#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 0.58 1.00 0.11 2.47 -1.26 -4.89 119.74 117.75 1i2v s LYS 2 Ca 0.00 -0.13 -0.13 0.00 -1.56 0.00 0.00 55.97 54.15 1i2v s LYS 2 Cb 0.00 -0.24 0.12 0.00 -1.46 0.00 0.00 37.83 36.26 1i2v s LYS 2 CO 0.00 -1.11 0.69 -0.11 0.16 0.00 0.00 175.35 174.98 1i2v n LEU 3 N 4.90 0.45 0.00 5.43 0.00 -1.26 0.36 117.00 126.88 1i2v n LEU 3 Ca 0.06 0.22 0.00 0.00 0.00 0.00 0.00 56.01 56.29 1i2v n LEU 3 Cb 0.51 -1.27 0.00 0.00 0.00 0.00 0.00 43.42 42.66 1i2v n LEU 3 CO 0.01 -3.02 -0.14 2.30 0.00 0.00 0.00 177.39 176.54 1i2v n ILE 4 N -4.16 0.00 0.00 1.96 -5.35 -0.68 -4.64 119.36 106.49 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 0.54 -0.21 0.00 0.00 -1.74 0.00 0.00 39.64 38.24 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 2.04 -0.70 3.41 3.28 0.00 -1.14 -5.02 105.19 107.08 1i2v n GLY 5 Ca 0.00 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 1i2v n GLY 5 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1i2v n SER 6 N 0.00 0.69 -2.69 1.61 7.64 -0.45 -0.16 113.62 120.26 1i2v n SER 6 Ca 0.00 -1.74 -0.08 0.00 1.01 0.00 0.00 58.87 58.06 1i2v n SER 6 Cb 0.00 -0.72 0.08 0.00 -1.01 0.00 0.00 64.21 62.57 1i2v n SER 6 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1i2v s VAL 8 N -1.13 -0.26 -0.59 0.00 1.01 -1.26 -4.64 120.40 113.52 1i2v s VAL 8 Ca 0.24 0.18 -0.28 0.00 0.00 0.00 0.00 61.98 62.12 1i2v s VAL 8 Cb 0.42 -0.51 0.01 0.00 0.00 0.00 0.00 36.38 36.30 1i2v s VAL 8 CO -0.04 0.07 1.46 0.86 0.00 0.00 0.00 175.10 177.46 1i2v s TRP 9 N 1.89 2.18 0.00 5.22 -0.00 -1.26 -2.41 118.94 124.57 1i2v s TRP 9 Ca -0.05 0.43 0.00 0.00 -0.00 0.00 0.00 56.10 56.48 1i2v s TRP 9 Cb -0.11 -4.38 0.00 0.00 -0.00 0.00 0.00 33.47 28.98 1i2v s TRP 9 CO -0.10 -2.06 0.00 0.41 -0.00 0.00 0.00 176.95 175.19 1i2v n GLY 10 N 5.35 1.07 3.99 5.86 0.00 -1.26 -5.13 105.19 115.07 1i2v n GLY 10 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.23 4.06 0.76 4.61 0.00 -1.01 -5.10 121.76 124.86 1i2v s ALA 11 Ca 0.00 -1.52 -0.10 0.00 0.00 0.00 0.00 51.96 50.34 1i2v s ALA 11 Cb 0.00 -1.93 0.07 0.00 0.00 0.00 0.00 23.12 21.26 1i2v s ALA 11 CO 0.00 -0.77 1.11 0.08 0.00 0.00 0.00 175.76 176.18 1i2v s VAL 12 N -2.73 2.21 -0.38 0.00 1.01 -1.26 -3.69 120.40 115.55 1i2v s VAL 12 Ca 0.59 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.49 1i2v s VAL 12 Cb -0.09 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.25 1i2v s VAL 12 CO 0.38 -0.04 0.00 0.59 0.00 0.00 0.00 175.10 176.03 1i2v n ASN 13 N -3.14 -1.95 -4.69 3.32 3.02 -1.26 -4.53 115.26 106.04 1i2v n ASN 13 Ca 0.08 0.36 -0.38 0.00 -0.03 0.00 0.00 54.58 54.61 1i2v n ASN 13 Cb 0.61 -1.78 0.05 0.00 -0.61 0.00 0.00 39.78 38.04 1i2v n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i2v n TYR 14 N -2.66 1.67 0.00 3.10 9.36 -1.24 -1.34 117.16 126.04 1i2v n TYR 14 Ca -0.05 0.44 0.00 0.00 3.32 0.00 0.00 57.90 61.61 1i2v n TYR 14 Cb 0.50 -2.26 0.00 0.00 -0.63 0.00 0.00 39.34 36.95 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 -1.34 0.00 0.00 2.97 -1.04 -1.19 -4.74 114.28 108.93 1i2v n THR 15 Ca 0.12 0.46 0.00 0.00 -2.04 0.00 0.00 64.05 62.60 1i2v n THR 15 Cb 0.45 -1.45 0.00 0.00 -1.82 0.00 0.00 70.33 67.52 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 -2.32 0.00 -3.48 8.00 2.88 -1.26 -4.80 113.62 112.64 1i2v n SER 16 Ca 0.00 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.26 1i2v n SER 16 Cb 0.00 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.34 1i2v n SER 16 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 1i2v s ASP 17 N 0.15 2.61 0.00 -3.46 -4.77 -1.26 -5.02 116.67 104.92 1i2v s ASP 17 Ca 0.00 -2.54 0.00 0.00 -3.30 0.00 0.00 52.55 46.71 1i2v s ASP 17 Cb 0.00 -0.51 0.00 0.00 -1.09 0.00 0.00 42.92 41.32 1i2v s ASP 17 CO 0.00 -0.26 0.59 0.00 0.70 0.00 0.00 175.17 176.21 1i2v h ASN 19 N 0.00 0.09 0.55 0.00 -0.00 -1.92 0.47 115.58 114.76 1i2v h ASN 19 Ca 0.00 0.05 -0.03 0.00 -0.00 0.00 0.00 56.30 56.32 1i2v h ASN 19 Cb 0.00 0.05 0.01 0.00 -0.00 0.00 0.00 38.32 38.37 1i2v h ASN 19 CO 0.00 -0.07 -0.26 1.23 -0.00 0.00 0.00 177.43 178.33 1i2v h GLY 20 N 0.03 -0.76 0.81 1.57 0.00 -1.89 0.32 103.07 103.14 1i2v h GLY 20 Ca 0.84 0.28 0.11 0.00 0.00 0.00 0.00 47.33 48.57 1i2v h GLY 20 CO -0.16 -0.28 0.50 -2.09 0.00 0.00 0.00 176.54 174.51 1i2v h GLU 21 N -1.16 0.60 -0.07 4.80 4.57 0.33 0.36 114.58 124.01 1i2v h GLU 21 Ca -0.07 -0.04 -0.18 0.00 -1.18 0.00 0.00 59.36 57.89 1i2v h GLU 21 Cb 0.59 -0.14 0.01 0.00 -0.16 0.00 0.00 28.75 29.05 1i2v h GLU 21 CO 0.12 0.40 -0.65 0.00 -1.18 0.00 0.00 179.01 177.70 1i2v h LEU 23 N 0.16 0.07 -1.22 0.00 3.38 0.11 0.19 115.31 118.00 1i2v h LEU 23 Ca -0.06 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1i2v h LEU 23 Cb 1.31 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 42.01 1i2v h LEU 23 CO 0.13 0.14 0.26 -0.07 0.09 0.00 0.00 178.44 179.00 1i2v h LEU 24 N 0.07 0.73 -2.86 1.67 3.38 -0.12 -1.15 115.31 117.04 1i2v h LEU 24 Ca 0.02 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1i2v h LEU 24 Cb 0.16 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1i2v h LEU 24 CO 0.01 0.63 0.00 0.54 0.09 0.00 0.00 178.44 179.71 1i2v n ARG 25 N -4.35 3.61 -2.31 1.13 1.74 -0.21 -4.90 116.66 111.36 1i2v n ARG 25 Ca 0.05 -2.54 -0.17 0.00 -0.77 0.00 0.00 57.85 54.42 1i2v n ARG 25 Cb 0.14 -1.90 -0.02 0.00 -1.02 0.00 0.00 32.46 29.66 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 0.92 -0.25 3.83 -0.13 0.00 -0.43 -4.94 105.19 104.18 1i2v n GLY 26 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.78 3.21 0.49 1.61 2.02 0.52 -4.92 117.35 117.50 1i2v s TYR 27 Ca 0.00 1.40 0.17 0.00 -0.37 0.00 0.00 57.07 58.27 1i2v s TYR 27 Cb 0.00 -2.85 1.21 0.00 -0.40 0.00 0.00 41.96 39.92 1i2v s TYR 27 CO 0.00 -1.12 2.06 0.87 -1.57 0.00 0.00 175.55 175.78 1i2v h LYS 28 N -0.60 0.14 0.00 -0.62 1.57 -1.86 -3.41 116.57 111.79 1i2v h LYS 28 Ca -0.44 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1i2v h LYS 28 Cb 1.21 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1i2v h LYS 28 CO 0.58 0.09 0.00 0.41 -0.57 0.00 0.00 179.45 179.96 1i2v n GLY 29 N -1.56 -1.95 3.46 3.86 0.00 -1.26 -4.92 105.19 102.83 1i2v n GLY 29 Ca 0.04 -1.26 -0.15 0.00 0.00 0.00 0.00 46.02 44.66 1i2v n GLY 29 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i2v s GLY 30 N 0.00 -0.60 0.21 -0.02 0.00 -1.26 0.15 107.32 105.79 1i2v s GLY 30 Ca 0.00 0.84 -0.16 0.00 0.00 0.00 0.00 44.72 45.40 1i2v s GLY 30 CO 0.00 0.50 0.50 -2.38 0.00 0.00 0.00 173.10 171.72 1i2v s HIS 31 N -2.67 0.03 0.47 1.90 -3.43 0.37 -3.69 115.29 108.25 1i2v s HIS 31 Ca -0.04 -0.39 -0.20 0.00 -0.80 0.00 0.00 55.06 53.63 1i2v s HIS 31 Cb -0.01 0.33 -0.09 0.00 -1.43 0.00 0.00 32.58 31.38 1i2v s HIS 31 CO -0.03 -0.94 1.00 0.00 -2.00 0.00 0.00 174.74 172.77 1i2v n GLY 33 N -0.42 -0.22 2.07 0.00 0.00 0.74 -4.80 105.19 102.55 1i2v n GLY 33 Ca 0.08 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1i2v n GLY 33 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1i2v n SER 34 N -0.11 -1.40 -2.79 1.61 3.41 -1.26 -4.99 113.62 108.09 1i2v n SER 34 Ca 0.00 0.49 -0.00 0.00 -0.26 0.00 0.00 58.87 59.10 1i2v n SER 34 Cb 0.00 1.46 0.01 0.00 -0.26 0.00 0.00 64.21 65.42 1i2v n SER 34 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1i2v s PHE 35 N -2.00 -0.62 0.00 7.33 2.19 -1.26 -4.94 117.98 118.68 1i2v s PHE 35 Ca 0.00 -0.03 0.00 0.00 0.33 0.00 0.00 56.93 57.23 1i2v s PHE 35 Cb 0.00 0.12 0.00 0.00 -1.31 0.00 0.00 43.02 41.83 1i2v s PHE 35 CO 0.00 -0.45 0.00 0.00 1.83 0.00 0.00 175.22 176.60 1i2v n ALA 36 N 3.35 0.00 0.84 11.12 0.00 -1.26 -4.95 120.51 129.60 1i2v n ALA 36 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.66 1i2v n ALA 36 Cb 0.62 -0.30 0.44 0.00 0.00 0.00 0.00 19.45 20.21 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 1.12 0.40 -3.31 0.00 2.85 -1.26 -4.88 115.26 110.18 1i2v n ASN 37 Ca 0.00 0.34 -0.19 0.00 -0.11 0.00 0.00 54.58 54.62 1i2v n ASN 37 Cb 0.30 -0.36 -0.03 0.00 1.24 0.00 0.00 39.78 40.93 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 -1.79 -0.23 -3.60 3.44 0.24 -1.26 -4.86 118.33 110.27 1i2v n VAL 38 Ca 0.06 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.27 1i2v n VAL 38 Cb 0.38 -0.61 -0.10 0.00 -1.47 0.00 0.00 33.84 32.04 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 -2.54 -0.10 0.00 -1.34 0.01 -1.26 -3.50 114.94 106.22 1i2v s ASN 39 Ca 0.34 0.81 -0.06 0.00 -0.71 0.00 0.00 52.86 53.24 1i2v s ASN 39 Cb -0.20 1.24 -0.05 0.00 0.41 0.00 0.00 41.25 42.65 1i2v s ASN 39 CO 0.42 -0.25 0.25 0.00 -1.51 0.00 0.00 177.10 176.02 1i2v s TRP 41 N -1.30 1.85 0.52 0.00 0.52 -0.02 -1.69 118.94 118.82 1i2v s TRP 41 Ca 0.27 -0.75 0.04 0.00 0.02 0.00 0.00 56.10 55.68 1i2v s TRP 41 Cb -0.13 -1.06 0.04 0.00 -1.15 0.00 0.00 33.47 31.17 1i2v s TRP 41 CO 0.16 0.20 0.72 0.00 0.02 0.00 0.00 176.95 178.05 1i2v n GLU 43 N -2.20 3.71 0.00 0.00 4.07 0.39 -4.17 120.64 122.44 1i2v n GLU 43 Ca 0.09 -3.71 0.14 0.00 -0.06 0.00 0.00 57.16 53.62 1i2v n GLU 43 Cb 0.60 -2.35 0.44 0.00 -0.06 0.00 0.00 31.44 30.07 1i2v n GLU 43 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32