#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 0.72 0.61 0.11 3.01 -1.26 -4.98 119.74 117.95 1i2v s LYS 2 Ca 0.00 -0.03 -0.08 0.00 -1.01 0.00 0.00 55.97 54.85 1i2v s LYS 2 Cb 0.00 -0.85 -0.00 0.00 -1.01 0.00 0.00 37.83 35.97 1i2v s LYS 2 CO 0.00 -0.15 0.95 -1.17 0.51 0.00 0.00 175.35 175.49 1i2v s LEU 3 N 1.23 3.20 0.00 3.17 1.98 -1.26 -0.54 118.68 126.46 1i2v s LEU 3 Ca -0.06 0.92 0.00 0.00 -2.89 0.00 0.00 54.13 52.09 1i2v s LEU 3 Cb -0.14 -3.78 0.00 0.00 0.66 0.00 0.00 46.19 42.94 1i2v s LEU 3 CO -0.02 -1.05 0.00 2.30 -1.89 0.00 0.00 176.35 175.69 1i2v n ILE 4 N -2.66 0.00 -3.61 6.68 -5.35 -1.26 -4.81 119.36 108.35 1i2v n ILE 4 Ca 0.05 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.53 1i2v n ILE 4 Cb 0.57 -0.10 0.00 0.00 -1.74 0.00 0.00 39.64 38.37 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 -0.80 3.96 3.28 0.00 -1.26 -5.06 105.19 107.14 1i2v n GLY 5 Ca 0.00 -0.96 -0.23 0.00 0.00 0.00 0.00 46.02 44.82 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 4.86 -0.28 1.61 0.15 -0.30 -1.47 113.70 114.26 1i2v s SER 6 Ca 0.00 0.04 0.20 0.00 0.70 0.00 0.00 55.95 56.90 1i2v s SER 6 Cb 0.00 -0.72 0.50 0.00 -1.71 0.00 0.00 66.02 64.09 1i2v s SER 6 CO 0.00 -1.49 1.09 0.00 1.20 0.00 0.00 173.24 174.04 1i2v s VAL 8 N -3.80 2.56 -1.37 0.00 1.01 -1.25 -4.27 120.40 113.28 1i2v s VAL 8 Ca 0.30 -0.80 -0.11 0.00 0.00 0.00 0.00 61.98 61.36 1i2v s VAL 8 Cb 0.35 -2.07 -0.06 0.00 0.00 0.00 0.00 36.38 34.60 1i2v s VAL 8 CO -0.02 0.52 2.54 1.87 0.00 0.00 0.00 175.10 180.01 1i2v n TRP 9 N 4.11 2.36 0.00 5.22 -0.00 -1.26 -3.29 117.44 124.58 1i2v n TRP 9 Ca -0.19 -2.72 0.00 0.00 -0.00 0.00 0.00 57.50 54.59 1i2v n TRP 9 Cb 0.52 -2.26 0.00 0.00 -0.00 0.00 0.00 31.31 29.56 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 3.80 -1.09 3.75 5.87 0.00 -1.26 -5.18 105.19 111.08 1i2v n GLY 10 Ca 0.63 0.25 -0.08 0.00 0.00 0.00 0.00 46.02 46.83 1i2v n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i2v n ALA 11 N 0.00 -1.86 -1.99 4.61 0.00 -1.21 -5.13 120.51 114.93 1i2v n ALA 11 Ca 0.00 -1.24 -0.28 0.00 0.00 0.00 0.00 53.44 51.93 1i2v n ALA 11 Cb 0.00 0.96 0.04 0.00 0.00 0.00 0.00 19.45 20.45 1i2v n ALA 11 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1i2v s VAL 12 N -2.10 3.31 -0.24 0.00 1.01 -1.26 -3.75 120.40 117.37 1i2v s VAL 12 Ca 0.16 0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.24 1i2v s VAL 12 Cb -0.05 -3.37 0.01 0.00 0.00 0.00 0.00 36.38 32.98 1i2v s VAL 12 CO 0.11 -0.42 0.04 0.59 0.00 0.00 0.00 175.10 175.42 1i2v n ASN 13 N -2.81 -1.41 -4.74 3.32 4.13 -1.26 -4.51 115.26 107.99 1i2v n ASN 13 Ca 0.06 0.35 -0.41 0.00 1.68 0.00 0.00 54.58 56.26 1i2v n ASN 13 Cb 0.58 -1.32 -0.02 0.00 -1.54 0.00 0.00 39.78 37.48 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 -2.15 3.03 0.52 3.10 5.04 -1.25 -1.15 117.35 124.49 1i2v s TYR 14 Ca 0.05 0.99 0.05 0.00 -2.44 0.00 0.00 57.07 55.72 1i2v s TYR 14 Cb -0.03 -3.83 0.02 0.00 0.35 0.00 0.00 41.96 38.47 1i2v s TYR 14 CO 0.07 -2.73 0.33 0.99 -1.34 0.00 0.00 175.55 172.87 1i2v s THR 15 N 0.13 1.68 0.02 4.34 2.01 -1.01 -4.87 115.64 117.94 1i2v s THR 15 Ca 0.60 -1.57 0.00 0.00 0.31 0.00 0.00 61.69 61.03 1i2v s THR 15 Cb -0.42 -2.25 0.00 0.00 0.01 0.00 0.00 72.50 69.84 1i2v s THR 15 CO 0.42 0.00 0.00 -1.20 -0.69 0.00 0.00 174.62 173.15 1i2v n SER 16 N -1.64 -0.05 -3.87 3.53 7.64 -1.26 -4.79 113.62 113.18 1i2v n SER 16 Ca -0.04 0.03 -0.40 0.00 1.01 0.00 0.00 58.87 59.47 1i2v n SER 16 Cb 0.65 0.12 -0.00 0.00 -1.01 0.00 0.00 64.21 63.97 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 -2.56 6.15 0.00 6.43 5.75 -1.26 -4.90 116.55 126.16 1i2v n ASP 17 Ca 0.00 -3.45 0.00 0.00 -0.01 0.00 0.00 54.79 51.33 1i2v n ASP 17 Cb 0.00 -1.17 0.00 0.00 -1.03 0.00 0.00 41.12 38.92 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 -2.80 0.19 0.20 0.00 5.15 -1.26 0.62 115.26 117.36 1i2v n ASN 19 Ca 0.00 1.29 -0.12 0.00 -0.60 0.00 0.00 54.58 55.15 1i2v n ASN 19 Cb 0.00 -0.63 -0.07 0.00 -0.53 0.00 0.00 39.78 38.55 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 -0.57 0.56 8.20 0.00 0.10 0.12 103.07 111.49 1i2v h GLY 20 Ca 0.83 0.21 0.15 0.00 0.00 0.00 0.00 47.33 48.52 1i2v h GLY 20 CO -0.43 -0.21 0.55 -2.09 0.00 0.00 0.00 176.54 174.36 1i2v h GLU 21 N -0.98 0.52 -0.02 4.80 4.57 0.48 0.54 114.58 124.49 1i2v h GLU 21 Ca -0.06 -0.03 -0.15 0.00 -1.18 0.00 0.00 59.36 57.95 1i2v h GLU 21 Cb 0.55 -0.12 0.01 0.00 -0.16 0.00 0.00 28.75 29.03 1i2v h GLU 21 CO 0.09 0.34 -0.56 0.00 -1.18 0.00 0.00 179.01 177.71 1i2v h LEU 23 N -0.09 0.11 -1.61 0.00 3.38 0.78 0.39 115.31 118.27 1i2v h LEU 23 Ca -0.06 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1i2v h LEU 23 Cb 1.26 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 1i2v h LEU 23 CO 0.11 0.27 -0.21 -0.07 0.09 0.00 0.00 178.44 178.63 1i2v h LEU 24 N 0.11 0.00 -2.35 1.67 3.38 0.12 -0.96 115.31 117.28 1i2v h LEU 24 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1i2v h LEU 24 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1i2v h LEU 24 CO 0.02 0.21 0.00 0.54 0.09 0.00 0.00 178.44 179.30 1i2v n ARG 25 N -4.12 2.52 -1.28 1.13 1.74 -0.47 -4.92 116.66 111.26 1i2v n ARG 25 Ca -0.02 -2.31 -0.10 0.00 -0.77 0.00 0.00 57.85 54.65 1i2v n ARG 25 Cb 0.28 -1.52 -0.04 0.00 -1.02 0.00 0.00 32.46 30.16 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 1.53 1.07 3.94 -0.13 0.00 -0.37 -4.99 105.19 106.25 1i2v n GLY 26 Ca 0.20 -0.33 -0.28 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.21 2.18 0.34 1.61 2.02 0.13 -4.95 117.35 116.46 1i2v s TYR 27 Ca 0.00 0.33 -0.12 0.00 -0.37 0.00 0.00 57.07 56.91 1i2v s TYR 27 Cb 0.00 -3.59 -0.08 0.00 -0.40 0.00 0.00 41.96 37.89 1i2v s TYR 27 CO 0.00 -2.03 0.71 0.15 -1.57 0.00 0.00 175.55 172.81 1i2v s LYS 28 N -5.55 3.87 -0.40 -0.62 3.01 -1.26 -4.22 119.74 114.56 1i2v s LYS 28 Ca 0.67 0.50 -0.19 0.00 -1.01 0.00 0.00 55.97 55.94 1i2v s LYS 28 Cb -0.07 -2.46 -0.11 0.00 -1.01 0.00 0.00 37.83 34.18 1i2v s LYS 28 CO 0.49 0.11 1.26 0.41 0.51 0.00 0.00 175.35 178.13 1i2v n GLY 29 N -0.70 -0.18 3.09 -3.33 0.00 -1.26 -3.00 105.19 99.81 1i2v n GLY 29 Ca 0.02 0.58 -0.20 0.00 0.00 0.00 0.00 46.02 46.42 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 3.52 -0.18 3.82 -0.02 0.00 -1.26 -3.97 105.19 107.10 1i2v n GLY 30 Ca 0.31 -1.89 -0.05 0.00 0.00 0.00 0.00 46.02 44.39 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 -2.78 -0.01 0.16 1.61 -3.43 -0.46 -4.22 115.29 106.16 1i2v s HIS 31 Ca 0.56 -0.44 -0.05 0.00 -0.80 0.00 0.00 55.06 54.33 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 0.38 -1.11 0.40 0.00 -2.00 0.00 0.00 174.74 172.41 1i2v n GLY 33 N -0.01 -1.74 0.01 0.00 0.00 -0.57 -4.92 105.19 97.95 1i2v n GLY 33 Ca -0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 1.23 0.13 -1.43 1.61 3.41 -1.26 -3.59 113.62 113.72 1i2v n SER 34 Ca 0.11 0.21 0.06 0.00 -0.26 0.00 0.00 58.87 58.99 1i2v n SER 34 Cb 0.43 -0.52 0.29 0.00 -0.26 0.00 0.00 64.21 64.15 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 -2.48 1.38 -2.69 7.33 7.35 -1.26 -4.18 117.46 122.90 1i2v n PHE 35 Ca -0.01 -0.50 -0.06 0.00 -0.76 0.00 0.00 57.45 56.12 1i2v n PHE 35 Cb 0.02 -0.31 0.08 0.00 0.35 0.00 0.00 39.48 39.63 1i2v n PHE 35 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1i2v n ALA 36 N 0.64 -0.54 -1.00 3.13 0.00 -1.26 -5.14 120.51 116.33 1i2v n ALA 36 Ca 0.20 -1.05 0.00 0.00 0.00 0.00 0.00 53.44 52.59 1i2v n ALA 36 Cb 0.85 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 -0.20 0.00 0.00 0.00 2.85 -1.24 -4.44 115.26 112.23 1i2v n ASN 37 Ca -0.06 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.41 1i2v n ASN 37 Cb 0.76 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.78 1i2v n ASN 37 CO 0.00 0.00 0.00 0.55 -2.11 0.00 0.00 177.26 175.70 1i2v n VAL 38 N -0.53 0.00 -3.82 3.44 3.14 -1.26 -4.79 118.33 114.51 1i2v n VAL 38 Ca 0.00 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.27 1i2v n VAL 38 Cb 0.00 0.00 -0.08 0.00 -1.06 0.00 0.00 33.84 32.70 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 -2.30 -0.02 0.27 6.55 0.01 -1.26 -1.48 114.94 116.70 1i2v s ASN 39 Ca 0.00 -0.28 0.07 0.00 -0.71 0.00 0.00 52.86 51.95 1i2v s ASN 39 Cb 0.00 0.30 -0.04 0.00 0.41 0.00 0.00 41.25 41.93 1i2v s ASN 39 CO 0.00 -0.55 0.19 0.00 -1.51 0.00 0.00 177.10 175.23 1i2v s TRP 41 N -2.20 -0.01 0.41 0.00 0.52 -0.15 -4.17 118.94 113.35 1i2v s TRP 41 Ca 0.34 -0.20 0.02 0.00 0.02 0.00 0.00 56.10 56.28 1i2v s TRP 41 Cb -0.07 0.03 -0.01 0.00 -1.15 0.00 0.00 33.47 32.27 1i2v s TRP 41 CO 0.25 -0.48 0.61 0.00 0.02 0.00 0.00 176.95 177.35 1i2v n GLU 43 N -1.95 5.27 0.00 0.00 1.02 -1.16 -4.32 120.64 119.49 1i2v n GLU 43 Ca 0.00 -4.63 0.12 0.00 -0.02 0.00 0.00 57.16 52.63 1i2v n GLU 43 Cb 0.58 -2.45 0.10 0.00 -0.02 0.00 0.00 31.44 29.64 1i2v n GLU 43 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94