#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i2v s LYS 2 N 0.00 2.14 0.82 -1.24 2.36 -1.26 -4.97 119.74 117.59 1i2v s LYS 2 Ca 0.00 -1.29 -0.11 0.00 -2.55 0.00 0.00 55.97 52.01 1i2v s LYS 2 Cb 0.00 -2.84 0.08 0.00 -1.05 0.00 0.00 37.83 34.02 1i2v s LYS 2 CO 0.00 -0.58 1.09 -1.17 1.55 0.00 0.00 175.35 176.24 1i2v s LEU 3 N 1.15 2.61 0.00 5.43 0.20 -1.26 -0.14 118.68 126.67 1i2v s LEU 3 Ca -0.08 1.53 0.00 0.00 0.69 0.00 0.00 54.13 56.26 1i2v s LEU 3 Cb -0.20 -4.11 0.00 0.00 -0.43 0.00 0.00 46.19 41.45 1i2v s LEU 3 CO -0.05 -2.20 0.00 2.30 -0.29 0.00 0.00 176.35 176.11 1i2v n ILE 4 N -3.60 0.00 -2.89 6.68 -5.35 -1.20 -4.79 119.36 108.21 1i2v n ILE 4 Ca 0.07 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.55 1i2v n ILE 4 Cb 0.55 -0.20 0.00 0.00 -1.74 0.00 0.00 39.64 38.25 1i2v n ILE 4 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1i2v n GLY 5 N 1.83 1.48 3.95 3.28 0.00 -1.25 -5.05 105.19 109.43 1i2v n GLY 5 Ca 0.00 -0.73 -0.23 0.00 0.00 0.00 0.00 46.02 45.06 1i2v n GLY 5 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1i2v s SER 6 N 1.08 5.94 -0.48 1.61 0.01 -0.09 -1.25 113.70 120.53 1i2v s SER 6 Ca 0.00 0.32 0.07 0.00 1.31 0.00 0.00 55.95 57.65 1i2v s SER 6 Cb 0.00 -1.64 0.39 0.00 0.21 0.00 0.00 66.02 64.98 1i2v s SER 6 CO 0.00 -0.61 1.01 0.00 0.41 0.00 0.00 173.24 174.05 1i2v s VAL 8 N -4.72 1.32 -1.28 0.00 1.01 -1.26 -3.31 120.40 112.16 1i2v s VAL 8 Ca 0.46 -0.49 -0.16 0.00 0.00 0.00 0.00 61.98 61.79 1i2v s VAL 8 Cb 0.36 -1.26 -0.01 0.00 0.00 0.00 0.00 36.38 35.47 1i2v s VAL 8 CO -0.14 0.41 2.11 1.87 0.00 0.00 0.00 175.10 179.35 1i2v n TRP 9 N 4.68 3.24 0.00 5.22 -0.00 -1.26 -3.34 117.44 125.98 1i2v n TRP 9 Ca -0.16 -2.66 0.00 0.00 -0.00 0.00 0.00 57.50 54.68 1i2v n TRP 9 Cb 0.50 -2.38 0.00 0.00 -0.00 0.00 0.00 31.31 29.44 1i2v n TRP 9 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1i2v n GLY 10 N 4.35 -0.29 3.80 5.87 0.00 -1.26 -5.18 105.19 112.48 1i2v n GLY 10 Ca 0.51 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 46.24 1i2v n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i2v s ALA 11 N 0.00 -0.67 0.84 4.61 0.00 -1.21 -5.14 121.76 120.19 1i2v s ALA 11 Ca 0.00 -0.81 -0.12 0.00 0.00 0.00 0.00 51.96 51.03 1i2v s ALA 11 Cb 0.00 0.66 0.10 0.00 0.00 0.00 0.00 23.12 23.88 1i2v s ALA 11 CO 0.00 -0.98 1.19 0.08 0.00 0.00 0.00 175.76 176.05 1i2v s VAL 12 N -2.16 2.00 -0.13 0.00 1.01 -1.26 -3.65 120.40 116.22 1i2v s VAL 12 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 61.98 62.13 1i2v s VAL 12 Cb -0.05 -2.96 0.01 0.00 0.00 0.00 0.00 36.38 33.38 1i2v s VAL 12 CO 0.12 0.00 0.03 -0.46 0.00 0.00 0.00 175.10 174.79 1i2v n ASN 13 N -3.43 -1.16 -4.64 3.32 0.23 -1.26 -4.47 115.26 103.84 1i2v n ASN 13 Ca 0.08 0.41 -0.46 0.00 -0.53 0.00 0.00 54.58 54.08 1i2v n ASN 13 Cb 0.61 -1.13 -0.03 0.00 -2.08 0.00 0.00 39.78 37.15 1i2v n ASN 13 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1i2v n TYR 14 N -2.61 1.91 0.00 -2.53 9.36 -1.24 -0.91 117.16 121.14 1i2v n TYR 14 Ca -0.00 0.51 0.00 0.00 3.32 0.00 0.00 57.90 61.73 1i2v n TYR 14 Cb 0.50 -2.40 0.00 0.00 -0.63 0.00 0.00 39.34 36.81 1i2v n TYR 14 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 1i2v n THR 15 N 1.65 0.00 0.00 2.97 -1.04 -0.79 -4.80 114.28 112.28 1i2v n THR 15 Ca 0.12 0.27 0.00 0.00 -2.04 0.00 0.00 64.05 62.40 1i2v n THR 15 Cb 0.30 -1.09 0.00 0.00 -1.82 0.00 0.00 70.33 67.72 1i2v n THR 15 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1i2v n SER 16 N -1.76 0.00 -3.32 8.00 2.88 -1.26 -4.74 113.62 113.42 1i2v n SER 16 Ca 0.00 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.28 1i2v n SER 16 Cb 0.00 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.38 1i2v n SER 16 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1i2v n ASP 17 N 1.39 0.47 -0.24 -3.46 5.75 -1.26 -4.99 116.55 114.22 1i2v n ASP 17 Ca 0.00 -2.69 -0.10 0.00 -0.01 0.00 0.00 54.79 51.99 1i2v n ASP 17 Cb 0.00 -0.62 -0.06 0.00 -1.03 0.00 0.00 41.12 39.41 1i2v n ASP 17 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1i2v h ASN 19 N -0.21 0.54 0.00 0.00 -1.24 -1.92 0.22 115.58 112.95 1i2v h ASN 19 Ca 0.16 0.04 0.00 0.00 0.71 0.00 0.00 56.30 57.21 1i2v h ASN 19 Cb 0.55 -0.07 0.00 0.00 0.73 0.00 0.00 38.32 39.53 1i2v h ASN 19 CO -0.74 0.26 0.00 0.61 -1.29 0.00 0.00 177.43 176.27 1i2v n GLY 20 N -1.47 -1.78 0.49 1.57 0.00 0.42 0.11 105.19 104.52 1i2v n GLY 20 Ca 0.17 0.00 0.34 0.00 0.00 0.00 0.00 46.02 46.53 1i2v n GLY 20 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1i2v h GLU 21 N 0.00 0.15 -0.11 1.61 4.57 0.31 0.94 114.58 122.06 1i2v h GLU 21 Ca 0.00 -0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 58.03 1i2v h GLU 21 Cb 0.00 -0.03 0.01 0.00 -0.16 0.00 0.00 28.75 28.56 1i2v h GLU 21 CO 0.00 0.10 -0.49 0.00 -1.18 0.00 0.00 179.01 177.44 1i2v h LEU 23 N 0.12 0.11 -1.53 0.00 3.38 0.48 0.35 115.31 118.22 1i2v h LEU 23 Ca -0.03 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1i2v h LEU 23 Cb 1.13 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1i2v h LEU 23 CO 0.10 0.30 -0.20 -0.07 0.09 0.00 0.00 178.44 178.65 1i2v h LEU 24 N 0.11 0.04 -2.39 1.67 3.38 -0.15 -1.11 115.31 116.85 1i2v h LEU 24 Ca 0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1i2v h LEU 24 Cb 0.38 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1i2v h LEU 24 CO 0.03 0.25 0.00 0.54 0.09 0.00 0.00 178.44 179.34 1i2v n ARG 25 N -4.28 2.53 -1.39 1.13 3.00 -0.48 -4.92 116.66 112.26 1i2v n ARG 25 Ca -0.02 -2.35 -0.13 0.00 -0.01 0.00 0.00 57.85 55.33 1i2v n ARG 25 Cb 0.28 -1.52 -0.06 0.00 0.00 0.00 0.00 32.46 31.15 1i2v n ARG 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1i2v n GLY 26 N 1.55 1.41 3.93 -0.13 0.00 -0.42 -4.98 105.19 106.54 1i2v n GLY 26 Ca 0.21 -0.36 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 1i2v n GLY 26 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1i2v s TYR 27 N -2.47 2.58 0.33 1.61 2.02 0.11 -4.96 117.35 116.57 1i2v s TYR 27 Ca 0.00 0.40 -0.16 0.00 -0.37 0.00 0.00 57.07 56.94 1i2v s TYR 27 Cb 0.00 -3.37 -0.09 0.00 -0.40 0.00 0.00 41.96 38.10 1i2v s TYR 27 CO 0.00 -1.70 0.76 0.15 -1.57 0.00 0.00 175.55 173.20 1i2v s LYS 28 N -5.39 4.06 -0.52 -0.62 3.01 -1.26 -4.24 119.74 114.77 1i2v s LYS 28 Ca 0.63 0.75 -0.16 0.00 -1.01 0.00 0.00 55.97 56.18 1i2v s LYS 28 Cb -0.09 -2.45 -0.12 0.00 -1.01 0.00 0.00 37.83 34.16 1i2v s LYS 28 CO 0.47 0.16 1.39 0.41 0.51 0.00 0.00 175.35 178.29 1i2v n GLY 29 N -0.29 -0.26 1.78 -3.33 0.00 -1.26 -2.30 105.19 99.53 1i2v n GLY 29 Ca 0.03 0.57 -0.14 0.00 0.00 0.00 0.00 46.02 46.48 1i2v n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i2v n GLY 30 N 3.36 -1.90 3.82 -0.02 0.00 -1.26 -3.91 105.19 105.28 1i2v n GLY 30 Ca 0.34 -1.59 -0.05 0.00 0.00 0.00 0.00 46.02 44.72 1i2v n GLY 30 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1i2v s HIS 31 N -2.20 -0.03 0.28 1.61 -3.43 0.17 -4.26 115.29 107.43 1i2v s HIS 31 Ca 0.35 -0.43 -0.08 0.00 -0.80 0.00 0.00 55.06 54.11 1i2v s HIS 31 Cb -0.02 0.72 -0.06 0.00 -1.43 0.00 0.00 32.58 31.79 1i2v s HIS 31 CO 0.26 -1.13 0.58 0.00 -2.00 0.00 0.00 174.74 172.44 1i2v n GLY 33 N -0.62 0.00 0.99 0.00 0.00 -0.36 -4.88 105.19 100.32 1i2v n GLY 33 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1i2v n GLY 33 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1i2v n SER 34 N 0.00 0.00 -2.19 1.61 2.88 -1.26 -4.98 113.62 109.68 1i2v n SER 34 Ca 0.00 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.38 1i2v n SER 34 Cb 0.00 0.25 0.03 0.00 -0.75 0.00 0.00 64.21 63.74 1i2v n SER 34 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1i2v n PHE 35 N -1.82 2.25 -2.70 0.66 -0.00 -1.26 -4.75 117.46 109.84 1i2v n PHE 35 Ca 0.00 -2.16 -0.07 0.00 -0.00 0.00 0.00 57.45 55.22 1i2v n PHE 35 Cb 0.00 -0.31 0.09 0.00 -0.00 0.00 0.00 39.48 39.26 1i2v n PHE 35 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1i2v n ALA 36 N -0.68 -0.97 -1.35 3.13 0.00 -1.26 -5.08 120.51 114.30 1i2v n ALA 36 Ca 0.33 -1.06 -0.25 0.00 0.00 0.00 0.00 53.44 52.46 1i2v n ALA 36 Cb 0.92 -1.51 -0.19 0.00 0.00 0.00 0.00 19.45 18.67 1i2v n ALA 36 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1i2v n ASN 37 N 0.02 -0.88 0.00 0.00 0.23 -1.26 -4.33 115.26 109.05 1i2v n ASN 37 Ca -0.03 -0.31 0.00 0.00 -0.53 0.00 0.00 54.58 53.71 1i2v n ASN 37 Cb 0.74 -0.58 0.00 0.00 -2.08 0.00 0.00 39.78 37.87 1i2v n ASN 37 CO 0.00 0.00 0.00 1.33 -0.93 0.00 0.00 177.26 177.66 1i2v n VAL 38 N 5.46 0.00 -4.85 3.53 0.24 -1.21 -4.46 118.33 117.04 1i2v n VAL 38 Ca 0.61 0.00 -0.26 0.00 -2.04 0.00 0.00 64.34 62.65 1i2v n VAL 38 Cb 0.10 -0.57 -0.16 0.00 -1.47 0.00 0.00 33.84 31.74 1i2v n VAL 38 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1i2v s ASN 39 N -4.68 2.16 -0.08 -1.34 -0.87 -1.26 0.05 114.94 108.92 1i2v s ASN 39 Ca 0.00 -0.35 -0.03 0.00 -1.57 0.00 0.00 52.86 50.92 1i2v s ASN 39 Cb 0.00 -0.53 -0.03 0.00 -0.02 0.00 0.00 41.25 40.67 1i2v s ASN 39 CO 0.00 0.17 0.03 0.00 -2.57 0.00 0.00 177.10 174.73 1i2v s TRP 41 N -0.93 1.55 0.55 0.00 0.52 -0.19 -3.23 118.94 117.21 1i2v s TRP 41 Ca 0.14 -0.77 0.03 0.00 0.02 0.00 0.00 56.10 55.52 1i2v s TRP 41 Cb -0.11 -0.83 0.05 0.00 -1.15 0.00 0.00 33.47 31.42 1i2v s TRP 41 CO 0.04 0.12 0.77 0.00 0.02 0.00 0.00 176.95 177.89 1i2v n GLU 43 N -2.31 5.21 0.00 0.00 1.02 -0.97 -4.26 120.64 119.33 1i2v n GLU 43 Ca 0.10 -4.67 0.14 0.00 -0.02 0.00 0.00 57.16 52.72 1i2v n GLU 43 Cb 0.60 -2.46 0.58 0.00 -0.02 0.00 0.00 31.44 30.13 1i2v n GLU 43 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56