#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 2.81 0.74 -1.24 2.36 -1.26 -4.96 119.74 118.19 1i2v s LYS 2 Ca 0.00 -0.97 -0.11 0.00 -2.55 0.00 0.00 55.97 52.34 1i2v s LYS 2 Cb 0.00 -2.81 0.03 0.00 -1.05 0.00 0.00 37.83 34.01 1i2v s LYS 2 CO 0.00 -0.35 1.08 -1.17 1.55 0.00 0.00 175.35 176.46 1i2v s LEU 3 N 1.28 2.87 0.00 5.43 0.20 -1.26 0.10 118.68 127.29 1i2v s LEU 3 Ca 0.01 1.41 0.00 0.00 0.69 0.00 0.00 54.13 56.24 1i2v s LEU 3 Cb -0.16 -4.17 0.00 0.00 -0.43 0.00 0.00 46.19 41.43 1i2v s LEU 3 CO -0.08 -1.65 0.00 2.30 -0.29 0.00 0.00 176.35 176.64 1i2v n ILE 4 N -3.24 0.00 -2.80 6.68 -5.35 -1.12 -4.80 119.36 108.73 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 -0.36 0.00 0.00 -1.74 0.00 0.00 39.64 38.09 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 2.01 1.45 3.93 3.28 0.00 -1.24 -5.07 105.19 109.56 1i2v n GLY 5 Ca 0.00 -0.69 -0.26 0.00 0.00 0.00 0.00 46.02 45.07 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 1.51 6.37 -0.66 1.61 0.01 -0.32 -0.66 113.70 121.56 1i2v s SER 6 Ca 0.00 0.40 0.03 0.00 1.31 0.00 0.00 55.95 57.69 1i2v s SER 6 Cb 0.00 -2.01 0.36 0.00 0.21 0.00 0.00 66.02 64.58 1i2v s SER 6 CO 0.00 -0.09 1.26 0.00 0.41 0.00 0.00 173.24 174.82 1i2v s VAL 8 N -4.76 0.30 -0.23 0.00 1.01 -1.26 -4.64 120.40 110.82 1i2v s VAL 8 Ca 0.47 -0.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.15 1i2v s VAL 8 Cb 0.31 -0.59 -0.01 0.00 0.00 0.00 0.00 36.38 36.09 1i2v s VAL 8 CO -0.18 0.10 1.29 0.86 0.00 0.00 0.00 175.10 177.17 1i2v s TRP 9 N 1.99 2.76 0.00 5.22 -0.00 -1.26 -2.56 118.94 125.09 1i2v s TRP 9 Ca 0.03 0.94 0.00 0.00 -0.00 0.00 0.00 56.10 57.07 1i2v s TRP 9 Cb -0.14 -3.70 0.00 0.00 -0.00 0.00 0.00 33.47 29.64 1i2v s TRP 9 CO -0.06 -1.73 0.00 0.41 -0.00 0.00 0.00 176.95 175.57 1i2v n GLY 10 N 3.96 0.91 3.94 5.86 0.00 -1.26 -5.10 105.19 113.50 1i2v n GLY 10 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.27 3.09 0.77 4.61 0.00 -1.06 -5.07 121.76 122.83 1i2v s ALA 11 Ca 0.00 -1.12 -0.11 0.00 0.00 0.00 0.00 51.96 50.73 1i2v s ALA 11 Cb 0.00 -2.53 0.07 0.00 0.00 0.00 0.00 23.12 20.66 1i2v s ALA 11 CO 0.00 -1.54 1.13 0.08 0.00 0.00 0.00 175.76 175.43 1i2v s VAL 12 N -3.35 2.25 -0.27 0.00 1.01 -1.26 -3.68 120.40 115.11 1i2v s VAL 12 Ca 0.64 -0.00 -0.01 0.00 0.00 0.00 0.00 61.98 62.61 1i2v s VAL 12 Cb -0.08 -3.06 0.01 0.00 0.00 0.00 0.00 36.38 33.24 1i2v s VAL 12 CO 0.46 -0.08 0.02 0.59 0.00 0.00 0.00 175.10 176.10 1i2v n ASN 13 N -3.19 -1.61 -4.76 3.32 4.13 -1.26 -4.60 115.26 107.29 1i2v n ASN 13 Ca 0.08 0.38 -0.39 0.00 1.68 0.00 0.00 54.58 56.33 1i2v n ASN 13 Cb 0.60 -1.48 0.02 0.00 -1.54 0.00 0.00 39.78 37.38 1i2v n ASN 13 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1i2v s TYR 14 N -2.16 2.52 0.00 3.10 5.04 -1.24 -1.17 117.35 123.43 1i2v s TYR 14 Ca 0.03 1.34 0.00 0.00 -2.44 0.00 0.00 57.07 56.00 1i2v s TYR 14 Cb -0.02 -3.81 0.00 0.00 0.35 0.00 0.00 41.96 38.49 1i2v s TYR 14 CO 0.04 -2.66 0.00 2.41 -1.34 0.00 0.00 175.55 174.00 1i2v n THR 15 N -0.33 0.00 0.00 4.34 -1.04 0.32 -4.77 114.28 112.79 1i2v n THR 15 Ca 0.06 0.35 0.00 0.00 -2.04 0.00 0.00 64.05 62.42 1i2v n THR 15 Cb 0.43 -1.19 0.00 0.00 -1.82 0.00 0.00 70.33 67.75 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 -1.86 0.00 -3.20 8.00 2.88 -1.26 -4.71 113.62 113.47 1i2v n SER 16 Ca 0.00 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.30 1i2v n SER 16 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 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 1.32 0.16 -0.19 -3.46 5.75 -1.26 -5.01 116.55 113.87 1i2v n ASP 17 Ca 0.00 -2.68 -0.05 0.00 -0.01 0.00 0.00 54.79 52.05 1i2v n ASP 17 Cb 0.00 -0.64 -0.04 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 0.00 -0.61 0.18 0.00 -1.24 -1.92 0.38 115.58 112.36 1i2v h ASN 19 Ca 0.07 0.27 -0.01 0.00 0.71 0.00 0.00 56.30 57.34 1i2v h ASN 19 Cb 0.18 0.50 0.00 0.00 0.73 0.00 0.00 38.32 39.74 1i2v h ASN 19 CO -0.42 -0.31 -0.09 1.23 -1.29 0.00 0.00 177.43 176.55 1i2v h GLY 20 N 0.02 -0.25 -0.98 1.57 0.00 0.29 0.39 103.07 104.11 1i2v h GLY 20 Ca 0.51 0.09 0.42 0.00 0.00 0.00 0.00 47.33 48.36 1i2v h GLY 20 CO -0.90 -0.09 0.97 -2.09 0.00 0.00 0.00 176.54 174.42 1i2v h GLU 21 N -0.25 0.08 0.01 4.80 4.57 0.76 1.33 114.58 125.89 1i2v h GLU 21 Ca -0.02 -0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 57.95 1i2v h GLU 21 Cb 0.19 -0.02 0.02 0.00 -0.16 0.00 0.00 28.75 28.77 1i2v h GLU 21 CO 0.04 0.05 -0.80 0.00 -1.18 0.00 0.00 179.01 177.13 1i2v h LEU 23 N 0.08 0.09 -1.68 0.00 3.38 0.59 0.55 115.31 118.31 1i2v h LEU 23 Ca -0.10 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1i2v h LEU 23 Cb 1.49 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.21 1i2v h LEU 23 CO 0.16 0.32 -0.11 -0.07 0.09 0.00 0.00 178.44 178.83 1i2v h LEU 24 N 0.08 0.06 -2.52 1.67 3.38 -0.16 -1.02 115.31 116.80 1i2v h LEU 24 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1i2v h LEU 24 Cb 0.45 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1i2v h LEU 24 CO 0.03 0.18 0.00 0.54 0.09 0.00 0.00 178.44 179.28 1i2v n ARG 25 N -4.37 2.53 -1.16 1.13 1.74 -0.52 -4.93 116.66 111.09 1i2v n ARG 25 Ca -0.02 -2.32 -0.05 0.00 -0.77 0.00 0.00 57.85 54.68 1i2v n ARG 25 Cb 0.20 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.14 1i2v n ARG 25 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i2v n GLY 26 N 1.34 0.71 3.84 -0.13 0.00 -0.39 -4.99 105.19 105.58 1i2v n GLY 26 Ca 0.19 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.90 1.75 0.28 1.61 2.02 0.18 -4.93 117.35 116.37 1i2v s TYR 27 Ca 0.00 0.50 -0.12 0.00 -0.37 0.00 0.00 57.07 57.08 1i2v s TYR 27 Cb 0.00 -3.79 -0.08 0.00 -0.40 0.00 0.00 41.96 37.69 1i2v s TYR 27 CO 0.00 -2.69 0.65 0.15 -1.57 0.00 0.00 175.55 172.09 1i2v s LYS 28 N -5.66 3.89 -0.61 -0.62 3.01 -1.26 -4.28 119.74 114.20 1i2v s LYS 28 Ca 0.70 0.46 -0.11 0.00 -1.01 0.00 0.00 55.97 56.00 1i2v s LYS 28 Cb -0.08 -2.53 -0.17 0.00 -1.01 0.00 0.00 37.83 34.04 1i2v s LYS 28 CO 0.53 0.22 1.45 0.41 0.51 0.00 0.00 175.35 178.47 1i2v n GLY 29 N -0.33 -0.30 0.28 -3.33 0.00 -1.26 -2.06 105.19 98.18 1i2v n GLY 29 Ca 0.02 0.31 -0.02 0.00 0.00 0.00 0.00 46.02 46.33 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 3.61 -1.74 3.81 -0.02 0.00 -1.26 -3.95 105.19 105.64 1i2v n GLY 30 Ca 0.41 -1.57 -0.05 0.00 0.00 0.00 0.00 46.02 44.80 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 -1.19 -0.09 0.39 1.61 -3.43 0.45 -4.12 115.29 108.92 1i2v s HIS 31 Ca 0.05 -0.34 -0.19 0.00 -0.80 0.00 0.00 55.06 53.78 1i2v s HIS 31 Cb -0.00 0.70 -0.10 0.00 -1.43 0.00 0.00 32.58 31.75 1i2v s HIS 31 CO 0.04 -1.10 0.88 0.00 -2.00 0.00 0.00 174.74 172.56 1i2v n GLY 33 N -0.54 -0.23 2.04 0.00 0.00 0.13 -4.79 105.19 101.80 1i2v n GLY 33 Ca 0.06 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.12 -0.82 -2.78 1.61 2.88 -1.26 -4.98 113.62 108.15 1i2v n SER 34 Ca 0.00 0.21 -0.01 0.00 -1.33 0.00 0.00 58.87 57.75 1i2v n SER 34 Cb 0.00 1.03 0.01 0.00 -0.75 0.00 0.00 64.21 64.51 1i2v n SER 34 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1i2v s PHE 35 N -2.00 -0.61 0.00 0.66 5.36 -1.26 -4.93 117.98 115.19 1i2v s PHE 35 Ca 0.00 -0.04 0.00 0.00 -0.96 0.00 0.00 56.93 55.93 1i2v s PHE 35 Cb 0.00 0.12 0.00 0.00 -0.34 0.00 0.00 43.02 42.80 1i2v s PHE 35 CO 0.00 -0.45 0.00 0.00 -1.46 0.00 0.00 175.22 173.31 1i2v n ALA 36 N 3.31 0.00 0.74 11.12 0.00 -1.26 -4.93 120.51 129.49 1i2v n ALA 36 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.67 1i2v n ALA 36 Cb 0.62 -0.37 0.48 0.00 0.00 0.00 0.00 19.45 20.19 1i2v n ALA 36 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1i2v n ASN 37 N 1.49 0.49 -3.30 0.00 2.85 -1.26 -4.88 115.26 110.66 1i2v n ASN 37 Ca 0.00 0.55 -0.20 0.00 -0.11 0.00 0.00 54.58 54.82 1i2v n ASN 37 Cb 0.34 -0.68 -0.02 0.00 1.24 0.00 0.00 39.78 40.66 1i2v n ASN 37 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 1i2v n VAL 38 N -1.96 -0.43 -3.57 3.44 0.24 -1.26 -4.89 118.33 109.90 1i2v n VAL 38 Ca 0.06 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.25 1i2v n VAL 38 Cb 0.38 -0.96 -0.11 0.00 -1.47 0.00 0.00 33.84 31.68 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 -2.57 0.24 -0.14 -1.34 0.01 -1.26 -3.72 114.94 106.16 1i2v s ASN 39 Ca 0.35 0.54 -0.12 0.00 -0.71 0.00 0.00 52.86 52.92 1i2v s ASN 39 Cb -0.19 0.98 -0.05 0.00 0.41 0.00 0.00 41.25 42.40 1i2v s ASN 39 CO 0.43 -0.26 0.24 0.00 -1.51 0.00 0.00 177.10 176.00 1i2v s TRP 41 N -0.08 2.32 0.66 0.00 0.52 -0.01 -2.80 118.94 119.55 1i2v s TRP 41 Ca 0.15 -0.34 0.00 0.00 0.02 0.00 0.00 56.10 55.94 1i2v s TRP 41 Cb -0.13 -1.08 0.09 0.00 -1.15 0.00 0.00 33.47 31.20 1i2v s TRP 41 CO 0.04 0.60 0.91 0.00 0.02 0.00 0.00 176.95 178.52 1i2v n GLU 43 N -2.65 5.23 0.00 0.00 1.02 -0.87 -4.28 120.64 119.09 1i2v n GLU 43 Ca 0.12 -4.67 0.14 0.00 -0.02 0.00 0.00 57.16 52.74 1i2v n GLU 43 Cb 0.60 -2.46 0.53 0.00 -0.02 0.00 0.00 31.44 30.09 1i2v n GLU 43 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56