#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i20 s LYS 2 N 0.00 3.45 0.00 3.17 1.02 -1.11 -4.89 119.74 121.38 3i20 s LYS 2 Ca 0.00 1.12 0.00 0.00 0.02 0.00 0.00 55.97 57.11 3i20 s LYS 2 Cb 0.00 -2.06 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 3i20 s LYS 2 CO 0.00 -0.70 0.00 1.33 -0.92 0.00 0.00 175.35 175.06 3i20 n VAL 3 N -2.01 0.00 0.00 3.17 0.24 -1.26 -1.38 118.33 117.09 3i20 n VAL 3 Ca 0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.38 3i20 n VAL 3 Cb 0.53 -0.58 0.00 0.00 -1.47 0.00 0.00 33.84 32.32 3i20 n VAL 3 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 3i20 n ARG 4 N -2.18 0.00 -0.07 7.34 1.85 -1.26 -3.82 116.66 118.52 3i20 n ARG 4 Ca 0.00 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.74 3i20 n ARG 4 Cb 0.43 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.76 3i20 n ARG 4 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3i20 h ALA 5 N 0.00 0.04 -2.73 2.89 0.00 -1.91 -3.42 119.26 114.13 3i20 h ALA 5 Ca 0.00 -0.49 -0.56 0.00 0.00 0.00 0.00 54.91 53.86 3i20 h ALA 5 Cb 0.00 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 3i20 h ALA 5 CO 0.00 0.15 0.04 -1.54 0.00 0.00 0.00 179.25 177.90 3i20 s SER 6 N -6.12 7.00 -0.08 0.00 1.04 -1.26 -4.41 113.70 109.87 3i20 s SER 6 Ca -0.16 1.20 -0.10 0.00 0.48 0.00 0.00 55.95 57.37 3i20 s SER 6 Cb -0.00 -2.39 -0.03 0.00 0.10 0.00 0.00 66.02 63.69 3i20 s SER 6 CO 0.47 0.00 -0.19 1.33 0.98 0.00 0.00 173.24 175.83 3i20 n VAL 7 N 3.17 1.08 -1.48 5.02 0.24 -1.26 -5.05 118.33 120.05 3i20 n VAL 7 Ca -0.04 0.25 0.19 0.00 -2.04 0.00 0.00 64.34 62.70 3i20 n VAL 7 Cb 0.51 -1.95 -0.07 0.00 -1.47 0.00 0.00 33.84 30.86 3i20 n VAL 7 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3i20 n LYS 8 N -3.78 -3.23 -3.90 7.34 5.02 -1.26 -4.91 118.16 113.44 3i20 n LYS 8 Ca -0.08 2.44 -0.25 0.00 -2.02 0.00 0.00 58.31 58.41 3i20 n LYS 8 Cb 0.28 -3.85 -0.03 0.00 -0.02 0.00 0.00 35.03 31.42 3i20 n LYS 8 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3i20 s LYS 9 N -3.41 3.45 0.00 1.97 3.01 -1.26 -4.91 119.74 118.60 3i20 s LYS 9 Ca 0.00 -0.60 0.00 0.00 -1.01 0.00 0.00 55.97 54.36 3i20 s LYS 9 Cb 0.00 -2.92 0.00 0.00 -1.01 0.00 0.00 37.83 33.90 3i20 s LYS 9 CO 0.00 0.47 0.00 1.28 0.51 0.00 0.00 175.35 177.61 3i20 n LEU 10 N -0.84 1.04 -5.03 3.17 4.77 -1.26 -5.06 117.00 113.80 3i20 n LEU 10 Ca -0.07 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.72 3i20 n LEU 10 Cb 0.55 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.68 3i20 n LEU 10 CO 0.48 0.16 0.29 0.00 -1.33 0.00 0.00 177.39 176.98 3i20 n ARG 12 N -2.13 0.23 -0.00 0.00 1.85 -1.26 -2.62 116.66 112.73 3i20 n ARG 12 Ca 0.13 0.14 0.11 0.00 -1.00 0.00 0.00 57.85 57.23 3i20 n ARG 12 Cb 0.61 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 30.37 3i20 n ARG 12 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3i20 n ASN 13 N -1.27 0.49 -4.59 2.89 3.02 -1.26 -4.99 115.26 109.55 3i20 n ASN 13 Ca 0.07 -0.48 -0.41 0.00 -0.03 0.00 0.00 54.58 53.74 3i20 n ASN 13 Cb 0.12 1.51 0.02 0.00 -0.61 0.00 0.00 39.78 40.81 3i20 n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3i20 n LYS 15 N -0.03 0.42 -1.92 0.00 5.02 0.32 -4.92 118.16 117.05 3i20 n LYS 15 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 3i20 n LYS 15 Cb 0.41 -0.99 0.00 0.00 -0.02 0.00 0.00 35.03 34.43 3i20 n LYS 15 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3i20 n ILE 16 N -1.51 -8.94 -3.68 -0.18 2.08 -1.25 -4.87 119.36 101.01 3i20 n ILE 16 Ca 0.00 2.40 -0.11 0.00 0.56 0.00 0.00 62.75 65.61 3i20 n ILE 16 Cb 0.04 -3.86 -0.11 0.00 -0.75 0.00 0.00 39.64 34.96 3i20 n ILE 16 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 3i20 s VAL 17 N -0.57 -0.31 -0.35 1.39 1.01 -0.06 -4.89 120.40 116.62 3i20 s VAL 17 Ca 0.00 0.16 -0.25 0.00 0.00 0.00 0.00 61.98 61.89 3i20 s VAL 17 Cb 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 36.38 35.82 3i20 s VAL 17 CO 0.00 0.07 0.85 -0.75 0.00 0.00 0.00 175.10 175.27 3i20 s LYS 18 N 1.98 3.84 0.11 2.72 2.20 -1.26 -0.87 119.74 128.45 3i20 s LYS 18 Ca -0.05 0.51 0.10 0.00 -0.36 0.00 0.00 55.97 56.16 3i20 s LYS 18 Cb -0.10 -3.79 -0.04 0.00 -1.51 0.00 0.00 37.83 32.39 3i20 s LYS 18 CO -0.12 -0.86 -0.23 1.03 -0.36 0.00 0.00 175.35 174.82 3i20 s ARG 19 N 3.24 1.64 0.12 4.03 0.52 -1.00 -4.95 118.95 122.55 3i20 s ARG 19 Ca 0.35 -1.23 0.00 0.00 -0.52 0.00 0.00 55.73 54.33 3i20 s ARG 19 Cb -0.13 -2.01 0.00 0.00 0.52 0.00 0.00 34.95 33.34 3i20 s ARG 19 CO 0.17 0.48 0.00 -0.25 0.02 0.00 0.00 175.30 175.71 3i20 n ASP 20 N 1.05 0.00 -1.45 0.23 10.43 -1.26 0.17 116.55 125.72 3i20 n ASP 20 Ca -0.17 0.00 0.06 0.00 2.57 0.00 0.00 54.79 57.25 3i20 n ASP 20 Cb 0.53 0.00 0.32 0.00 1.84 0.00 0.00 41.12 43.81 3i20 n ASP 20 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3i20 n GLY 21 N 0.00 3.61 3.17 0.44 0.00 -1.26 -4.99 105.19 106.16 3i20 n GLY 21 Ca 0.00 -1.00 -0.30 0.00 0.00 0.00 0.00 46.02 44.72 3i20 n GLY 21 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i20 s VAL 22 N -2.85 1.84 0.10 1.61 1.01 0.13 -5.07 120.40 117.16 3i20 s VAL 22 Ca 0.49 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 3i20 s VAL 22 Cb 0.39 -1.60 -0.06 0.00 0.00 0.00 0.00 36.38 35.10 3i20 s VAL 22 CO 0.12 0.51 1.17 -0.63 0.00 0.00 0.00 175.10 176.27 3i20 s ILE 23 N 0.45 3.98 0.33 2.22 1.01 -1.26 -2.38 121.20 125.55 3i20 s ILE 23 Ca -0.17 1.51 0.03 0.00 0.00 0.00 0.00 60.65 62.02 3i20 s ILE 23 Cb -0.17 -3.96 -0.05 0.00 0.01 0.00 0.00 42.46 38.28 3i20 s ILE 23 CO 0.07 0.16 0.08 -0.13 0.00 0.00 0.00 174.94 175.12 3i20 s ARG 24 N 0.60 1.66 -0.13 2.79 0.52 -0.05 -2.06 118.95 122.29 3i20 s ARG 24 Ca 0.56 -1.94 -0.00 0.00 -0.52 0.00 0.00 55.73 53.82 3i20 s ARG 24 Cb -0.29 -0.70 0.03 0.00 0.52 0.00 0.00 34.95 34.51 3i20 s ARG 24 CO 0.31 -0.27 -0.07 0.08 0.02 0.00 0.00 175.30 175.38 3i20 s VAL 25 N -3.37 1.03 -0.19 3.52 1.01 -0.85 -0.89 120.40 120.66 3i20 s VAL 25 Ca 0.34 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.93 3i20 s VAL 25 Cb 0.07 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 3i20 s VAL 25 CO 0.15 0.30 -0.06 -0.63 0.00 0.00 0.00 175.10 174.86 3i20 s ILE 26 N 1.70 3.38 -0.17 2.22 -1.09 -1.26 -2.63 121.20 123.34 3i20 s ILE 26 Ca 0.04 -0.51 -0.04 0.00 -2.23 0.00 0.00 60.65 57.91 3i20 s ILE 26 Cb -0.13 -2.51 -0.03 0.00 -1.58 0.00 0.00 42.46 38.21 3i20 s ILE 26 CO -0.08 0.45 -0.02 0.00 -1.23 0.00 0.00 174.94 174.07 3i20 n SER 28 N 3.68 0.00 -0.02 0.00 3.41 -1.26 -4.22 113.62 115.20 3i20 n SER 28 Ca -0.17 -0.40 -0.04 0.00 -0.26 0.00 0.00 58.87 58.00 3i20 n SER 28 Cb 0.52 -0.18 -0.02 0.00 -0.26 0.00 0.00 64.21 64.27 3i20 n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i20 n ALA 29 N -1.18 2.15 -3.88 7.33 0.00 -1.26 -4.95 120.51 118.72 3i20 n ALA 29 Ca 0.16 -0.20 -0.30 0.00 0.00 0.00 0.00 53.44 53.11 3i20 n ALA 29 Cb 0.18 0.41 -0.15 0.00 0.00 0.00 0.00 19.45 19.88 3i20 n ALA 29 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3i20 s GLU 30 N -2.09 1.24 0.19 0.00 2.56 -1.26 -5.00 118.70 114.34 3i20 s GLU 30 Ca -0.06 -1.24 -0.16 0.00 0.00 0.00 0.00 54.97 53.50 3i20 s GLU 30 Cb 0.02 -2.54 0.16 0.00 2.00 0.00 0.00 34.13 33.76 3i20 s GLU 30 CO 0.10 -0.82 1.64 -1.35 -0.56 0.00 0.00 175.26 174.26 3i20 h PRO 31 N 7.91 -0.05 -1.90 4.30 0.11 -1.93 -0.61 132.00 139.85 3i20 h PRO 31 Ca -0.13 0.00 0.55 0.00 0.11 0.00 0.00 66.00 66.54 3i20 h PRO 31 Cb 1.04 0.01 -0.08 0.00 0.11 0.00 0.00 31.00 32.08 3i20 h PRO 31 CO 0.46 -0.03 1.37 0.87 -0.21 0.00 0.00 178.00 180.46 3i20 h LYS 32 N -0.05 0.00 0.00 1.05 1.57 -1.95 0.59 116.57 117.78 3i20 h LYS 32 Ca 0.24 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3i20 h LYS 32 Cb 0.42 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 3i20 h LYS 32 CO -0.54 0.00 0.00 0.45 -0.57 0.00 0.00 179.45 178.79 3i20 h HIS 33 N 0.00 0.00 -2.61 -1.35 3.86 -1.49 -3.43 115.15 110.14 3i20 h HIS 33 Ca 0.90 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 59.51 3i20 h HIS 33 Cb 3.63 0.00 0.10 0.00 1.06 0.00 0.00 27.41 32.20 3i20 h HIS 33 CO -0.00 0.00 0.28 1.17 0.86 0.00 0.00 177.93 180.24 3i20 n LYS 34 N -2.44 1.57 -3.78 2.45 4.81 0.20 -4.78 118.16 116.18 3i20 n LYS 34 Ca 0.05 0.55 -0.11 0.00 -0.87 0.00 0.00 58.31 57.93 3i20 n LYS 34 Cb 0.42 -2.02 -0.07 0.00 0.02 0.00 0.00 35.03 33.38 3i20 n LYS 34 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 3i20 s GLN 35 N -1.34 0.82 0.00 1.64 -0.21 -1.08 -2.77 119.66 116.72 3i20 s GLN 35 Ca 0.61 -0.65 0.00 0.00 0.02 0.00 0.00 55.36 55.34 3i20 s GLN 35 Cb -0.69 0.35 0.00 0.00 1.00 0.00 0.00 33.01 33.67 3i20 s GLN 35 CO 0.58 -0.26 0.00 -2.13 -2.12 0.00 0.00 175.29 171.36 3i20 n ARG 36 N 0.38 3.12 -2.78 2.91 0.63 -0.48 -2.00 116.66 118.45 3i20 n ARG 36 Ca -0.18 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.70 3i20 n ARG 36 Cb 0.60 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.51 3i20 n ARG 36 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 3i20 n GLN 37 N 0.00 -0.33 0.00 -0.14 7.27 -1.22 -4.74 117.38 118.22 3i20 n GLN 37 Ca 0.00 0.15 0.15 0.00 0.07 0.00 0.00 57.00 57.37 3i20 n GLN 37 Cb 0.00 -0.46 0.70 0.00 2.41 0.00 0.00 30.24 32.89 3i20 n GLN 37 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54