#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 2.29 0.97 -1.24 3.01 -1.26 -4.87 119.74 118.64 1i2v s LYS 2 Ca 0.00 -1.94 -0.12 0.00 -1.01 0.00 0.00 55.97 52.90 1i2v s LYS 2 Cb 0.00 -3.74 0.11 0.00 -1.01 0.00 0.00 37.83 33.19 1i2v s LYS 2 CO 0.00 -1.14 0.74 -0.11 0.51 0.00 0.00 175.35 175.35 1i2v n LEU 3 N 4.49 0.99 0.00 3.17 0.00 -1.26 0.46 117.00 124.86 1i2v n LEU 3 Ca -0.02 0.29 0.00 0.00 0.00 0.00 0.00 56.01 56.28 1i2v n LEU 3 Cb 0.41 -1.31 0.00 0.00 0.00 0.00 0.00 43.42 42.52 1i2v n LEU 3 CO 0.36 -2.96 -0.09 2.30 0.00 0.00 0.00 177.39 177.00 1i2v n ILE 4 N -4.06 0.00 0.00 1.96 -5.35 -1.14 -4.70 119.36 106.07 1i2v n ILE 4 Ca 0.08 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.56 1i2v n ILE 4 Cb 0.54 -0.16 0.00 0.00 -1.74 0.00 0.00 39.64 38.27 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 1.86 -0.77 0.98 3.28 0.00 -1.25 -5.05 105.19 104.24 1i2v n GLY 5 Ca 0.00 -0.33 -0.06 0.00 0.00 0.00 0.00 46.02 45.64 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 0.39 -1.94 1.61 7.64 0.55 -1.29 113.62 120.59 1i2v n SER 6 Ca 0.00 -1.31 -0.02 0.00 1.01 0.00 0.00 58.87 58.54 1i2v n SER 6 Cb 0.00 -0.15 0.03 0.00 -1.01 0.00 0.00 64.21 63.08 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 -0.62 1.32 -1.49 0.00 1.01 -1.25 -3.94 120.40 115.42 1i2v s VAL 8 Ca 0.14 -0.55 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 1i2v s VAL 8 Cb 0.27 -1.21 -0.06 0.00 0.00 0.00 0.00 36.38 35.38 1i2v s VAL 8 CO -0.08 0.40 2.70 1.87 0.00 0.00 0.00 175.10 180.00 1i2v n TRP 9 N 4.07 2.49 0.00 5.22 -0.00 -1.26 -3.02 117.44 124.95 1i2v n TRP 9 Ca -0.20 -2.91 0.00 0.00 -0.00 0.00 0.00 57.50 54.39 1i2v n TRP 9 Cb 0.51 -2.39 0.00 0.00 -0.00 0.00 0.00 31.31 29.43 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 3.73 0.00 3.63 5.87 0.00 -1.26 -5.17 105.19 111.98 1i2v n GLY 10 Ca 0.69 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.59 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 0.14 0.80 4.61 0.00 -1.17 -5.13 121.76 121.01 1i2v s ALA 11 Ca 0.00 -1.21 -0.12 0.00 0.00 0.00 0.00 51.96 50.64 1i2v s ALA 11 Cb 0.00 0.94 0.07 0.00 0.00 0.00 0.00 23.12 24.14 1i2v s ALA 11 CO 0.00 -0.88 1.14 0.08 0.00 0.00 0.00 175.76 176.10 1i2v s VAL 12 N -2.67 2.58 -0.13 0.00 1.01 -1.26 -3.53 120.40 116.40 1i2v s VAL 12 Ca 0.24 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.41 1i2v s VAL 12 Cb -0.03 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.26 1i2v s VAL 12 CO 0.17 -0.25 0.00 0.59 0.00 0.00 0.00 175.10 175.61 1i2v n ASN 13 N -3.34 -1.35 -4.63 3.32 4.13 -1.26 -4.30 115.26 107.83 1i2v n ASN 13 Ca 0.07 0.45 -0.46 0.00 1.68 0.00 0.00 54.58 56.33 1i2v n ASN 13 Cb 0.59 -1.28 -0.03 0.00 -1.54 0.00 0.00 39.78 37.52 1i2v n ASN 13 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1i2v n TYR 14 N -2.58 1.77 -4.70 3.10 9.36 -1.23 -0.33 117.16 122.54 1i2v n TYR 14 Ca -0.02 0.56 -0.31 0.00 3.32 0.00 0.00 57.90 61.45 1i2v n TYR 14 Cb 0.51 -2.37 -0.09 0.00 -0.63 0.00 0.00 39.34 36.76 1i2v n TYR 14 CO 0.00 0.00 0.00 -0.08 0.22 0.00 0.00 176.86 177.00 1i2v s THR 15 N -0.32 1.39 0.02 2.97 -1.32 -1.23 -4.79 115.64 112.36 1i2v s THR 15 Ca 0.67 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 59.15 1i2v s THR 15 Cb -0.72 -2.44 0.00 0.00 -1.51 0.00 0.00 72.50 67.83 1i2v s THR 15 CO 0.53 0.00 0.00 -1.20 -2.21 0.00 0.00 174.62 171.74 1i2v n SER 16 N -1.16 -0.03 -3.70 8.08 7.64 -1.26 -4.72 113.62 118.46 1i2v n SER 16 Ca -0.14 0.03 -0.36 0.00 1.01 0.00 0.00 58.87 59.41 1i2v n SER 16 Cb 0.67 0.08 -0.03 0.00 -1.01 0.00 0.00 64.21 63.92 1i2v n SER 16 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1i2v n ASP 17 N -2.55 5.29 -0.38 6.43 5.75 -1.26 -4.90 116.55 124.94 1i2v n ASP 17 Ca 0.00 -3.45 -0.08 0.00 -0.01 0.00 0.00 54.79 51.25 1i2v n ASP 17 Cb 0.00 -0.99 -0.06 0.00 -1.03 0.00 0.00 41.12 39.04 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 -0.70 0.46 0.00 -0.73 -1.89 0.29 115.58 113.01 1i2v h ASN 19 Ca 0.19 0.22 -0.02 0.00 1.87 0.00 0.00 56.30 58.55 1i2v h ASN 19 Cb 0.42 0.45 0.00 0.00 0.27 0.00 0.00 38.32 39.46 1i2v h ASN 19 CO -0.87 -0.24 -0.22 1.23 -0.37 0.00 0.00 177.43 176.96 1i2v h GLY 20 N -0.01 -0.65 -1.14 1.57 0.00 0.10 0.27 103.07 103.21 1i2v h GLY 20 Ca 0.34 0.24 0.44 0.00 0.00 0.00 0.00 47.33 48.35 1i2v h GLY 20 CO -0.74 -0.24 0.78 -2.09 0.00 0.00 0.00 176.54 174.26 1i2v h GLU 21 N -0.66 0.06 -0.01 4.80 4.57 0.50 1.41 114.58 125.24 1i2v h GLU 21 Ca -0.06 -0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 57.95 1i2v h GLU 21 Cb 0.48 -0.01 0.01 0.00 -0.16 0.00 0.00 28.75 29.07 1i2v h GLU 21 CO 0.10 0.04 -0.62 0.00 -1.18 0.00 0.00 179.01 177.36 1i2v h LEU 23 N -0.05 0.03 -1.35 0.00 3.38 0.52 0.42 115.31 118.27 1i2v h LEU 23 Ca -0.07 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 1i2v h LEU 23 Cb 1.32 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 1i2v h LEU 23 CO 0.12 0.16 -0.08 -0.07 0.09 0.00 0.00 178.44 178.66 1i2v h LEU 24 N 0.03 0.31 -1.37 1.67 3.38 0.24 -0.85 115.31 118.73 1i2v h LEU 24 Ca 0.01 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1i2v h LEU 24 Cb 0.24 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1i2v h LEU 24 CO 0.02 0.44 0.00 0.54 0.09 0.00 0.00 178.44 179.52 1i2v n ARG 25 N -4.28 1.90 -1.01 1.13 1.74 -0.40 -4.89 116.66 110.85 1i2v n ARG 25 Ca 0.00 -1.35 -0.00 0.00 -0.77 0.00 0.00 57.85 55.73 1i2v n ARG 25 Cb 0.26 -1.43 -0.00 0.00 -1.02 0.00 0.00 32.46 30.27 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 1.22 0.47 3.95 -0.13 0.00 -0.32 -5.02 105.19 105.36 1i2v n GLY 26 Ca 0.17 -0.30 -0.23 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.98 2.87 0.44 1.61 2.02 0.13 -4.93 117.35 117.51 1i2v s TYR 27 Ca 0.00 0.18 -0.12 0.00 -0.37 0.00 0.00 57.07 56.76 1i2v s TYR 27 Cb 0.00 -2.95 -0.07 0.00 -0.40 0.00 0.00 41.96 38.55 1i2v s TYR 27 CO 0.00 -1.11 0.82 0.15 -1.57 0.00 0.00 175.55 173.84 1i2v s LYS 28 N -4.97 3.81 -0.75 -0.62 1.02 -1.26 -3.46 119.74 113.51 1i2v s LYS 28 Ca 0.59 0.58 -0.18 0.00 0.02 0.00 0.00 55.97 56.98 1i2v s LYS 28 Cb -0.10 -2.33 -0.19 0.00 -0.52 0.00 0.00 37.83 34.69 1i2v s LYS 28 CO 0.41 -0.10 1.90 0.41 -0.92 0.00 0.00 175.35 177.04 1i2v n GLY 29 N -1.40 -0.37 0.30 -3.33 0.00 -1.26 -4.17 105.19 94.95 1i2v n GLY 29 Ca 0.03 0.60 -0.03 0.00 0.00 0.00 0.00 46.02 46.63 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 4.64 -2.53 3.83 -0.02 0.00 -1.26 -4.62 105.19 105.23 1i2v n GLY 30 Ca 0.50 -1.44 -0.06 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.17 -0.13 0.23 1.61 -3.43 -0.31 -4.11 115.29 107.99 1i2v s HIS 31 Ca 0.06 -0.32 -0.07 0.00 -0.80 0.00 0.00 55.06 53.92 1i2v s HIS 31 Cb -0.01 0.71 -0.06 0.00 -1.43 0.00 0.00 32.58 31.79 1i2v s HIS 31 CO 0.05 -1.17 0.52 0.00 -2.00 0.00 0.00 174.74 172.14 1i2v n GLY 33 N -0.35 0.00 0.38 0.00 0.00 -0.55 -4.87 105.19 99.80 1i2v n GLY 33 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 0.00 -1.92 1.61 3.41 -1.26 -4.97 113.62 110.49 1i2v n SER 34 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 1i2v n SER 34 Cb 0.00 0.10 0.04 0.00 -0.26 0.00 0.00 64.21 64.08 1i2v n SER 34 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1i2v n PHE 35 N -1.66 2.56 -2.69 7.33 -0.00 -1.26 -4.66 117.46 117.08 1i2v n PHE 35 Ca 0.00 -2.19 -0.06 0.00 -0.00 0.00 0.00 57.45 55.20 1i2v n PHE 35 Cb 0.00 -0.37 0.08 0.00 -0.00 0.00 0.00 39.48 39.18 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 -0.75 0.06 -1.50 3.13 0.00 -1.26 -5.08 120.51 115.11 1i2v n ALA 36 Ca 0.43 -1.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.55 1i2v n ALA 36 Cb 0.94 -1.01 -0.18 0.00 0.00 0.00 0.00 19.45 19.20 1i2v n ALA 36 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1i2v n ASN 37 N -0.58 -0.43 0.00 0.00 4.13 -1.26 -4.11 115.26 113.01 1i2v n ASN 37 Ca -0.11 -0.20 0.00 0.00 1.68 0.00 0.00 54.58 55.95 1i2v n ASN 37 Cb 0.78 -0.77 0.00 0.00 -1.54 0.00 0.00 39.78 38.25 1i2v n ASN 37 CO 0.00 0.00 0.00 0.55 0.28 0.00 0.00 177.26 178.09 1i2v n VAL 38 N 6.64 0.00 -5.22 2.41 3.14 -1.25 -4.53 118.33 119.51 1i2v n VAL 38 Ca 0.66 0.00 -0.30 0.00 -2.96 0.00 0.00 64.34 61.74 1i2v n VAL 38 Cb 0.10 -0.10 -0.16 0.00 -1.06 0.00 0.00 33.84 32.62 1i2v n VAL 38 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 1i2v s ASN 39 N -2.48 2.92 0.04 6.55 -0.87 -1.26 0.16 114.94 120.00 1i2v s ASN 39 Ca 0.00 -0.47 0.03 0.00 -1.57 0.00 0.00 52.86 50.85 1i2v s ASN 39 Cb 0.00 -0.57 -0.04 0.00 -0.02 0.00 0.00 41.25 40.63 1i2v s ASN 39 CO 0.00 0.27 0.02 0.00 -2.57 0.00 0.00 177.10 174.82 1i2v s TRP 41 N -1.22 0.62 0.14 0.00 0.52 0.09 -2.89 118.94 116.20 1i2v s TRP 41 Ca 0.23 -0.62 -0.01 0.00 0.02 0.00 0.00 56.10 55.72 1i2v s TRP 41 Cb -0.12 -0.38 0.03 0.00 -1.15 0.00 0.00 33.47 31.85 1i2v s TRP 41 CO 0.15 -0.14 0.19 0.00 0.02 0.00 0.00 176.95 177.17 1i2v n GLU 43 N -1.38 0.50 0.00 0.00 0.28 -1.26 -4.08 120.64 114.70 1i2v n GLU 43 Ca 0.03 -3.02 0.15 0.00 -0.16 0.00 0.00 57.16 54.16 1i2v n GLU 43 Cb 0.10 -1.42 0.83 0.00 1.43 0.00 0.00 31.44 32.37 1i2v n GLU 43 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22