#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 2.74 0.94 -1.24 -0.14 -1.26 -4.85 119.74 115.93 1i2v s LYS 2 Ca 0.00 -1.10 -0.11 0.00 -1.36 0.00 0.00 55.97 53.40 1i2v s LYS 2 Cb 0.00 -3.48 0.16 0.00 -1.68 0.00 0.00 37.83 32.83 1i2v s LYS 2 CO 0.00 -0.63 1.11 -1.17 -0.76 0.00 0.00 175.35 173.91 1i2v s LEU 3 N 1.44 2.44 0.00 3.17 0.20 -1.26 0.01 118.68 124.68 1i2v s LEU 3 Ca -0.00 1.96 0.00 0.00 0.69 0.00 0.00 54.13 56.78 1i2v s LEU 3 Cb -0.19 -4.29 0.00 0.00 -0.43 0.00 0.00 46.19 41.28 1i2v s LEU 3 CO 0.03 -3.15 0.00 2.30 -0.29 0.00 0.00 176.35 175.25 1i2v n ILE 4 N -4.25 0.00 0.00 6.68 -5.35 -1.05 -4.75 119.36 110.64 1i2v n ILE 4 Ca 0.09 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.57 1i2v n ILE 4 Cb 0.53 -0.34 0.00 0.00 -1.74 0.00 0.00 39.64 38.08 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 2.05 -0.85 4.01 3.28 0.00 -1.24 -5.05 105.19 107.38 1i2v n GLY 5 Ca 0.00 -0.21 -0.17 0.00 0.00 0.00 0.00 46.02 45.63 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 -4.00 5.61 -0.35 1.61 0.01 -0.10 -0.85 113.70 115.63 1i2v s SER 6 Ca 0.00 -0.39 0.15 0.00 1.31 0.00 0.00 55.95 57.02 1i2v s SER 6 Cb 0.00 -0.66 0.44 0.00 0.21 0.00 0.00 66.02 66.01 1i2v s SER 6 CO 0.00 -0.81 0.95 0.00 0.41 0.00 0.00 173.24 173.79 1i2v s VAL 8 N -3.45 0.82 -1.50 0.00 1.01 -1.26 -4.63 120.40 111.39 1i2v s VAL 8 Ca 0.32 -0.28 -0.10 0.00 0.00 0.00 0.00 61.98 61.92 1i2v s VAL 8 Cb 0.43 -0.80 -0.07 0.00 0.00 0.00 0.00 36.38 35.95 1i2v s VAL 8 CO -0.01 0.29 2.75 0.79 0.00 0.00 0.00 175.10 178.92 1i2v n TRP 9 N 4.03 2.41 0.00 5.22 8.01 -1.26 -3.55 117.44 132.30 1i2v n TRP 9 Ca -0.23 -2.91 0.00 0.00 -1.31 0.00 0.00 57.50 53.05 1i2v n TRP 9 Cb 0.51 -2.39 0.00 0.00 -2.01 0.00 0.00 31.31 27.43 1i2v n TRP 9 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1i2v n GLY 10 N 3.68 -1.21 3.82 6.99 0.00 -1.26 -5.18 105.19 112.03 1i2v n GLY 10 Ca 0.71 0.34 -0.04 0.00 0.00 0.00 0.00 46.02 47.02 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 -2.47 -1.92 4.61 0.00 -1.23 -5.13 120.51 114.36 1i2v n ALA 11 Ca 0.00 -1.08 -0.29 0.00 0.00 0.00 0.00 53.44 52.08 1i2v n ALA 11 Cb 0.00 0.67 0.06 0.00 0.00 0.00 0.00 19.45 20.18 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 -2.07 2.77 -0.26 0.00 1.01 -1.26 -3.65 120.40 116.94 1i2v s VAL 12 Ca 0.21 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1i2v s VAL 12 Cb -0.03 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1i2v s VAL 12 CO 0.07 -0.28 0.00 0.59 0.00 0.00 0.00 175.10 175.48 1i2v n ASN 13 N -3.05 -1.67 -4.71 3.32 3.02 -1.26 -4.39 115.26 106.51 1i2v n ASN 13 Ca 0.07 0.41 -0.43 0.00 -0.03 0.00 0.00 54.58 54.60 1i2v n ASN 13 Cb 0.59 -1.55 -0.02 0.00 -0.61 0.00 0.00 39.78 38.19 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 -2.64 2.57 -4.53 3.10 9.36 -1.24 -0.92 117.16 122.86 1i2v n TYR 14 Ca -0.04 0.33 -0.31 0.00 3.32 0.00 0.00 57.90 61.20 1i2v n TYR 14 Cb 0.51 -2.54 -0.06 0.00 -0.63 0.00 0.00 39.34 36.61 1i2v n TYR 14 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1i2v s THR 15 N -0.02 1.35 0.00 2.97 2.01 -1.13 -4.85 115.64 115.96 1i2v s THR 15 Ca 0.66 -1.87 0.00 0.00 0.31 0.00 0.00 61.69 60.78 1i2v s THR 15 Cb -0.56 -2.22 0.00 0.00 0.01 0.00 0.00 72.50 69.73 1i2v s THR 15 CO 0.49 0.00 0.00 -0.24 -0.69 0.00 0.00 174.62 174.18 1i2v n SER 16 N -1.37 0.00 -3.77 3.53 2.88 -1.26 -4.80 113.62 108.83 1i2v n SER 16 Ca -0.14 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.06 1i2v n SER 16 Cb 0.66 0.05 -0.05 0.00 -0.75 0.00 0.00 64.21 64.12 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 -2.40 4.70 -0.33 -3.46 5.75 -1.26 -4.87 116.55 114.68 1i2v n ASP 17 Ca 0.00 -3.37 0.26 0.00 -0.01 0.00 0.00 54.79 51.67 1i2v n ASP 17 Cb 0.00 -0.95 0.49 0.00 -1.03 0.00 0.00 41.12 39.64 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 0.03 -0.04 0.68 0.00 -0.00 -1.90 0.11 115.58 114.47 1i2v h ASN 19 Ca 0.76 -0.07 -0.03 0.00 -0.00 0.00 0.00 56.30 56.96 1i2v h ASN 19 Cb 1.90 0.01 0.01 0.00 -0.00 0.00 0.00 38.32 40.23 1i2v h ASN 19 CO -0.80 0.04 -0.33 1.23 -0.00 0.00 0.00 177.43 177.57 1i2v h GLY 20 N -0.12 -0.96 0.02 1.57 0.00 0.13 0.28 103.07 103.99 1i2v h GLY 20 Ca -0.01 0.36 0.26 0.00 0.00 0.00 0.00 47.33 47.94 1i2v h GLY 20 CO 0.01 -0.35 0.67 0.83 0.00 0.00 0.00 176.54 177.70 1i2v h GLU 21 N -1.01 0.24 0.01 4.80 3.07 -0.19 0.60 114.58 122.09 1i2v h GLU 21 Ca -0.09 -0.01 -0.18 0.00 -0.50 0.00 0.00 59.36 58.57 1i2v h GLU 21 Cb 0.73 -0.05 0.02 0.00 -0.84 0.00 0.00 28.75 28.60 1i2v h GLU 21 CO 0.15 0.16 -0.72 0.00 -1.40 0.00 0.00 179.01 177.20 1i2v h LEU 23 N -0.01 0.10 -1.61 0.00 3.38 0.29 0.57 115.31 118.02 1i2v h LEU 23 Ca -0.09 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1i2v h LEU 23 Cb 1.43 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.14 1i2v h LEU 23 CO 0.14 0.26 -0.02 -0.07 0.09 0.00 0.00 178.44 178.83 1i2v h LEU 24 N 0.11 0.19 -1.25 1.67 3.38 0.10 -0.42 115.31 119.09 1i2v h LEU 24 Ca 0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i2v h LEU 24 Cb 0.31 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1i2v h LEU 24 CO 0.02 0.26 -0.07 0.54 0.09 0.00 0.00 178.44 179.28 1i2v n ARG 25 N -4.38 1.76 -0.66 1.13 1.74 -0.47 -4.92 116.66 110.86 1i2v n ARG 25 Ca -0.01 -1.25 0.00 0.00 -0.77 0.00 0.00 57.85 55.82 1i2v n ARG 25 Cb 0.18 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 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 1.28 0.72 3.91 -0.13 0.00 -0.17 -5.04 105.19 105.77 1i2v n GLY 26 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.45 3.29 0.57 1.61 2.02 0.19 -4.90 117.35 117.67 1i2v s TYR 27 Ca 0.00 0.71 -0.05 0.00 -0.37 0.00 0.00 57.07 57.37 1i2v s TYR 27 Cb 0.00 -2.75 0.01 0.00 -0.40 0.00 0.00 41.96 38.82 1i2v s TYR 27 CO 0.00 -0.83 0.86 -1.59 -1.57 0.00 0.00 175.55 172.42 1i2v s LYS 28 N -5.02 2.92 -0.60 -0.62 0.00 -1.26 -3.14 119.74 112.02 1i2v s LYS 28 Ca 0.54 -0.12 -0.15 0.00 0.00 0.00 0.00 55.97 56.24 1i2v s LYS 28 Cb -0.11 -2.33 -0.15 0.00 0.00 0.00 0.00 37.83 35.25 1i2v s LYS 28 CO 0.46 -0.64 1.53 0.41 0.00 0.00 0.00 175.35 177.11 1i2v n GLY 29 N -2.49 -0.29 0.00 0.59 0.00 -1.26 -3.69 105.19 98.04 1i2v n GLY 29 Ca 0.04 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 3.72 -1.40 3.82 -0.02 0.00 -1.26 -3.95 105.19 106.10 1i2v n GLY 30 Ca 0.40 -1.60 -0.06 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.81 -0.09 0.37 1.61 -3.43 -0.04 -4.44 115.29 108.45 1i2v s HIS 31 Ca 0.00 -0.34 -0.17 0.00 -0.80 0.00 0.00 55.06 53.75 1i2v s HIS 31 Cb 0.00 0.71 -0.09 0.00 -1.43 0.00 0.00 32.58 31.76 1i2v s HIS 31 CO 0.00 -1.12 0.82 0.00 -2.00 0.00 0.00 174.74 172.44 1i2v n GLY 33 N -0.57 -0.35 2.07 0.00 0.00 0.16 -4.78 105.19 101.72 1i2v n GLY 33 Ca 0.05 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.15 -1.26 -2.78 1.61 3.41 -1.26 -4.98 113.62 108.20 1i2v n SER 34 Ca 0.00 0.45 -0.01 0.00 -0.26 0.00 0.00 58.87 59.05 1i2v n SER 34 Cb 0.00 1.34 0.01 0.00 -0.26 0.00 0.00 64.21 65.30 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 -0.63 0.00 7.33 2.19 -1.26 -4.94 117.98 118.67 1i2v s PHE 35 Ca 0.00 -0.05 0.00 0.00 0.33 0.00 0.00 56.93 57.21 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 -0.46 0.00 0.00 1.83 0.00 0.00 175.22 176.59 1i2v n ALA 36 N 3.29 0.00 1.27 11.12 0.00 -1.26 -4.95 120.51 129.99 1i2v n ALA 36 Ca 0.10 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.68 1i2v n ALA 36 Cb 0.62 -0.29 0.71 0.00 0.00 0.00 0.00 19.45 20.49 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 1.09 0.00 -2.41 0.00 5.15 -1.26 -4.86 115.26 112.97 1i2v n ASN 37 Ca 0.00 0.09 -0.03 0.00 -0.60 0.00 0.00 54.58 54.04 1i2v n ASN 37 Cb 0.29 -0.36 -0.00 0.00 -0.53 0.00 0.00 39.78 39.18 1i2v n ASN 37 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 1i2v n VAL 38 N -1.36 -0.14 -3.68 3.44 0.24 -1.26 -4.85 118.33 110.71 1i2v n VAL 38 Ca 0.12 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.32 1i2v n VAL 38 Cb 0.28 -0.44 -0.10 0.00 -1.47 0.00 0.00 33.84 32.11 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 -1.97 -0.53 -0.12 -1.34 0.01 -1.26 -3.79 114.94 105.93 1i2v s ASN 39 Ca 0.00 0.99 -0.06 0.00 -0.71 0.00 0.00 52.86 53.09 1i2v s ASN 39 Cb 0.00 0.96 -0.04 0.00 0.41 0.00 0.00 41.25 42.58 1i2v s ASN 39 CO 0.00 -0.21 0.09 0.00 -1.51 0.00 0.00 177.10 175.48 1i2v s TRP 41 N -0.80 1.77 0.60 0.00 0.52 -0.16 -2.53 118.94 118.33 1i2v s TRP 41 Ca 0.13 -0.45 -0.07 0.00 0.02 0.00 0.00 56.10 55.73 1i2v s TRP 41 Cb -0.12 -0.93 -0.00 0.00 -1.15 0.00 0.00 33.47 31.26 1i2v s TRP 41 CO 0.03 0.25 0.93 0.00 0.02 0.00 0.00 176.95 178.18 1i2v n GLU 43 N -2.63 3.75 0.00 0.00 2.13 -1.24 -4.01 120.64 118.64 1i2v n GLU 43 Ca 0.04 -3.66 0.13 0.00 0.66 0.00 0.00 57.16 54.33 1i2v n GLU 43 Cb 0.57 -2.36 0.31 0.00 0.27 0.00 0.00 31.44 30.23 1i2v n GLU 43 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35