#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 1.94 0.99 -1.24 3.01 -1.26 -4.89 119.74 118.29 1i2v s LYS 2 Ca 0.00 -1.70 -0.12 0.00 -1.01 0.00 0.00 55.97 53.14 1i2v s LYS 2 Cb 0.00 -3.35 0.12 0.00 -1.01 0.00 0.00 37.83 33.59 1i2v s LYS 2 CO 0.00 -0.91 0.73 -0.11 0.51 0.00 0.00 175.35 175.57 1i2v n LEU 3 N 4.49 0.72 0.00 3.17 0.00 -1.26 0.03 117.00 124.15 1i2v n LEU 3 Ca -0.03 0.24 0.00 0.00 0.00 0.00 0.00 56.01 56.22 1i2v n LEU 3 Cb 0.42 -1.29 0.00 0.00 0.00 0.00 0.00 43.42 42.55 1i2v n LEU 3 CO 0.28 -2.96 -0.15 2.30 0.00 0.00 0.00 177.39 176.85 1i2v n ILE 4 N -4.15 0.00 0.00 1.96 -5.35 -1.20 -4.71 119.36 105.91 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 -0.51 0.00 0.00 -1.74 0.00 0.00 39.64 37.93 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 2.02 -0.75 3.91 3.28 0.00 -1.25 -5.06 105.19 107.34 1i2v n GLY 5 Ca 0.00 -0.37 -0.25 0.00 0.00 0.00 0.00 46.02 45.40 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 6.10 -0.40 1.61 0.15 -0.42 -1.40 113.70 115.33 1i2v s SER 6 Ca 0.00 0.07 0.08 0.00 0.70 0.00 0.00 55.95 56.79 1i2v s SER 6 Cb 0.00 -1.77 0.43 0.00 -1.71 0.00 0.00 66.02 62.98 1i2v s SER 6 CO 0.00 0.04 1.09 0.00 1.20 0.00 0.00 173.24 175.57 1i2v s VAL 8 N -4.98 1.48 -0.78 0.00 1.01 -1.26 -4.59 120.40 111.28 1i2v s VAL 8 Ca 0.44 -0.65 -0.26 0.00 0.00 0.00 0.00 61.98 61.52 1i2v s VAL 8 Cb 0.41 -1.45 -0.00 0.00 0.00 0.00 0.00 36.38 35.34 1i2v s VAL 8 CO -0.12 0.38 1.67 0.86 0.00 0.00 0.00 175.10 177.89 1i2v s TRP 9 N 1.51 1.99 0.00 5.22 -0.00 -1.26 -1.62 118.94 124.78 1i2v s TRP 9 Ca 0.04 0.27 0.00 0.00 -0.00 0.00 0.00 56.10 56.41 1i2v s TRP 9 Cb -0.13 -4.32 0.00 0.00 -0.00 0.00 0.00 33.47 29.02 1i2v s TRP 9 CO -0.10 -2.06 0.00 0.41 -0.00 0.00 0.00 176.95 175.20 1i2v n GLY 10 N 6.08 0.92 4.01 5.86 0.00 -1.26 -5.13 105.19 115.68 1i2v n GLY 10 Ca 0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.90 4.24 0.73 4.61 0.00 -0.64 -5.09 121.76 124.71 1i2v s ALA 11 Ca 0.00 -1.87 -0.10 0.00 0.00 0.00 0.00 51.96 49.99 1i2v s ALA 11 Cb 0.00 -1.74 0.05 0.00 0.00 0.00 0.00 23.12 21.44 1i2v s ALA 11 CO 0.00 -1.03 1.08 0.08 0.00 0.00 0.00 175.76 175.90 1i2v s VAL 12 N -2.83 2.55 -0.22 0.00 1.01 -1.26 -3.74 120.40 115.92 1i2v s VAL 12 Ca 0.63 0.02 -0.00 0.00 0.00 0.00 0.00 61.98 62.62 1i2v s VAL 12 Cb -0.06 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.17 1i2v s VAL 12 CO 0.40 -0.17 0.01 0.59 0.00 0.00 0.00 175.10 175.92 1i2v n ASN 13 N -3.06 -1.58 -4.65 3.32 4.13 -1.26 -4.49 115.26 107.67 1i2v n ASN 13 Ca 0.07 0.43 -0.43 0.00 1.68 0.00 0.00 54.58 56.33 1i2v n ASN 13 Cb 0.60 -1.46 -0.01 0.00 -1.54 0.00 0.00 39.78 37.37 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 -2.69 1.79 0.00 3.10 9.36 -1.24 -1.31 117.16 126.17 1i2v n TYR 14 Ca -0.03 0.60 0.00 0.00 3.32 0.00 0.00 57.90 61.79 1i2v n TYR 14 Cb 0.52 -2.33 0.00 0.00 -0.63 0.00 0.00 39.34 36.90 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 0.16 0.00 0.00 2.97 -1.04 0.40 -4.77 114.28 112.00 1i2v n THR 15 Ca 0.07 0.29 0.00 0.00 -2.04 0.00 0.00 64.05 62.37 1i2v n THR 15 Cb 0.35 -1.03 0.00 0.00 -1.82 0.00 0.00 70.33 67.83 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 -1.64 0.00 -3.28 8.00 2.88 -1.26 -4.74 113.62 113.58 1i2v n SER 16 Ca 0.00 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.29 1i2v n SER 16 Cb 0.00 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.38 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 1.31 0.30 0.00 -3.46 5.75 -1.26 -5.02 116.55 114.17 1i2v n ASP 17 Ca 0.00 -2.67 0.00 0.00 -0.01 0.00 0.00 54.79 52.11 1i2v n ASP 17 Cb 0.00 -0.62 0.00 0.00 -1.03 0.00 0.00 41.12 39.47 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 -2.34 0.09 0.21 0.00 5.15 -1.26 0.27 115.26 117.37 1i2v n ASN 19 Ca 0.00 1.12 -0.09 0.00 -0.60 0.00 0.00 54.58 55.01 1i2v n ASN 19 Cb 0.00 -0.55 -0.04 0.00 -0.53 0.00 0.00 39.78 38.65 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 -0.62 0.97 8.20 0.00 0.75 0.16 103.07 112.53 1i2v h GLY 20 Ca 0.88 0.23 0.13 0.00 0.00 0.00 0.00 47.33 48.57 1i2v h GLY 20 CO -0.20 -0.23 0.40 -2.09 0.00 0.00 0.00 176.54 174.42 1i2v h GLU 21 N -1.14 0.22 -0.00 4.80 4.57 0.44 0.46 114.58 123.93 1i2v h GLU 21 Ca -0.06 -0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 57.97 1i2v h GLU 21 Cb 0.46 -0.05 0.01 0.00 -0.16 0.00 0.00 28.75 29.01 1i2v h GLU 21 CO 0.10 0.15 -0.53 0.00 -1.18 0.00 0.00 179.01 177.55 1i2v h LEU 23 N -0.18 0.17 -1.67 0.00 3.38 0.10 0.28 115.31 117.40 1i2v h LEU 23 Ca -0.06 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1i2v h LEU 23 Cb 1.25 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1i2v h LEU 23 CO 0.10 0.29 -0.02 -0.07 0.09 0.00 0.00 178.44 178.83 1i2v h LEU 24 N 0.18 0.16 -0.77 1.67 3.38 -0.09 -0.55 115.31 119.29 1i2v h LEU 24 Ca 0.04 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1i2v h LEU 24 Cb 0.27 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1i2v h LEU 24 CO 0.01 0.22 -0.28 0.54 0.09 0.00 0.00 178.44 179.02 1i2v n ARG 25 N -4.41 1.12 -0.89 1.13 1.74 -0.44 -4.92 116.66 109.98 1i2v n ARG 25 Ca -0.01 -0.77 0.00 0.00 -0.77 0.00 0.00 57.85 56.30 1i2v n ARG 25 Cb 0.17 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 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 1.35 0.52 3.88 -0.13 0.00 -0.22 -5.03 105.19 105.57 1i2v n GLY 26 Ca 0.12 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 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 3.44 0.69 1.61 2.02 0.86 -4.94 117.35 119.03 1i2v s TYR 27 Ca 0.00 1.07 -0.11 0.00 -0.37 0.00 0.00 57.07 57.66 1i2v s TYR 27 Cb 0.00 -2.85 0.01 0.00 -0.40 0.00 0.00 41.96 38.71 1i2v s TYR 27 CO 0.00 -0.90 1.08 0.15 -1.57 0.00 0.00 175.55 174.31 1i2v s LYS 28 N -5.21 2.97 -0.47 -0.62 3.01 -1.26 -4.04 119.74 114.12 1i2v s LYS 28 Ca 0.56 0.53 -0.22 0.00 -1.01 0.00 0.00 55.97 55.82 1i2v s LYS 28 Cb -0.11 -2.03 -0.13 0.00 -1.01 0.00 0.00 37.83 34.56 1i2v s LYS 28 CO 0.51 -0.97 1.48 0.41 0.51 0.00 0.00 175.35 177.29 1i2v n GLY 29 N -2.90 -0.20 0.00 -3.33 0.00 -1.26 -4.06 105.19 93.43 1i2v n GLY 29 Ca 0.07 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.78 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 4.21 0.78 3.82 -0.02 0.00 -1.26 -4.01 105.19 108.71 1i2v n GLY 30 Ca 0.37 -1.92 -0.05 0.00 0.00 0.00 0.00 46.02 44.42 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 -0.06 0.02 1.61 -3.43 -0.13 -4.54 115.29 109.42 1i2v s HIS 31 Ca 0.00 -0.38 -0.04 0.00 -0.80 0.00 0.00 55.06 53.84 1i2v s HIS 31 Cb 0.00 0.71 -0.04 0.00 -1.43 0.00 0.00 32.58 31.81 1i2v s HIS 31 CO 0.00 -1.10 0.24 0.00 -2.00 0.00 0.00 174.74 171.88 1i2v n GLY 33 N 0.86 0.21 0.91 0.00 0.00 0.94 -4.74 105.19 103.37 1i2v n GLY 33 Ca -0.10 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 -4.87 113.62 109.33 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 0.23 0.01 0.00 -0.75 0.00 0.00 64.21 63.70 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 -1.45 -0.64 0.00 0.66 5.36 -1.26 -4.98 117.98 115.66 1i2v s PHE 35 Ca 0.00 -0.04 0.00 0.00 -0.96 0.00 0.00 56.93 55.93 1i2v s PHE 35 Cb 0.00 0.12 0.00 0.00 -0.34 0.00 0.00 43.02 42.80 1i2v s PHE 35 CO 0.00 -0.47 0.00 0.00 -1.46 0.00 0.00 175.22 173.29 1i2v n ALA 36 N 3.33 -0.13 -2.32 11.12 0.00 -1.26 -5.10 120.51 126.15 1i2v n ALA 36 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1i2v n ALA 36 Cb 0.62 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.68 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 -0.91 0.26 -1.12 0.00 2.85 -1.26 -5.08 115.26 110.00 1i2v n ASN 37 Ca 0.00 0.00 -0.05 0.00 -0.11 0.00 0.00 54.58 54.42 1i2v n ASN 37 Cb 0.39 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.38 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 -3.98 3.44 0.24 -1.26 -5.01 118.33 111.75 1i2v n VAL 38 Ca 0.00 -0.12 -0.11 0.00 -2.04 0.00 0.00 64.34 62.07 1i2v n VAL 38 Cb 0.00 0.47 -0.03 0.00 -1.47 0.00 0.00 33.84 32.80 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 -0.79 0.27 0.08 -1.34 0.01 -1.26 -3.94 114.94 107.97 1i2v s ASN 39 Ca 0.01 -1.15 0.08 0.00 -0.71 0.00 0.00 52.86 51.09 1i2v s ASN 39 Cb 0.05 0.67 -0.03 0.00 0.41 0.00 0.00 41.25 42.36 1i2v s ASN 39 CO -0.02 -1.32 -0.22 0.00 -1.51 0.00 0.00 177.10 174.04 1i2v s TRP 41 N -0.98 0.25 0.44 0.00 0.52 -0.22 -3.26 118.94 115.68 1i2v s TRP 41 Ca 0.08 -0.69 0.01 0.00 0.02 0.00 0.00 56.10 55.52 1i2v s TRP 41 Cb -0.10 -0.12 0.09 0.00 -1.15 0.00 0.00 33.47 32.19 1i2v s TRP 41 CO 0.03 -0.53 0.60 0.00 0.02 0.00 0.00 176.95 177.07 1i2v n GLU 43 N -2.09 0.44 0.00 0.00 1.02 -1.26 -4.16 120.64 114.58 1i2v n GLU 43 Ca 0.10 -3.00 0.14 0.00 -0.02 0.00 0.00 57.16 54.38 1i2v n GLU 43 Cb 0.36 -1.48 0.50 0.00 -0.02 0.00 0.00 31.44 30.80 1i2v n GLU 43 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94