.68 3kzi s PRO 9 Cb 0.05 -2.25 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 3kzi s PRO 9 CO 0.14 -0.52 -0.07 0.08 0.04 0.00 0.00 177.00 176.67 3kzi s VAL 10 N -2.97 3.57 0.02 -0.36 1.01 -1.26 -5.13 120.40 115.28 3kzi s VAL 10 Ca 0.52 -0.99 -0.00 0.00 0.00 0.00 0.00 61.98 61.51 3kzi s VAL 10 Cb -0.11 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 3kzi s VAL 10 CO 0.47 0.26 -0.02 -0.70 0.00 0.00 0.00 175.10 175.11 3kzi s GLU 11 N -1.81 0.26 -0.23 2.72 2.12 -1.26 -5.12 118.70 115.38 3kzi s GLU 11 Ca 0.20 -0.50 -0.03 0.00 0.36 0.00 0.00 54.97 54.99 3kzi s GLU 11 Cb -0.11 0.09 0.11 0.00 0.26 0.00 0.00 34.13 34.48 3kzi s GLU 11 CO 0.11 -0.04 0.29 -1.17 -0.54 0.00 0.00 175.26 173.90 3kzi s LEU 12 N -1.21 -0.31 1.00 2.70 2.96 -1.26 -5.16 118.68 117.40 3kzi s LEU 12 Ca -0.13 -0.12 -0.13 0.00 -0.22 0.00 0.00 54.13 53.52 3kzi s LEU 12 Cb -0.08 0.66 0.19 0.00 0.50 0.00 0.00 46.19 47.45 3kzi s LEU 12 CO -0.01 -0.32 1.12 0.54 -1.32 0.00 0.00 176.35 176.36 3kzi s ASN 13 N 2.41 2.67 0.13 3.68 2.20 -1.26 -4.84 114.94 119.92 3kzi s ASN 13 Ca 0.09 0.98 -0.16 0.00 -0.94 0.00 0.00 52.86 52.83 3kzi s ASN 13 Cb -0.15 -1.53 -0.02 0.00 -2.00 0.00 0.00 41.25 37.55 3kzi s ASN 13 CO -0.16 -3.08 1.66 -0.09 -2.94 0.00 0.00 177.10 172.50 3kzi h ARG 14 N -1.86 0.55 -0.90 3.55 2.43 -2.01 -2.03 114.38 114.10 3kzi h ARG 14 Ca -0.52 -0.11 0.05 0.00 -0.81 0.00 0.00 59.98 58.59 3kzi h ARG 14 Cb 1.32 -0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 30.73 3kzi h ARG 14 CO 0.55 0.54 0.58 1.15 -1.51 0.00 0.00 179.97 181.29 3kzi h THR 15 N 0.44 1.11 -0.80 0.20 2.02 -2.00 -0.91 112.91 112.98 3kzi h THR 15 Ca 0.12 -0.38 -0.03 0.00 0.77 0.00 0.00 66.41 66.90 3kzi h THR 15 Cb 0.20 -0.08 -0.04 0.00 -1.74 0.00 0.00 68.15 66.50 3kzi h THR 15 CO -0.01 0.20 0.38 0.28 0.37 0.00 0.00 175.52 176.74 3kzi h SER 16 N 1.09 1.04 -0.10 4.18 0.02 -1.85 0.64 113.55 118.58 3kzi h SER 16 Ca 0.37 -0.12 0.03 0.00 -0.84 0.00 0.00 61.79 61.23 3kzi h SER 16 Cb 0.07 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.31 3kzi h SER 16 CO -0.14 0.88 -0.10 0.25 -1.14 0.00 0.00 176.83 176.58 3kzi h LEU 17 N 1.13 -0.31 0.49 5.07 5.85 -0.48 0.55 115.31 127.62 3kzi h LEU 17 Ca 0.27 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 59.04 3kzi h LEU 17 Cb 0.12 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 3kzi h LEU 17 CO -0.03 -0.13 -0.29 1.88 -0.34 0.00 0.00 178.44 179.52 3kzi h TYR 18 N -0.12 -0.77 -0.91 1.25 0.05 -0.73 1.00 116.97 116.73 3kzi h TYR 18 Ca 0.07 -0.01 0.15 0.00 0.05 0.00 0.00 58.73 59.00 3kzi h TYR 18 Cb 0.23 0.27 -0.07 0.00 1.01 0.00 0.00 36.73 38.16 3kzi h TYR 18 CO -0.21 -0.45 0.58 -0.07 -1.05 0.00 0.00 178.16 176.96 3kzi h LEU 19 N -0.75 0.66 0.48 3.88 3.38 -0.60 0.19 115.31 122.55 3kzi h LEU 19 Ca -0.06 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 3kzi h LEU 19 Cb 0.60 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3kzi h LEU 19 CO 0.06 0.32 -0.23 1.23 0.09 0.00 0.00 178.44 179.91 3kzi h GLY 20 N 0.69 -0.67 0.07 0.83 0.00 0.84 -2.82 103.07 101.99 3kzi h GLY 20 Ca 0.47 0.25 0.17 0.00 0.00 0.00 0.00 47.33 48.22 3kzi h GLY 20 CO -0.22 -0.24 0.42 1.41 0.00 0.00 0.00 176.54 177.91 3kzi h LEU 21 N -0.70 0.46 -0.95 3.11 3.38 -0.31 0.15 115.31 120.44 3kzi h LEU 21 Ca -0.07 0.11 0.12 0.00 0.09 0.00 0.00 57.88 58.13 3kzi h LEU 21 Cb 0.49 0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.22 3kzi h LEU 21 CO 0.11 0.14 0.58 0.25 0.09 0.00 0.00 178.44 179.60 3kzi h LEU 22 N 0.54 0.84 0.02 1.67 5.85 -0.62 -0.33 115.31 123.28 3kzi h LEU 22 Ca 0.50 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 59.27 3kzi h LEU 22 Cb 0.81 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.73 3kzi h LEU 22 CO -0.42 0.45 -0.01 0.25 -0.34 0.00 0.00 178.44 178.36 3kzi h LEU 23 N 0.92 -0.02 0.42 2.25 5.85 -0.48 -2.21 115.31 122.04 3kzi h LEU 23 Ca 0.47 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3kzi h LEU 23 Cb 0.47 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 3kzi h LEU 23 CO -0.27 0.33 -0.35 0.40 -0.34 0.00 0.00 178.44 178.21 3kzi h ILE 24 N -0.37 0.28 0.13 4.05 5.03 -0.86 -0.79 117.51 124.97 3kzi h ILE 24 Ca -0.00 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 64.76 3kzi h ILE 24 Cb 0.35 0.28 -0.04 0.00 -3.03 0.00 0.00 36.82 34.37 3kzi h ILE 24 CO 0.00 0.00 -0.42 -0.07 -0.68 0.00 0.00 178.15 176.99 3kzi h LEU 25 N -0.78 -1.22 -1.22 1.44 3.38 -1.14 -1.26 115.31 114.52 3kzi h LEU 25 Ca -0.04 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3kzi h LEU 25 Cb 0.68 0.46 -0.04 0.00 0.09 0.00 0.00 40.66 41.85 3kzi h LEU 25 CO -0.02 -0.49 0.47 -0.37 0.09 0.00 0.00 178.44 178.12 3kzi h VAL 26 N -0.65 1.20 -0.77 1.22 -1.51 -1.36 0.80 116.25 115.17 3kzi h VAL 26 Ca 0.02 -0.41 0.03 0.00 -1.23 0.00 0.00 66.70 65.11 3kzi h VAL 26 Cb 0.68 0.13 -0.05 0.00 -2.13 0.00 0.00 31.29 29.92 3kzi h VAL 26 CO -0.24 0.20 0.49 -0.07 -1.23 0.00 0.00 177.57 176.73 3kzi h LEU 27 N 1.02 0.80 -1.32 4.19 3.38 -0.82 0.12 115.31 122.68 3kzi h LEU 27 Ca 0.27 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 3kzi h LEU 27 Cb -0.07 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 3kzi h LEU 27 CO -0.05 0.55 0.30 0.00 0.09 0.00 0.00 178.44 179.33 3kzi h ALA 28 N 1.33 1.49 0.00 1.53 0.00 0.11 0.41 119.26 124.12 3kzi h ALA 28 Ca 0.31 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 3kzi h ALA 28 Cb 0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3kzi h ALA 28 CO -0.12 0.43 -0.29 1.25 0.00 0.00 0.00 179.25 180.52 3kzi h LEU 29 N 0.78 0.00 0.10 0.00 5.85 0.60 -1.94 115.31 120.70 3kzi h LEU 29 Ca 0.20 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.61 3kzi h LEU 29 Cb 0.02 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 3kzi h LEU 29 CO -0.03 0.29 -1.61 0.25 -0.34 0.00 0.00 178.44 176.99 3kzi h LEU 30 N 0.00 0.33 0.00 2.25 5.85 0.11 -3.40 115.31 120.45 3kzi h LEU 30 Ca -0.00 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 58.20 3kzi h LEU 30 Cb 0.90 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.82 3kzi h LEU 30 CO 0.04 1.44 -1.62 0.49 -0.34 0.00 0.00 178.44 178.44 3kzi n PHE 31 N -3.40 0.19 -0.34 1.25 3.01 0.13 -4.42 117.46 113.87 3kzi n PHE 31 Ca -0.18 0.05 0.08 0.00 1.01 0.00 0.00 57.45 58.41 3kzi n PHE 31 Cb 1.04 -0.51 0.27 0.00 -0.01 0.00 0.00 39.48 40.27 3kzi n PHE 31 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3kzi h SER 32 N 0.00 0.88 -0.99 4.37 4.64 -1.56 -1.13 113.55 119.76 3kzi h SER 32 Ca 0.00 0.05 0.06 0.00 -0.47 0.00 0.00 61.79 61.42 3kzi h SER 32 Cb 0.92 -0.13 -0.06 0.00 -0.31 0.00 0.00 62.40 62.81 3kzi h SER 32 CO 0.00 0.46 0.64 0.28 -0.87 0.00 0.00 176.83 177.34 3kzi h SER 33 N 0.94 1.04 1.67 4.97 0.02 -1.82 -0.87 113.55 119.50 3kzi h SER 33 Ca 0.49 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.38 3kzi h SER 33 Cb 0.54 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 3kzi h SER 33 CO -0.26 0.68 -0.33 1.88 -1.14 0.00 0.00 176.83 177.66 3kzi h TYR 34 N 1.19 0.00 -0.14 3.45 0.05 -1.51 -0.24 116.97 119.76 3kzi h TYR 34 Ca 0.42 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 59.01 3kzi h TYR 34 Cb 0.12 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.87 3kzi h TYR 34 CO -0.00 0.27 -0.63 0.74 -1.05 0.00 0.00 178.16 177.49 3kzi h PHE 35 N 0.00 0.91 0.00 4.88 -1.00 -0.43 -2.90 116.94 118.39 3kzi h PHE 35 Ca -0.01 -0.39 -0.07 0.00 2.81 0.00 0.00 57.97 60.31 3kzi h PHE 35 Cb 1.21 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 40.62 3kzi h PHE 35 CO 0.00 1.20 -0.32 0.74 -1.61 0.00 0.00 178.31 178.32 3kzi h PHE 36 N 0.35 0.00 0.00 -0.55 0.04 -1.22 -3.51 116.94 112.05 3kzi h PHE 36 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 3kzi h PHE 36 Cb 1.27 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.42 3kzi h PHE 36 CO 0.10 0.32 0.00 -1.71 -0.60 0.00 0.00 178.31 176.42