#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 0.57 0.97 0.11 2.47 -1.26 -4.96 119.74 117.63 1i2v s LYS 2 Ca 0.00 -0.90 -0.11 0.00 -1.56 0.00 0.00 55.97 53.40 1i2v s LYS 2 Cb 0.00 -1.78 0.17 0.00 -1.46 0.00 0.00 37.83 34.76 1i2v s LYS 2 CO 0.00 -0.98 1.07 -0.11 0.16 0.00 0.00 175.35 175.49 1i2v n LEU 3 N 4.96 2.29 0.00 5.43 0.00 -1.26 -0.09 117.00 128.33 1i2v n LEU 3 Ca -0.03 0.31 0.00 0.00 0.00 0.00 0.00 56.01 56.29 1i2v n LEU 3 Cb 0.42 -1.42 0.00 0.00 0.00 0.00 0.00 43.42 42.42 1i2v n LEU 3 CO 0.09 -2.44 -0.10 2.30 0.00 0.00 0.00 177.39 177.24 1i2v n ILE 4 N -4.35 0.00 0.00 1.96 -5.35 -1.21 -4.73 119.36 105.68 1i2v n ILE 4 Ca 0.10 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.58 1i2v n ILE 4 Cb 0.52 -0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.16 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 1.89 -0.80 3.97 3.28 0.00 -1.25 -5.07 105.19 107.21 1i2v n GLY 5 Ca 0.00 -0.29 -0.19 0.00 0.00 0.00 0.00 46.02 45.54 1i2v n GLY 5 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1i2v s SER 6 N -4.00 5.34 -0.28 1.61 0.15 -0.30 -1.29 113.70 114.93 1i2v s SER 6 Ca 0.00 -0.62 0.20 0.00 0.70 0.00 0.00 55.95 56.23 1i2v s SER 6 Cb 0.00 -0.45 0.48 0.00 -1.71 0.00 0.00 66.02 64.34 1i2v s SER 6 CO 0.00 -0.82 1.19 0.00 1.20 0.00 0.00 173.24 174.81 1i2v s VAL 8 N -2.90 1.70 -1.31 0.00 1.01 -1.26 -4.57 120.40 113.07 1i2v s VAL 8 Ca 0.23 -0.78 -0.15 0.00 0.00 0.00 0.00 61.98 61.29 1i2v s VAL 8 Cb 0.36 -1.52 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1i2v s VAL 8 CO -0.05 0.48 2.26 1.87 0.00 0.00 0.00 175.10 179.66 1i2v n TRP 9 N 3.95 2.92 0.00 5.22 -0.00 -1.26 -3.15 117.44 125.12 1i2v n TRP 9 Ca -0.20 -2.70 0.00 0.00 -0.00 0.00 0.00 57.50 54.60 1i2v n TRP 9 Cb 0.52 -2.33 0.00 0.00 -0.00 0.00 0.00 31.31 29.50 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 4.10 -0.02 3.76 5.87 0.00 -1.26 -5.17 105.19 112.46 1i2v n GLY 10 Ca 0.55 0.01 -0.10 0.00 0.00 0.00 0.00 46.02 46.48 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 -0.54 0.69 4.61 0.00 -1.19 -5.14 121.76 120.20 1i2v s ALA 11 Ca 0.00 -0.85 -0.07 0.00 0.00 0.00 0.00 51.96 51.04 1i2v s ALA 11 Cb 0.00 0.75 0.05 0.00 0.00 0.00 0.00 23.12 23.92 1i2v s ALA 11 CO 0.00 -0.96 1.02 0.08 0.00 0.00 0.00 175.76 175.90 1i2v s VAL 12 N -2.48 2.62 -0.30 0.00 1.01 -1.26 -3.79 120.40 116.19 1i2v s VAL 12 Ca 0.17 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1i2v s VAL 12 Cb -0.04 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.21 1i2v s VAL 12 CO 0.13 -0.14 0.00 0.59 0.00 0.00 0.00 175.10 175.67 1i2v n ASN 13 N -2.90 -1.78 -4.71 3.32 3.02 -1.26 -4.38 115.26 106.57 1i2v n ASN 13 Ca 0.07 0.40 -0.43 0.00 -0.03 0.00 0.00 54.58 54.59 1i2v n ASN 13 Cb 0.60 -1.63 -0.02 0.00 -0.61 0.00 0.00 39.78 38.11 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 -2.68 2.59 -4.57 3.10 9.36 -1.25 -1.15 117.16 122.57 1i2v n TYR 14 Ca -0.04 0.29 -0.32 0.00 3.32 0.00 0.00 57.90 61.15 1i2v n TYR 14 Cb 0.51 -2.56 -0.05 0.00 -0.63 0.00 0.00 39.34 36.61 1i2v n TYR 14 CO 0.00 0.00 0.00 -2.37 0.22 0.00 0.00 176.86 174.71 1i2v n THR 15 N 2.31 0.00 0.00 2.97 5.66 -0.78 -4.85 114.28 119.59 1i2v n THR 15 Ca 0.11 -2.38 0.00 0.00 -3.05 0.00 0.00 64.05 58.72 1i2v n THR 15 Cb 0.34 0.37 0.00 0.00 -1.55 0.00 0.00 70.33 69.50 1i2v n THR 15 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1i2v n SER 16 N -1.43 0.00 -3.70 1.09 7.64 -1.26 -4.73 113.62 111.24 1i2v n SER 16 Ca -0.17 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.33 1i2v n SER 16 Cb 0.65 0.05 -0.01 0.00 -1.01 0.00 0.00 64.21 63.89 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 -2.44 6.08 0.00 6.43 5.75 -1.26 -4.91 116.55 126.21 1i2v n ASP 17 Ca 0.00 -3.53 0.00 0.00 -0.01 0.00 0.00 54.79 51.25 1i2v n ASP 17 Cb 0.00 -1.07 0.00 0.00 -1.03 0.00 0.00 41.12 39.02 1i2v n ASP 17 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1i2v n ASN 19 N -2.59 0.13 0.21 0.00 5.15 -1.26 0.84 115.26 117.73 1i2v n ASN 19 Ca 0.00 1.44 -0.14 0.00 -0.60 0.00 0.00 54.58 55.28 1i2v n ASN 19 Cb 0.00 -0.63 -0.08 0.00 -0.53 0.00 0.00 39.78 38.54 1i2v n ASN 19 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1i2v h GLY 20 N 0.00 -0.55 1.36 8.20 0.00 1.00 0.35 103.07 113.43 1i2v h GLY 20 Ca 0.64 0.20 0.09 0.00 0.00 0.00 0.00 47.33 48.27 1i2v h GLY 20 CO -0.73 -0.20 0.23 -2.09 0.00 0.00 0.00 176.54 173.76 1i2v h GLU 21 N -0.76 0.00 0.01 4.80 4.81 0.50 0.40 114.58 124.34 1i2v h GLU 21 Ca -0.05 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.05 1i2v h GLU 21 Cb 0.52 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.91 1i2v h GLU 21 CO 0.09 0.00 -0.49 0.00 -0.73 0.00 0.00 179.01 177.88 1i2v h LEU 23 N -0.26 0.26 -1.38 0.00 3.38 0.14 0.24 115.31 117.69 1i2v h LEU 23 Ca -0.06 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1i2v h LEU 23 Cb 1.22 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 1i2v h LEU 23 CO 0.10 0.25 0.18 -0.07 0.09 0.00 0.00 178.44 178.98 1i2v h LEU 24 N 0.30 0.54 -0.88 1.67 3.38 -0.21 -0.60 115.31 119.51 1i2v h LEU 24 Ca 0.08 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1i2v h LEU 24 Cb 0.07 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1i2v h LEU 24 CO -0.01 0.48 -0.02 0.54 0.09 0.00 0.00 178.44 179.52 1i2v n ARG 25 N -4.38 1.56 -0.86 1.13 1.74 -0.28 -4.90 116.66 110.68 1i2v n ARG 25 Ca 0.03 -0.88 0.00 0.00 -0.77 0.00 0.00 57.85 56.23 1i2v n ARG 25 Cb 0.14 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.10 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 1.18 0.54 3.90 -0.13 0.00 -0.23 -5.03 105.19 105.42 1i2v n GLY 26 Ca 0.19 -0.25 -0.28 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.00 3.28 0.70 1.61 2.02 0.68 -4.94 117.35 118.70 1i2v s TYR 27 Ca 0.00 0.79 -0.05 0.00 -0.37 0.00 0.00 57.07 57.44 1i2v s TYR 27 Cb 0.00 -2.86 0.08 0.00 -0.40 0.00 0.00 41.96 38.78 1i2v s TYR 27 CO 0.00 -0.96 0.99 -1.59 -1.57 0.00 0.00 175.55 172.42 1i2v s LYS 28 N -5.13 2.01 -0.27 -0.62 0.00 -1.26 -3.87 119.74 110.60 1i2v s LYS 28 Ca 0.55 -0.56 -0.15 0.00 0.00 0.00 0.00 55.97 55.81 1i2v s LYS 28 Cb -0.11 -2.24 -0.08 0.00 0.00 0.00 0.00 37.83 35.40 1i2v s LYS 28 CO 0.48 -1.28 0.93 0.41 0.00 0.00 0.00 175.35 175.88 1i2v n GLY 29 N -2.86 -0.11 0.07 0.59 0.00 -1.26 -4.14 105.19 97.48 1i2v n GLY 29 Ca 0.10 0.45 -0.00 0.00 0.00 0.00 0.00 46.02 46.57 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 2.81 1.50 3.84 -0.02 0.00 -1.26 -3.68 105.19 108.38 1i2v n GLY 30 Ca 0.23 -2.07 -0.04 0.00 0.00 0.00 0.00 46.02 44.14 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 0.66 0.03 0.02 1.61 -3.43 -0.19 -4.49 115.29 109.50 1i2v s HIS 31 Ca 0.01 -0.47 -0.01 0.00 -0.80 0.00 0.00 55.06 53.78 1i2v s HIS 31 Cb -0.00 0.72 -0.04 0.00 -1.43 0.00 0.00 32.58 31.83 1i2v s HIS 31 CO 0.01 -1.04 0.18 0.00 -2.00 0.00 0.00 174.74 171.88 1i2v n GLY 33 N 0.75 0.24 1.13 0.00 0.00 0.81 -4.73 105.19 103.39 1i2v n GLY 33 Ca -0.09 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.15 0.00 -2.79 1.61 2.88 -1.26 -4.84 113.62 109.36 1i2v n SER 34 Ca 0.00 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.53 1i2v n SER 34 Cb 0.00 0.22 0.01 0.00 -0.75 0.00 0.00 64.21 63.69 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 -1.56 -0.68 0.00 0.66 5.36 -1.26 -4.98 117.98 115.52 1i2v s PHE 35 Ca 0.00 -0.05 0.00 0.00 -0.96 0.00 0.00 56.93 55.92 1i2v s PHE 35 Cb 0.00 0.13 0.00 0.00 -0.34 0.00 0.00 43.02 42.81 1i2v s PHE 35 CO 0.00 -0.49 0.00 0.00 -1.46 0.00 0.00 175.22 173.27 1i2v n ALA 36 N 3.33 -0.08 -2.26 11.12 0.00 -1.26 -5.10 120.51 126.25 1i2v n ALA 36 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1i2v n ALA 36 Cb 0.62 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.70 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 -0.82 0.14 -1.47 0.00 2.85 -1.26 -5.08 115.26 109.61 1i2v n ASN 37 Ca 0.00 0.00 -0.03 0.00 -0.11 0.00 0.00 54.58 54.44 1i2v n ASN 37 Cb 0.37 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.40 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 0.00 0.00 -3.92 3.44 0.24 -1.26 -5.01 118.33 111.81 1i2v n VAL 38 Ca 0.00 -0.29 -0.10 0.00 -2.04 0.00 0.00 64.34 61.90 1i2v n VAL 38 Cb 0.00 0.55 -0.01 0.00 -1.47 0.00 0.00 33.84 32.91 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 -0.71 0.23 0.09 -1.34 0.01 -1.26 -4.01 114.94 107.95 1i2v s ASN 39 Ca 0.03 -1.15 0.10 0.00 -0.71 0.00 0.00 52.86 51.13 1i2v s ASN 39 Cb 0.13 0.75 -0.03 0.00 0.41 0.00 0.00 41.25 42.50 1i2v s ASN 39 CO -0.04 -1.46 -0.26 0.00 -1.51 0.00 0.00 177.10 173.84 1i2v s TRP 41 N -0.97 0.30 0.25 0.00 0.52 -0.22 -3.30 118.94 115.52 1i2v s TRP 41 Ca 0.12 -0.72 0.01 0.00 0.02 0.00 0.00 56.10 55.53 1i2v s TRP 41 Cb -0.10 -0.11 0.05 0.00 -1.15 0.00 0.00 33.47 32.16 1i2v s TRP 41 CO 0.04 -0.59 0.34 0.00 0.02 0.00 0.00 176.95 176.77 1i2v n GLU 43 N -1.61 0.43 0.00 0.00 2.13 -1.24 -4.35 120.64 116.00 1i2v n GLU 43 Ca 0.06 -3.02 0.14 0.00 0.66 0.00 0.00 57.16 55.00 1i2v n GLU 43 Cb 0.21 -1.48 0.47 0.00 0.27 0.00 0.00 31.44 30.92 1i2v n GLU 43 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35